A0A096N7L7_PAPAN Loading...

Coronin

Regulates leading edge dynamics and cell motility in fibroblasts. May be involved in cytokinesis and signal transduction.

AlphaFold DB , UniProt , Accession A0A096N7L7, Species PAPAN (Papio anubis, Olive baboon), Gene CORO1B, Length 489 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	M	36.2	Very low	60.8	Low	233 Å²	233	146.5 Å²	146.5	100%	1.148	71%	0.711	S	S	*	*				0	107.3	0	-73.8	-166.2	-125.1	0	0	107.6	F3	M1-F3 PolarHBondContact O-N 3.3Å
2	S	41.8	Very low	63.5	Low	121 Å²	121	134.4 Å²	134.4	85%	0.846	65%	0.652	S	S	*	*			trans	-69.4	115.1	176.8	-177.2	0	0	0	0	108.1	R4	S2-R4 PolarHBondContact O-N 3.06Å
3	F	43.6	Very low	65.5	Low	198 Å²	198	133.2 Å²	133.2	87%	0.868	64%	0.636	S	S	*	*			trans	-58.9	112.9	171.3	-77.9	-90.1	0	0	0	107.5	M1 K5	M1-F3 PolarHBondContact O-N 3.3Å; F3-K5 PolarHBondContact O-N 3.37Å; F3-K5 VanDerWaalsContact O-N 3.11Å
4	R	46.7	Very low	67.5	Low	237 Å²	237	133.1 Å²	133.1	89%	0.894	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-48.9	119.4	172.7	-77.3	177.2	170.2	173.3	-3.5	108.1	S2 V6	S2-R4 PolarHBondContact O-N 3.06Å; R4-V6 PolarHBondContact O-N 3.11Å; R4-V6 VanDerWaalsContact O-N 3.1Å
5	K	48.8	Very low	69.4	Low	212 Å²	212	124.4 Å²	124.4	92%	0.922	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-50.9	119.7	177.6	-114.7	-178.2	176.7	-174.7	0	108.8	F3	F3-K5 PolarHBondContact O-N 3.37Å; F3-K5 VanDerWaalsContact O-N 3.11Å
6	V	54.1	Low	71	Confident	125 Å²	125	121.6 Å²	121.6	76%	0.758	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-46.2	132.9	173.5	177.3	0	0	0	0	109.1	R4 R8	R4-V6 PolarHBondContact O-N 3.11Å; R4-V6 VanDerWaalsContact O-N 3.1Å; V6-R8 PolarHBondContact O-N 3.11Å; V6-R8 VanDerWaalsContact O-N 3.16Å
7	V	63.1	Low	72.5	Confident	122 Å²	122	115.4 Å²	115.4	74%	0.739	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-46.6	123	174.8	175.9	0	0	0	0	109	Q9	V7-Q9 PolarHBondContact O-N 3.09Å; V7-Q9 VanDerWaalsContact O-N 3.15Å
8	R	74.6	Confident	73.8	Confident	73 Å²	73	115.4 Å²	115.4	28%	0.275	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-51.3	122.3	177.7	179.1	-179.2	171.6	-104.2	-24.9	108.9	V6 S10 E296	V6-R8 PolarHBondContact O-N 3.11Å; V6-R8 VanDerWaalsContact O-N 3.16Å; R8-S10 PolarHBondContact O-N 3.29Å; R8-E296 IonicContact CZ-OE2 3.27Å; R8-E296 VanDerWaalsContact CZ-OE2 3.24Å; R8-E296 IonicContact NH1-OE2 3.02Å; R8-E296 PolarHBondContact NH1-OE2 2.88Å; R8-E296 IonicContact NH2-OE1 2.77Å; R8-E296 PolarHBondContact NH2-OE1 2.9Å; R8-E296 IonicContact NH2-OE2 3.75Å; R8-E296 PolarHBondContact NH2-OE2 2.92Å
9	Q	80.9	Confident	75	Confident	182 Å²	182	112.3 Å²	112.3	85%	0.85	54%	0.543	S	S	*	.			trans	-81	99.1	176.9	-69.3	-171.7	-8.4	0	0	108.6	V7	V7-Q9 PolarHBondContact O-N 3.09Å; V7-Q9 VanDerWaalsContact O-N 3.15Å
10	S	88.5	Confident	76	Confident	18 Å²	18	107.9 Å²	107.9	13%	0.126	52%	0.523	C	S	.	.			trans	-106.8	130.1	170.3	167.7	0	0	0	0	109.5	R8 F12 R13 E296	R8-S10 PolarHBondContact O-N 3.29Å; S10-F12 PolarHBondContact O-N 3.33Å; S10-F12 PolarHBondContact OG-N 3.26Å; S10-F12 VanDerWaalsContact OG-N 3.07Å; S10-R13 WeakPolarHBondContact O-CB 3.32Å; S10-R13 PolarHBondContact O-N 3.36Å; S10-R13 PolarHBondContact OG-N 2.89Å; S10-E296 WeakPolarHBondContact CB-OE2 3.43Å; S10-E296 PolarHBondContact OG-OE2 3.49Å
11	K	90.1	Very high	76.9	Confident	91 Å²	91	109.9 Å²	109.9	40%	0.396	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-20.9	172	57	175.7	167.8	171	0	112.4	D362 L363	K11-D362 PolarHBondContact NZ-O 2.8Å; K11-L363 HydrophobicContact CD-CD2 4.28Å
12	F	92.9	Very high	79.5	Confident	1 Å²	1	104 Å²	104	0%	0.004	50%	0.503	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	2.1	-177.4	-54.8	-61.5	0	0	0	114	S10 H14 V15 T279 V281 E296 L307 I334 V352 L363	S10-F12 PolarHBondContact O-N 3.33Å; S10-F12 PolarHBondContact OG-N 3.26Å; S10-F12 VanDerWaalsContact OG-N 3.07Å; F12-H14 PolarHBondContact O-N 2.73Å; F12-V15 HydrophobicContact CB-CG2 3.87Å; F12-V15 HydrophobicContact CD1-CG2 4.1Å; F12-V15 HydrophobicContact CG-CG2 4.48Å; F12-V15 WeakPolarHBondContact O-CB 3.43Å; F12-V15 VanDerWaalsContact O-CG2 3.29Å; F12-V15 WeakPolarHBondContact O-CG2 3.48Å; F12-V15 PolarHBondContact O-N 2.71Å; F12-T279 HydrophobicContact CE1-CG2 3.86Å; F12-T279 HydrophobicContact CE2-CG2 4.49Å; F12-T279 VanDerWaalsContact CE2-O 3.25Å; F12-T279 WeakPolarHBondContact CE2-O 3.36Å; F12-T279 HydrophobicContact CZ-CG2 3.59Å; F12-V281 HydrophobicContact CB-CG2 4.46Å; F12-V281 HydrophobicContact CD2-CG2 3.89Å; F12-V281 HydrophobicContact CE2-CG2 4.24Å; F12-V281 HydrophobicContact CG-CG2 4.08Å; F12-E296 HydrophobicContact CD2-CG 4.36Å; F12-L307 HydrophobicContact CB-CD1 3.74Å; F12-L307 HydrophobicContact CB-CD2 4.28Å; F12-I334 HydrophobicContact CD1-CD1 4.17Å; F12-I334 HydrophobicContact CE1-CD1 4.45Å; F12-V352 HydrophobicContact CD1-CG2 3.91Å; F12-V352 HydrophobicContact CE1-CG2 4.22Å; F12-L363 HydrophobicContact CE1-CD2 3.84Å; F12-L363 HydrophobicContact CZ-CD2 4.48Å
13	R	90.7	Very high	81.8	Confident	118 Å²	118	103.2 Å²	103.2	45%	0.445	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-32.3	-178.1	179.2	59.6	-174.4	92.4	-7.1	114.1	S10	S10-R13 WeakPolarHBondContact O-CB 3.32Å; S10-R13 PolarHBondContact O-N 3.36Å; S10-R13 PolarHBondContact OG-N 2.89Å
14	H	92.8	Very high	84.2	Confident	133 Å²	133	98.2 Å²	98.2	62%	0.616	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	17.1	-175.9	-60.2	-63	0	0	0	113.2	F12 F16 P353	F12-H14 PolarHBondContact O-N 2.73Å; H14-F16 PolarHBondContact O-N 3.4Å; H14-P353 HydrophobicContact CB-CG 3.78Å; H14-P353 WeakPolarHBondContact O-CD 2.98Å; H14-P353 WeakPolarHBondContact O-CG 3.18Å
15	V	95.7	Very high	86.5	Confident	2 Å²	2	87 Å²	87	1%	0.012	43%	0.426	C	S	.	.			trans	-56.8	135.8	169	171	0	0	0	0	108.9	F12 Y294 I334 M350 T351 V352	F12-V15 HydrophobicContact CB-CG2 3.87Å; F12-V15 HydrophobicContact CD1-CG2 4.1Å; F12-V15 HydrophobicContact CG-CG2 4.48Å; F12-V15 WeakPolarHBondContact O-CB 3.43Å; F12-V15 VanDerWaalsContact O-CG2 3.29Å; F12-V15 WeakPolarHBondContact O-CG2 3.48Å; F12-V15 PolarHBondContact O-N 2.71Å; V15-Y294 HydrophobicContact CB-CE2 4.06Å; V15-Y294 HydrophobicContact CG1-CD2 4.41Å; V15-Y294 HydrophobicContact CG1-CE2 3.88Å; V15-Y294 PolarHBondContact O-OH 3.15Å; V15-Y294 VanDerWaalsContact O-OH 3.14Å; V15-I334 HydrophobicContact CG1-CD1 4.09Å; V15-I334 HydrophobicContact CG2-CD1 3.64Å; V15-M350 HydrophobicContact CG1-CB 4.4Å; V15-M350 HydrophobicContact CG1-CE 4.03Å; V15-T351 WeakPolarHBondContact CA-O 3.29Å; V15-V352 HydrophobicContact CG2-CG2 3.69Å
16	F	95.8	Very high	88.8	Confident	80 Å²	80	77.1 Å²	77.1	35%	0.351	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	147.4	174.5	67	-83.9	0	0	0	110.3	H14 Q18 T351 P353	H14-F16 PolarHBondContact O-N 3.4Å; F16-Q18 HydrophobicContact CE2-CB 4.33Å; F16-T351 HydrophobicContact CE1-CG2 4.37Å; F16-T351 HydrophobicContact CZ-CG2 4.3Å; F16-T351 PolarHBondContact N-O 3.4Å; F16-T351 PolarHBondContact O-N 3.04Å; F16-P353 HydrophobicContact CD1-CG 4.42Å; F16-P353 HydrophobicContact CE1-CB 4.04Å; F16-P353 HydrophobicContact CE1-CG 4.26Å
17	G	96.1	Very high	90.8	Very high	15 Å²	15	74.8 Å²	74.8	16%	0.155	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	134.3	173.9	0	0	0	0	0	110.8	F310 V349 M350	G17-F310 WeakPolarHBondContact O-CD2 3.31Å; G17-F310 WeakPolarHBondContact O-CE2 3.44Å; G17-V349 CarbonylContact C-O 3.58Å; G17-V349 WeakPolarHBondContact CA-O 3.37Å; G17-M350 WeakPolarHBondContact CA-SD 3.44Å
18	Q	96.6	Very high	92.3	Very high	117 Å²	117	71.5 Å²	71.5	55%	0.547	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	120.7	175	-176.7	169	5.4	0	0	109.6	F16 V349	F16-Q18 HydrophobicContact CE2-CB 4.33Å; Q18-V349 PolarHBondContact N-O 3.21Å; Q18-V349 PolarHBondContact O-N 3.32Å
19	P	96.3	Very high	93.3	Very high	56 Å²	56	68.2 Å²	68.2	36%	0.364	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	143	171.8	30	-33.3	0	0	0	109.2	E346	P19-E346 HydrophobicContact CB-CG 4.4Å
20	V	95.3	Very high	93.9	Very high	23 Å²	23	65.6 Å²	65.6	14%	0.139	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-67.5	166	173.1	-60.2	0	0	0	0	110.7	Q24 P347 V349	V20-Q24 HydrophobicContact CB-CB 3.98Å; V20-Q24 HydrophobicContact CG2-CB 3.8Å; V20-P347 HydrophobicContact CB-CB 4.44Å; V20-P347 HydrophobicContact CG1-CB 3.86Å; V20-P347 HydrophobicContact CG2-CB 3.73Å; V20-P347 HydrophobicContact CG2-CG 3.82Å; V20-P347 WeakPolarHBondContact CG2-O 3.19Å; V20-P347 PolarHBondContact N-O 2.66Å; V20-V349 HydrophobicContact CG1-CG2 3.92Å
21	K	94.2	Very high	94.3	Very high	150 Å²	150	64.9 Å²	64.9	65%	0.652	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-68.2	153.6	175	-64.5	177.7	-176.3	176.8	0	110.1	D23 Q24 C25	K21-D23 WeakPolarHBondContact CB-OD1 3.27Å; K21-D23 PolarHBondContact O-N 2.86Å; K21-D23 VanDerWaalsContact O-N 3.13Å; K21-Q24 WeakPolarHBondContact O-CA 3.06Å; K21-Q24 WeakPolarHBondContact O-CB 3.01Å; K21-Q24 PolarHBondContact O-N 3.27Å; K21-C25 PolarHBondContact O-N 3.02Å
22	N	90.4	Very high	94.5	Very high	111 Å²	111	60.9 Å²	60.9	59%	0.594	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-57.7	-31.1	-175.3	-66.8	-0.7	0	0	0	114.1	Q24 C25	N22-Q24 PolarHBondContact O-N 2.87Å; N22-C25 WeakPolarHBondContact O-CB 3.48Å; N22-C25 PolarHBondContact O-N 3.48Å; N22-C25 VanDerWaalsContact O-N 3.12Å
23	D	91.3	Very high	94.5	Very high	104 Å²	104	67.8 Å²	67.8	56%	0.556	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-66.8	-17.9	175.9	60.2	-32.7	0	0	0	113.6	K21 T68	K21-D23 WeakPolarHBondContact CB-OD1 3.27Å; K21-D23 PolarHBondContact O-N 2.86Å; K21-D23 VanDerWaalsContact O-N 3.13Å; D23-T68 WeakPolarHBondContact O-CB 3.45Å; D23-T68 PolarHBondContact O-OG1 2.8Å
24	Q	93.1	Very high	94.7	Very high	92 Å²	92	64 Å²	64	43%	0.43	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-100.3	-1.5	175.9	-59.5	178.8	-2.5	0	0	112.6	V20 K21 N22 T68	V20-Q24 HydrophobicContact CB-CB 3.98Å; V20-Q24 HydrophobicContact CG2-CB 3.8Å; K21-Q24 WeakPolarHBondContact O-CA 3.06Å; K21-Q24 WeakPolarHBondContact O-CB 3.01Å; K21-Q24 PolarHBondContact O-N 3.27Å; N22-Q24 PolarHBondContact O-N 2.87Å; Q24-T68 WeakPolarHBondContact O-CG2 3.32Å
25	C	95.9	Very high	94.7	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.007	32%	0.318	C	S	.	.	S	Bend	trans	-82.7	161.7	171.4	-64.7	0	0	0	0	110.5	K21 N22 G69	K21-C25 PolarHBondContact O-N 3.02Å; N22-C25 WeakPolarHBondContact O-CB 3.48Å; N22-C25 PolarHBondContact O-N 3.48Å; N22-C25 VanDerWaalsContact O-N 3.12Å; C25-G69 WeakPolarHBondContact O-CA 3.12Å; C25-G69 PolarHBondContact O-N 2.81Å
26	Y	97.4	Very high	94.6	Very high	5 Å²	5	66.5 Å²	66.5	2%	0.02	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	114.2	172.1	-47.8	-97.7	0	0	0	108.4	L48 L63 L65 K67 T68 Y338 K344 C345 P347	Y26-L48 HydrophobicContact CD1-CD2 4.11Å; Y26-L48 HydrophobicContact CD2-CD2 3.47Å; Y26-L48 VanDerWaalsContact CD2-CD2 3.47Å; Y26-L48 HydrophobicContact CE1-CD2 4.14Å; Y26-L48 HydrophobicContact CE2-CD2 3.52Å; Y26-L48 HydrophobicContact CG-CD2 3.8Å; Y26-L63 HydrophobicContact CD1-CD1 3.76Å; Y26-L63 HydrophobicContact CE1-CD1 4.45Å; Y26-L63 HydrophobicContact CG-CD1 4.35Å; Y26-L65 WeakPolarHBondContact OH-CA 3.27Å; Y26-L65 PolarHBondContact OH-O 3.2Å; Y26-K67 VanDerWaalsContact CD1-O 3.26Å; Y26-K67 WeakPolarHBondContact CD1-O 3.4Å; Y26-K67 WeakPolarHBondContact CE1-O 3.35Å; Y26-T68 HydrophobicContact CE1-CG2 3.95Å; Y26-Y338 HydrophobicContact CE2-CD1 4.21Å; Y26-Y338 AromaticContact CE2-CE1 3.87Å; Y26-Y338 HydrophobicContact CE2-CE1 3.87Å; Y26-K344 CarbonylContact O-C 3.52Å; Y26-K344 WeakPolarHBondContact O-CA 3.36Å; Y26-C345 HydrophobicContact CD2-CB 4.02Å; Y26-C345 HydrophobicContact CG-CB 4.49Å; Y26-C345 PolarHBondContact N-O 3.01Å; Y26-C345 PolarHBondContact O-N 3.04Å; Y26-P347 HydrophobicContact CE2-CG 4.08Å
27	E	96.1	Very high	94.3	Very high	76 Å²	76	65.7 Å²	65.7	36%	0.355	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	161	-172.7	-61.7	-174.1	175.2	0	0	112.1	I29 G69 I71	E27-I29 VanDerWaalsContact C-N 3.27Å; E27-I29 PolarHBondContact O-N 3.35Å; E27-G69 PolarHBondContact N-O 2.68Å; E27-I71 WeakPolarHBondContact O-CB 3.42Å; E27-I71 PolarHBondContact O-N 3.24Å
28	D	94.8	Very high	94.1	Very high	54 Å²	54	65.4 Å²	65.4	29%	0.289	32%	0.321	S	S	.	.	S	Bend	trans	63.4	22.9	-178.7	-86.3	-12.1	0	0	0	115.1	R70 R343	D28-R70 HydrophobicContact CB-CG 4.22Å; D28-R70 IonicContact OD2-CZ 3.32Å; D28-R70 VanDerWaalsContact OD2-CZ 3.32Å; D28-R70 IonicContact OD2-NE 3.49Å; D28-R70 PolarHBondContact OD2-NE 3.03Å; D28-R70 IonicContact OD2-NH2 2.99Å; D28-R70 PolarHBondContact OD2-NH2 3.45Å; D28-R343 PolarHBondContact N-O 3.1Å
29	I	94.9	Very high	94	Very high	4 Å²	4	61.3 Å²	61.3	2%	0.021	30%	0.304	C	S	.	.			trans	-83.5	120.9	173.8	-58.5	175.9	0	0	0	110.5	E27 V31 V50 V52 L61 L63 I71 R343 C345	E27-I29 VanDerWaalsContact C-N 3.27Å; E27-I29 PolarHBondContact O-N 3.35Å; I29-V31 HydrophobicContact CG2-CG2 4.22Å; I29-V31 PolarHBondContact O-N 2.98Å; I29-V31 VanDerWaalsContact O-N 3.08Å; I29-V50 HydrophobicContact CG2-CB 4.48Å; I29-V50 HydrophobicContact CG2-CG1 4.03Å; I29-V52 HydrophobicContact CG2-CG1 3.87Å; I29-L61 HydrophobicContact CD1-CD2 4Å; I29-L61 HydrophobicContact CG1-CD2 3.9Å; I29-L61 HydrophobicContact CG2-CD2 3.96Å; I29-L63 HydrophobicContact CD1-CD1 4.01Å; I29-I71 HydrophobicContact CD1-CG1 4.46Å; I29-I71 HydrophobicContact CG1-CB 4.5Å; I29-I71 HydrophobicContact CG1-CG1 4.13Å; I29-R343 PolarHBondContact N-O 3.11Å; I29-R343 VanDerWaalsContact N-O 3.15Å; I29-R343 CarbonylContact O-C 3.6Å; I29-R343 WeakPolarHBondContact O-CA 3.4Å; I29-C345 HydrophobicContact CD1-CB 4.24Å
30	R	93.9	Very high	94	Very high	127 Å²	127	58.9 Å²	58.9	48%	0.479	29%	0.288	S	S	.	.			trans	-81.5	84	175.4	-66.7	-176.6	-67.7	-153	-4.6	111.5	V52 E53	R30-V52 CarbonylContact O-C 3.49Å; R30-V52 WeakPolarHBondContact O-CA 3.41Å; R30-V52 VanDerWaalsContact O-CB 3.23Å; R30-V52 WeakPolarHBondContact O-CB 3.47Å; R30-V52 WeakPolarHBondContact O-CG1 3.37Å; R30-E53 PolarHBondContact O-N 3.4Å
31	V	95.8	Very high	94.1	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.012	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-62.9	137.1	179.1	-179.9	0	0	0	0	110.7	I29 V50 R317 L340 H341	I29-V31 HydrophobicContact CG2-CG2 4.22Å; I29-V31 PolarHBondContact O-N 2.98Å; I29-V31 VanDerWaalsContact O-N 3.08Å; V31-V50 HydrophobicContact CG2-CG1 4.12Å; V31-R317 HydrophobicContact CG1-CB 4.3Å; V31-L340 HydrophobicContact CG1-CB 4.35Å; V31-L340 HydrophobicContact CG1-CD1 3.89Å; V31-L340 HydrophobicContact CG2-CB 4.31Å; V31-L340 HydrophobicContact CG2-CD1 4.38Å; V31-L340 HydrophobicContact CG2-CD2 4.44Å; V31-H341 WeakPolarHBondContact CG2-O 3.42Å
32	S	95.2	Very high	94.3	Very high	8 Å²	8	51.2 Å²	51.2	6%	0.056	25%	0.254	C	S	.	.			trans	-51.7	141	179.1	-179.3	0	0	0	0	113.1	V34 I51	S32-V34 WeakPolarHBondContact OG-CG2 3.47Å; S32-V34 PolarHBondContact OG-N 3.36Å; S32-I51 PolarHBondContact N-O 2.67Å
33	R	93.3	Very high	94.7	Very high	145 Å²	145	46.2 Å²	46.2	55%	0.547	23%	0.228	S	C	.	.			trans	-100.5	3.2	174.3	-74.2	177.5	-162.8	-171.7	-12	113.4	T35 E53 R317 E342	R33-T35 PolarHBondContact O-N 3.05Å; R33-E53 WeakPolarHBondContact CD-OE1 3.12Å; R33-E53 WeakPolarHBondContact CG-OE1 3.28Å; R33-E53 IonicContact CZ-OE1 3.65Å; R33-E53 IonicContact NE-OE1 2.84Å; R33-E53 PolarHBondContact NE-OE1 3.23Å; R33-R317 VanDerWaalsContact CG-NH1 3.29Å; R33-E342 IonicContact CZ-OE1 3.66Å; R33-E342 IonicContact NE-OE1 3.91Å; R33-E342 IonicContact NH2-OE1 2.8Å; R33-E342 PolarHBondContact NH2-OE1 2.72Å
34	V	93.7	Very high	95	Very high	40 Å²	40	41.4 Å²	41.4	24%	0.242	20%	0.202	C	C	.	.			trans	-57.8	134.2	177.7	176.2	0	0	0	0	109.1	S32 W36 F40 P84 L86	S32-V34 WeakPolarHBondContact OG-CG2 3.47Å; S32-V34 PolarHBondContact OG-N 3.36Å; V34-W36 HydrophobicContact CG1-CB 4.26Å; V34-W36 PolarHBondContact O-N 3.25Å; V34-W36 VanDerWaalsContact O-N 3.09Å; V34-F40 HydrophobicContact CB-CZ 4.33Å; V34-F40 WeakPolarHBondContact O-CE2 3.44Å; V34-F40 WeakPolarHBondContact O-CZ 3.4Å; V34-P84 HydrophobicContact CG2-CB 3.92Å; V34-P84 HydrophobicContact CG2-CG 4.43Å; V34-L86 HydrophobicContact CG1-CD2 3.81Å
35	T	92.3	Very high	95.1	Very high	138 Å²	138	38.7 Å²	38.7	85%	0.847	19%	0.193	S	C	*	.			trans	-81.5	88.2	176.6	51.2	0	0	0	0	109.2	R33	R33-T35 PolarHBondContact O-N 3.05Å
36	W	94.1	Very high	95	Very high	49 Å²	49	42.1 Å²	42.1	19%	0.186	21%	0.208	C	C	.	.			trans	-141.8	148.1	176.8	-163.3	-109.2	0	0	0	109.8	V34 F40 L86 G136 C153 K287	V34-W36 HydrophobicContact CG1-CB 4.26Å; V34-W36 PolarHBondContact O-N 3.25Å; V34-W36 VanDerWaalsContact O-N 3.09Å; W36-F40 HydrophobicContact CB-CE1 3.96Å; W36-F40 HydrophobicContact CB-CZ 4.05Å; W36-L86 HydrophobicContact CB-CD2 4.22Å; W36-L86 HydrophobicContact CD2-CD1 4.24Å; W36-L86 HydrophobicContact CD2-CD2 4.19Å; W36-L86 HydrophobicContact CE3-CD1 4.42Å; W36-L86 HydrophobicContact CE3-CD2 4.49Å; W36-L86 HydrophobicContact CG-CB 4.31Å; W36-L86 HydrophobicContact CG-CD2 4.06Å; W36-L86 HydrophobicContact CZ2-CD1 4.43Å; W36-G136 PolarHBondContact NE1-O 2.83Å; W36-C153 VanDerWaalsContact CH2-SG 3.55Å; W36-K287 PolarHBondContact O-NZ 2.84Å
37	D	89.1	Confident	95.1	Very high	62 Å²	62	42 Å²	42	33%	0.332	21%	0.207	S	C	.	.			trans	-95.8	15.6	-171.2	-69.9	-33.5	0	0	0	113.8	R225 L272	D37-R225 VanDerWaalsContact C-NH2 3.31Å; D37-R225 PolarHBondContact O-NH2 3.48Å; D37-L272 WeakPolarHBondContact O-CD2 3.21Å
38	S	92.6	Very high	95.1	Very high	10 Å²	10	38.3 Å²	38.3	7%	0.07	19%	0.19	C	C	.	.	S	Bend	trans	-73.4	173.4	170.3	67.3	0	0	0	0	111.8	F40 L86 D87 K287	S38-F40 VanDerWaalsContact C-N 3.32Å; S38-F40 PolarHBondContact O-N 3.23Å; S38-F40 WeakPolarHBondContact OG-CD1 3.37Å; S38-F40 VanDerWaalsContact OG-CE1 3.28Å; S38-F40 WeakPolarHBondContact OG-CE1 3.38Å; S38-L86 WeakPolarHBondContact CB-O 3.44Å; S38-L86 PolarHBondContact OG-O 2.97Å; S38-D87 WeakPolarHBondContact CB-OD1 3.48Å; S38-K287 WeakPolarHBondContact O-CE 3.25Å; S38-K287 PolarHBondContact O-NZ 2.91Å
39	T	94.4	Very high	95.3	Very high	31 Å²	31	35.8 Å²	35.8	19%	0.19	18%	0.176	C	C	.	.			trans	-70.1	-24.3	-177.3	54.1	0	0	0	0	114.3	C41 L272 F274 G318 M319	T39-C41 PolarHBondContact O-N 3.27Å; T39-C41 VanDerWaalsContact O-N 3.07Å; T39-C41 PolarHBondContact OG1-O 3.49Å; T39-L272 HydrophobicContact CG2-CD1 4.32Å; T39-F274 HydrophobicContact CG2-CE1 4.03Å; T39-F274 HydrophobicContact CG2-CZ 3.84Å; T39-G318 CarbonylContact O-C 3.56Å; T39-G318 WeakPolarHBondContact O-CA 3.18Å; T39-M319 WeakPolarHBondContact CB-O 3.3Å; T39-M319 PolarHBondContact O-N 2.92Å
40	F	96.9	Very high	95.5	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.018	18%	0.176	C	C	.	.	S	Bend	trans	59.4	2.3	-171	-71	-0.4	0	0	0	115.6	V34 W36 S38 I51 K287 L340	V34-F40 HydrophobicContact CB-CZ 4.33Å; V34-F40 WeakPolarHBondContact O-CE2 3.44Å; V34-F40 WeakPolarHBondContact O-CZ 3.4Å; W36-F40 HydrophobicContact CB-CE1 3.96Å; W36-F40 HydrophobicContact CB-CZ 4.05Å; S38-F40 VanDerWaalsContact C-N 3.32Å; S38-F40 PolarHBondContact O-N 3.23Å; S38-F40 WeakPolarHBondContact OG-CD1 3.37Å; S38-F40 VanDerWaalsContact OG-CE1 3.28Å; S38-F40 WeakPolarHBondContact OG-CE1 3.38Å; F40-I51 HydrophobicContact CB-CB 4.46Å; F40-I51 HydrophobicContact CD1-CD1 3.9Å; F40-I51 PolarHBondContact O-N 3.4Å; F40-K287 VanDerWaalsContact CD1-NZ 3.35Å; F40-K287 VanDerWaalsContact CD2-NZ 3.35Å; F40-K287 VanDerWaalsContact CE1-NZ 3.33Å; F40-K287 VanDerWaalsContact CE2-NZ 3.32Å; F40-K287 VanDerWaalsContact CZ-NZ 3.31Å; F40-L340 HydrophobicContact CB-CD1 3.92Å
41	C	97.8	Very high	95.6	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.02	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	122.8	-171.9	-168.6	0	0	0	0	108.1	T39 A49 G320 L340	T39-C41 PolarHBondContact O-N 3.27Å; T39-C41 VanDerWaalsContact O-N 3.07Å; T39-C41 PolarHBondContact OG1-O 3.49Å; C41-A49 WeakPolarHBondContact CA-O 3.27Å; C41-G320 WeakPolarHBondContact O-CA 3.5Å; C41-L340 HydrophobicContact CB-CD1 3.7Å; C41-L340 HydrophobicContact CB-CD2 4.29Å; C41-L340 HydrophobicContact CB-CG 3.89Å
42	A	98.3	Very high	95.6	Very high	9 Å²	9	30.4 Å²	30.4	7%	0.074	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	135.3	173.4	0	0	0	0	0	107.9	A49 I88 W90	A42-A49 PolarHBondContact N-O 2.71Å; A42-A49 WeakPolarHBondContact O-CA 3.39Å; A42-A49 WeakPolarHBondContact O-CB 3.4Å; A42-A49 PolarHBondContact O-N 3.22Å; A42-I88 HydrophobicContact CB-CD1 4.06Å; A42-I88 HydrophobicContact CB-CG1 3.92Å; A42-I88 WeakPolarHBondContact CB-O 3.35Å; A42-W90 VanDerWaalsContact C-CD1 3.48Å; A42-W90 VanDerWaalsContact C-NE1 3.27Å; A42-W90 PolarHBondContact O-NE1 3.29Å
43	V	98	Very high	95.5	Very high	7 Å²	7	33.4 Å²	33.4	4%	0.042	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	144	-175.9	60.2	0	0	0	0	109.3	F47 L48 L65 S321 M322 P323 Y338	V43-F47 WeakPolarHBondContact CA-O 3.41Å; V43-F47 WeakPolarHBondContact CG2-O 3.29Å; V43-L48 HydrophobicContact CB-CD1 4.22Å; V43-L48 HydrophobicContact CG2-CD1 4.43Å; V43-L65 HydrophobicContact CG2-CD2 3.93Å; V43-S321 WeakPolarHBondContact CG1-O 3.47Å; V43-M322 HydrophobicContact CG1-CB 4.44Å; V43-M322 HydrophobicContact CG2-CE 3.39Å; V43-M322 HydrophobicContact CG2-SD 4.19Å; V43-P323 WeakPolarHBondContact O-CD 3.18Å; V43-Y338 HydrophobicContact CB-CD2 4.26Å; V43-Y338 HydrophobicContact CB-CE2 4.46Å; V43-Y338 HydrophobicContact CG1-CD2 3.77Å; V43-Y338 HydrophobicContact CG1-CE2 4.14Å; V43-Y338 HydrophobicContact CG1-CG 4.35Å; V43-Y338 HydrophobicContact CG2-CD2 4.08Å; V43-Y338 HydrophobicContact CG2-CE1 4.25Å; V43-Y338 HydrophobicContact CG2-CE2 3.81Å; V43-Y338 HydrophobicContact CG2-CG 4.44Å
44	N	96.9	Very high	95.2	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.011	16%	0.162	C	C	.	.			trans	-133.3	-178.5	172.2	76.2	11.3	0	0	0	109.3	K46 F47 W90 D95	N44-K46 PolarHBondContact O-N 3.11Å; N44-K46 VanDerWaalsContact O-N 3.11Å; N44-K46 PolarHBondContact OD1-N 3.09Å; N44-F47 PolarHBondContact N-O 3.07Å; N44-F47 PolarHBondContact OD1-N 3Å; N44-F47 PolarHBondContact OD1-O 2.86Å; N44-W90 HydrophobicContact CB-CB 4.23Å; N44-W90 HydrophobicContact CB-CD2 4.29Å; N44-W90 HydrophobicContact CB-CG 3.95Å; N44-W90 VanDerWaalsContact ND2-CD2 3.29Å; N44-D95 VanDerWaalsContact ND2-C 3.34Å; N44-D95 VanDerWaalsContact ND2-CA 3.33Å; N44-D95 WeakPolarHBondContact ND2-CA 3.19Å; N44-D95 PolarHBondContact ND2-O 3.43Å
45	P	95.3	Very high	94.3	Very high	35 Å²	35	33.6 Å²	33.6	23%	0.227	20%	0.199	C	C	.	.	S	Bend	trans	-62.8	-15.3	-177.6	-27.3	38.5	0	0	0	116	L65 R325	P45-L65 VanDerWaalsContact O-CD1 3.26Å; P45-L65 WeakPolarHBondContact O-CD1 3.31Å; P45-R325 HydrophobicContact CG-CB 3.75Å
46	K	95.3	Very high	93.7	Very high	74 Å²	74	30.3 Å²	30.3	32%	0.322	19%	0.192	S	C	.	.	S	Bend	trans	-106.1	-39.8	-179.7	-68.7	-167.4	-179.5	-168.2	0	113.1	N44 L65 D95 E96	N44-K46 PolarHBondContact O-N 3.11Å; N44-K46 VanDerWaalsContact O-N 3.11Å; N44-K46 PolarHBondContact OD1-N 3.09Å; K46-L65 PolarHBondContact O-N 3.46Å; K46-D95 HydrophobicContact CD-CB 4.06Å; K46-D95 HydrophobicContact CG-CB 4.13Å; K46-E96 HydrophobicContact CD-CG 4.47Å; K46-E96 IonicContact NZ-OE1 3.36Å; K46-E96 PolarHBondContact NZ-OE1 3.35Å
47	F	97.7	Very high	93.5	Very high	1 Å²	1	29 Å²	29	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	148.7	-165.5	-54.4	-71.9	0	0	0	113.5	V43 N44 V62 L63 P64 W90 D95 E96 I112 P113 E114	V43-F47 WeakPolarHBondContact CA-O 3.41Å; V43-F47 WeakPolarHBondContact CG2-O 3.29Å; N44-F47 PolarHBondContact N-O 3.07Å; N44-F47 PolarHBondContact OD1-N 3Å; N44-F47 PolarHBondContact OD1-O 2.86Å; F47-V62 HydrophobicContact CB-CG1 3.91Å; F47-V62 HydrophobicContact CD1-CG1 4.13Å; F47-V62 HydrophobicContact CG-CG1 4.1Å; F47-L63 CarbonylContact C-O 3.53Å; F47-L63 VanDerWaalsContact CA-O 3.26Å; F47-L63 WeakPolarHBondContact CA-O 3.36Å; F47-P64 HydrophobicContact CD1-CG 4.42Å; F47-P64 HydrophobicContact CE1-CG 4.35Å; F47-W90 HydrophobicContact CB-CH2 3.54Å; F47-W90 HydrophobicContact CB-CZ2 3.45Å; F47-W90 VanDerWaalsContact CB-CZ2 3.45Å; F47-W90 AromaticContact CD2-CH2 3.76Å; F47-W90 HydrophobicContact CD2-CH2 3.76Å; F47-W90 HydrophobicContact CD2-CZ2 4.47Å; F47-W90 HydrophobicContact CD2-CZ3 4.06Å; F47-W90 AromaticContact CG-CH2 3.91Å; F47-W90 HydrophobicContact CG-CH2 3.91Å; F47-W90 HydrophobicContact CG-CZ2 4.33Å; F47-D95 VanDerWaalsContact CD2-O 3.3Å; F47-D95 WeakPolarHBondContact CD2-O 3.29Å; F47-D95 WeakPolarHBondContact CE2-O 3.47Å; F47-E96 HydrophobicContact CE2-CG 4Å; F47-I112 HydrophobicContact CD1-CG2 4.32Å; F47-I112 HydrophobicContact CD2-CG2 4.41Å; F47-I112 HydrophobicContact CE1-CG2 4.03Å; F47-I112 HydrophobicContact CE2-CB 4.47Å; F47-I112 HydrophobicContact CE2-CG2 4.13Å; F47-I112 HydrophobicContact CZ-CG2 3.93Å; F47-P113 WeakPolarHBondContact CZ-O 3.42Å; F47-E114 WeakPolarHBondContact CZ-O 3.42Å
48	L	97.9	Very high	93.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	123.6	165	170	64.4	0	0	0	108.7	Y26 V43 V50 V62 L63 L65 Y338 C345	Y26-L48 HydrophobicContact CD1-CD2 4.11Å; Y26-L48 HydrophobicContact CD2-CD2 3.47Å; Y26-L48 VanDerWaalsContact CD2-CD2 3.47Å; Y26-L48 HydrophobicContact CE1-CD2 4.14Å; Y26-L48 HydrophobicContact CE2-CD2 3.52Å; Y26-L48 HydrophobicContact CG-CD2 3.8Å; V43-L48 HydrophobicContact CB-CD1 4.22Å; V43-L48 HydrophobicContact CG2-CD1 4.43Å; L48-V50 HydrophobicContact CD1-CG2 4.02Å; L48-V50 HydrophobicContact CD2-CG2 4.28Å; L48-V50 HydrophobicContact CG-CG2 3.96Å; L48-V62 CarbonylContact O-C 3.59Å; L48-V62 WeakPolarHBondContact O-CA 3.25Å; L48-L63 PolarHBondContact N-O 3.23Å; L48-L63 PolarHBondContact O-N 3.18Å; L48-L65 HydrophobicContact CB-CD2 4.11Å; L48-Y338 HydrophobicContact CD1-CD1 3.72Å; L48-Y338 HydrophobicContact CD1-CE1 4.38Å; L48-Y338 HydrophobicContact CD1-CG 4.18Å; L48-Y338 HydrophobicContact CD2-CD1 4.1Å; L48-Y338 HydrophobicContact CD2-CE1 4.47Å; L48-Y338 HydrophobicContact CG-CD1 4.43Å; L48-C345 HydrophobicContact CD2-CB 4.2Å
49	A	98.3	Very high	93.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.1	172.1	0	0	0	0	0	111.4	C41 A42 F60 L61 V62 I88 W90 I98	C41-A49 WeakPolarHBondContact CA-O 3.27Å; A42-A49 PolarHBondContact N-O 2.71Å; A42-A49 WeakPolarHBondContact O-CA 3.39Å; A42-A49 WeakPolarHBondContact O-CB 3.4Å; A42-A49 PolarHBondContact O-N 3.22Å; A49-F60 HydrophobicContact CB-CD2 4.45Å; A49-L61 CarbonylContact C-O 3.47Å; A49-L61 WeakPolarHBondContact CA-O 3.32Å; A49-V62 HydrophobicContact CB-CG2 4.2Å; A49-I88 HydrophobicContact CB-CD1 3.77Å; A49-W90 HydrophobicContact CB-CZ2 3.73Å; A49-I98 HydrophobicContact CB-CD1 3.5Å; A49-I98 VanDerWaalsContact CB-CD1 3.5Å
50	V	98.1	Very high	94	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	128.2	-178.2	-179.3	0	0	0	0	110	I29 V31 L48 V52 F60 L61 L340	I29-V50 HydrophobicContact CG2-CB 4.48Å; I29-V50 HydrophobicContact CG2-CG1 4.03Å; V31-V50 HydrophobicContact CG2-CG1 4.12Å; L48-V50 HydrophobicContact CD1-CG2 4.02Å; L48-V50 HydrophobicContact CD2-CG2 4.28Å; L48-V50 HydrophobicContact CG-CG2 3.96Å; V50-V52 HydrophobicContact CG1-CG1 4.44Å; V50-V52 PolarHBondContact O-N 3.27Å; V50-F60 CarbonylContact O-C 3.6Å; V50-F60 WeakPolarHBondContact O-CA 3.39Å; V50-F60 WeakPolarHBondContact O-CB 3.42Å; V50-L61 PolarHBondContact N-O 3.28Å; V50-L61 PolarHBondContact O-N 3.02Å; V50-L340 HydrophobicContact CG1-CD1 3.82Å; V50-L340 HydrophobicContact CG1-CD2 3.96Å; V50-L340 HydrophobicContact CG2-CD2 3.94Å
51	I	97.8	Very high	94	Very high	2 Å²	2	25 Å²	25	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	122.5	173.6	-54.6	-177.6	0	0	0	109	S32 F40 V85 I88	S32-I51 PolarHBondContact N-O 2.67Å; F40-I51 HydrophobicContact CB-CB 4.46Å; F40-I51 HydrophobicContact CD1-CD1 3.9Å; F40-I51 PolarHBondContact O-N 3.4Å; I51-V85 HydrophobicContact CD1-CG1 4Å; I51-V85 HydrophobicContact CG1-CG1 4.3Å; I51-V85 HydrophobicContact CG2-CB 4.12Å; I51-V85 WeakPolarHBondContact CG2-O 3.45Å; I51-I88 HydrophobicContact CD1-CG1 4.12Å; I51-I88 HydrophobicContact CD1-CG2 4.28Å; I51-I88 HydrophobicContact CG1-CD1 3.75Å; I51-I88 HydrophobicContact CG1-CG1 3.86Å; I51-I88 HydrophobicContact CG1-CG2 4.07Å
52	V	95.6	Very high	94	Very high	18 Å²	18	24.9 Å²	24.9	11%	0.109	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	160.8	-175	-65.7	0	0	0	0	112.1	I29 R30 V50 A54 A59 L61 T77	I29-V52 HydrophobicContact CG2-CG1 3.87Å; R30-V52 CarbonylContact O-C 3.49Å; R30-V52 WeakPolarHBondContact O-CA 3.41Å; R30-V52 VanDerWaalsContact O-CB 3.23Å; R30-V52 WeakPolarHBondContact O-CB 3.47Å; R30-V52 WeakPolarHBondContact O-CG1 3.37Å; V50-V52 HydrophobicContact CG1-CG1 4.44Å; V50-V52 PolarHBondContact O-N 3.27Å; V52-A54 PolarHBondContact O-N 3.45Å; V52-A59 HydrophobicContact CG2-CB 4.19Å; V52-A59 PolarHBondContact N-O 2.96Å; V52-L61 HydrophobicContact CG1-CB 3.77Å; V52-T77 HydrophobicContact CG2-CG2 4.24Å
53	E	91.5	Very high	94	Very high	70 Å²	70	24.5 Å²	24.5	33%	0.327	17%	0.169	S	C	.	.			trans	-66.5	127.7	170.7	-64.8	-178.8	157.1	0	0	110.9	R30 R33	R30-E53 PolarHBondContact O-N 3.4Å; R33-E53 WeakPolarHBondContact CD-OE1 3.12Å; R33-E53 WeakPolarHBondContact CG-OE1 3.28Å; R33-E53 IonicContact CZ-OE1 3.65Å; R33-E53 IonicContact NE-OE1 2.84Å; R33-E53 PolarHBondContact NE-OE1 3.23Å
54	A	87.1	Confident	93.9	Very high	45 Å²	45	25.1 Å²	25.1	37%	0.372	17%	0.174	S	C	.	.			trans	-115.6	139.2	170.5	0	0	0	0	0	109.9	V52 G56 A59	V52-A54 PolarHBondContact O-N 3.45Å; A54-G56 VanDerWaalsContact C-N 3.28Å; A54-G56 PolarHBondContact O-N 3.37Å; A54-A59 HydrophobicContact CB-CB 3.94Å
55	S	76.4	Confident	93.8	Very high	144 Å²	144	26.6 Å²	26.6	100%	1.007	18%	0.182	S	C	*	.	S	Bend	trans	-78	-11.3	180	49.9	0	0	0	0	113.9
56	G	78.2	Confident	93.7	Very high	69 Å²	69	30.2 Å²	30.2	71%	0.711	21%	0.208	S	C	*	.	S	Bend	trans	-167.5	115.3	174.9	0	0	0	0	0	109.6	A54	A54-G56 VanDerWaalsContact C-N 3.28Å; A54-G56 PolarHBondContact O-N 3.37Å
57	G	90	Very high	93.6	Very high	23 Å²	23	30.9 Å²	30.9	24%	0.237	21%	0.21	C	C	.	.	S	Bend	trans	94.1	-158.8	-172.2	0	0	0	0	0	113.8	H81 G83	G57-H81 WeakPolarHBondContact CA-O 2.88Å; G57-G83 CarbonylContact C-O 3.51Å
58	G	93.4	Very high	93.5	Very high	5 Å²	5	33.5 Å²	33.5	5%	0.052	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	137.9	176.6	0	0	0	0	0	111.7	H81 G83	G58-H81 PolarHBondContact N-O 2.88Å; G58-G83 WeakPolarHBondContact CA-O 3.46Å; G58-G83 PolarHBondContact N-O 3.38Å
59	A	96.3	Very high	93.4	Very high	8 Å²	8	34.3 Å²	34.3	7%	0.066	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	151.9	175.7	0	0	0	0	0	112.3	V52 A54 V78 C79	V52-A59 HydrophobicContact CG2-CB 4.19Å; V52-A59 PolarHBondContact N-O 2.96Å; A54-A59 HydrophobicContact CB-CB 3.94Å; A59-V78 WeakPolarHBondContact CA-O 3.3Å; A59-V78 WeakPolarHBondContact CB-O 3.43Å; A59-C79 HydrophobicContact CB-CB 4.24Å
60	F	97.7	Very high	93.2	Very high	1 Å²	1	43.1 Å²	43.1	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	150.2	167	64.2	-86.6	0	0	0	110.1	A49 V50 V62 T77 V78 V85 I88 I98 W110	A49-F60 HydrophobicContact CB-CD2 4.45Å; V50-F60 CarbonylContact O-C 3.6Å; V50-F60 WeakPolarHBondContact O-CA 3.39Å; V50-F60 WeakPolarHBondContact O-CB 3.42Å; F60-V62 HydrophobicContact CD2-CG2 3.68Å; F60-V62 HydrophobicContact CE2-CG2 3.51Å; F60-T77 WeakPolarHBondContact O-CB 3.36Å; F60-V78 HydrophobicContact CD1-CB 4Å; F60-V78 HydrophobicContact CD1-CG1 4.32Å; F60-V78 HydrophobicContact CD2-CB 4.13Å; F60-V78 HydrophobicContact CD2-CG2 4.14Å; F60-V78 HydrophobicContact CE1-CB 3.59Å; F60-V78 HydrophobicContact CE1-CG1 3.5Å; F60-V78 VanDerWaalsContact CE1-CG1 3.5Å; F60-V78 HydrophobicContact CE1-CG2 4.32Å; F60-V78 HydrophobicContact CE2-CB 3.73Å; F60-V78 HydrophobicContact CE2-CG1 4.21Å; F60-V78 HydrophobicContact CE2-CG2 3.55Å; F60-V78 HydrophobicContact CG-CB 4.26Å; F60-V78 HydrophobicContact CZ-CB 3.45Å; F60-V78 VanDerWaalsContact CZ-CB 3.45Å; F60-V78 HydrophobicContact CZ-CG1 3.44Å; F60-V78 VanDerWaalsContact CZ-CG1 3.44Å; F60-V78 HydrophobicContact CZ-CG2 3.67Å; F60-V78 PolarHBondContact N-O 3.35Å; F60-V78 VanDerWaalsContact N-O 3.13Å; F60-V78 PolarHBondContact O-N 3.18Å; F60-V85 HydrophobicContact CD1-CG2 4.33Å; F60-I88 HydrophobicContact CB-CG2 4.47Å; F60-I88 HydrophobicContact CD1-CG2 4.19Å; F60-I88 HydrophobicContact CD2-CG2 4.48Å; F60-I88 HydrophobicContact CG-CG2 4.15Å; F60-I98 HydrophobicContact CD2-CD1 4.5Å; F60-I98 HydrophobicContact CE2-CD1 3.95Å; F60-I98 HydrophobicContact CE2-CG2 3.96Å; F60-I98 HydrophobicContact CZ-CG2 3.98Å; F60-W110 AromaticContact CE1-NE1 3.74Å; F60-W110 AromaticContact CZ-CD1 3.69Å; F60-W110 HydrophobicContact CZ-CG 4.13Å; F60-W110 AromaticContact CZ-NE1 3.84Å
61	L	97.2	Very high	93.1	Very high	9 Å²	9	43.4 Å²	43.4	5%	0.047	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	137.6	-180	177.5	66	0	0	0	109	I29 A49 V50 V52 L63 Y75 T77	I29-L61 HydrophobicContact CD1-CD2 4Å; I29-L61 HydrophobicContact CG1-CD2 3.9Å; I29-L61 HydrophobicContact CG2-CD2 3.96Å; A49-L61 CarbonylContact C-O 3.47Å; A49-L61 WeakPolarHBondContact CA-O 3.32Å; V50-L61 PolarHBondContact N-O 3.28Å; V50-L61 PolarHBondContact O-N 3.02Å; V52-L61 HydrophobicContact CG1-CB 3.77Å; L61-L63 HydrophobicContact CD1-CD2 4.04Å; L61-L63 HydrophobicContact CD1-CG 4.31Å; L61-L63 HydrophobicContact CD2-CD1 3.77Å; L61-L63 HydrophobicContact CD2-CD2 4.25Å; L61-L63 HydrophobicContact CD2-CG 3.95Å; L61-L63 HydrophobicContact CG-CD1 4.28Å; L61-L63 HydrophobicContact CG-CD2 4.18Å; L61-L63 HydrophobicContact CG-CG 3.9Å; L61-Y75 HydrophobicContact CD1-CD1 3.33Å; L61-Y75 HydrophobicContact CD1-CE1 3.76Å; L61-Y75 HydrophobicContact CD1-CG 4.38Å; L61-T77 HydrophobicContact CD1-CG2 4.34Å
62	V	97.9	Very high	92.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	120.5	171.8	-176.6	0	0	0	0	109.6	F47 L48 A49 F60 Y75 V78 W90 I112 L117	F47-V62 HydrophobicContact CB-CG1 3.91Å; F47-V62 HydrophobicContact CD1-CG1 4.13Å; F47-V62 HydrophobicContact CG-CG1 4.1Å; L48-V62 CarbonylContact O-C 3.59Å; L48-V62 WeakPolarHBondContact O-CA 3.25Å; A49-V62 HydrophobicContact CB-CG2 4.2Å; F60-V62 HydrophobicContact CD2-CG2 3.68Å; F60-V62 HydrophobicContact CE2-CG2 3.51Å; V62-Y75 WeakPolarHBondContact O-CE1 3.24Å; V62-Y75 PolarHBondContact O-OH 3.16Å; V62-V78 HydrophobicContact CG2-CG2 3.91Å; V62-W90 HydrophobicContact CG1-CH2 3.82Å; V62-W90 HydrophobicContact CG1-CZ2 4.07Å; V62-I112 HydrophobicContact CG1-CD1 4.48Å; V62-I112 HydrophobicContact CG1-CG1 4.31Å; V62-I112 HydrophobicContact CG1-CG2 3.85Å; V62-I112 HydrophobicContact CG2-CD1 4.11Å; V62-L117 HydrophobicContact CB-CD1 4.24Å
63	L	96.9	Very high	92.5	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.5	-177.5	-62.1	171.3	0	0	0	109.9	Y26 I29 F47 L48 L61 K67 I71 Y75	Y26-L63 HydrophobicContact CD1-CD1 3.76Å; Y26-L63 HydrophobicContact CE1-CD1 4.45Å; Y26-L63 HydrophobicContact CG-CD1 4.35Å; I29-L63 HydrophobicContact CD1-CD1 4.01Å; F47-L63 CarbonylContact C-O 3.53Å; F47-L63 VanDerWaalsContact CA-O 3.26Å; F47-L63 WeakPolarHBondContact CA-O 3.36Å; L48-L63 PolarHBondContact N-O 3.23Å; L48-L63 PolarHBondContact O-N 3.18Å; L61-L63 HydrophobicContact CD1-CD2 4.04Å; L61-L63 HydrophobicContact CD1-CG 4.31Å; L61-L63 HydrophobicContact CD2-CD1 3.77Å; L61-L63 HydrophobicContact CD2-CD2 4.25Å; L61-L63 HydrophobicContact CD2-CG 3.95Å; L61-L63 HydrophobicContact CG-CD1 4.28Å; L61-L63 HydrophobicContact CG-CD2 4.18Å; L61-L63 HydrophobicContact CG-CG 3.9Å; L63-K67 HydrophobicContact CD2-CD 4.06Å; L63-I71 HydrophobicContact CD1-CD1 3.89Å; L63-I71 HydrophobicContact CD1-CG1 3.94Å; L63-I71 HydrophobicContact CD2-CD1 4.07Å; L63-I71 HydrophobicContact CD2-CG1 4.5Å; L63-I71 HydrophobicContact CD2-CG2 4.14Å; L63-Y75 HydrophobicContact CD2-CD1 3.95Å; L63-Y75 HydrophobicContact CD2-CE1 3.53Å; L63-Y75 HydrophobicContact CD2-CE2 4.26Å; L63-Y75 HydrophobicContact CD2-CG 4.44Å
64	P	96.6	Very high	92.5	Very high	21 Å²	21	55.6 Å²	55.6	14%	0.136	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	140.2	162	-22.9	34	0	0	0	110.2	F47 S66 K67	F47-P64 HydrophobicContact CD1-CG 4.42Å; F47-P64 HydrophobicContact CE1-CG 4.35Å; P64-S66 PolarHBondContact O-N 3.15Å; P64-S66 VanDerWaalsContact O-N 3.11Å; P64-K67 WeakPolarHBondContact O-CB 3.12Å; P64-K67 PolarHBondContact O-N 3.31Å
65	L	95.1	Very high	92.8	Very high	33 Å²	33	55 Å²	55	17%	0.173	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-31.3	-177.3	-70.2	-176.7	0	0	0	113.1	Y26 V43 P45 K46 L48 K67 M322 Y338	Y26-L65 WeakPolarHBondContact OH-CA 3.27Å; Y26-L65 PolarHBondContact OH-O 3.2Å; V43-L65 HydrophobicContact CG2-CD2 3.93Å; P45-L65 VanDerWaalsContact O-CD1 3.26Å; P45-L65 WeakPolarHBondContact O-CD1 3.31Å; K46-L65 PolarHBondContact O-N 3.46Å; L48-L65 HydrophobicContact CB-CD2 4.11Å; L65-K67 PolarHBondContact O-N 3.16Å; L65-M322 HydrophobicContact CD1-CE 3.68Å; L65-M322 HydrophobicContact CD2-CE 4.2Å; L65-Y338 HydrophobicContact CD2-CE1 4.2Å
66	S	93.1	Very high	93.7	Very high	111 Å²	111	49 Å²	49	78%	0.776	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-16.9	177.9	57.2	0	0	0	0	114.1	P64 T68	P64-S66 PolarHBondContact O-N 3.15Å; P64-S66 VanDerWaalsContact O-N 3.11Å; S66-T68 VanDerWaalsContact C-N 3.29Å; S66-T68 PolarHBondContact O-N 3.03Å
67	K	93.7	Very high	94.5	Very high	87 Å²	87	47.4 Å²	47.4	38%	0.378	26%	0.264	S	S	.	.			trans	-86.9	64.1	-177.1	-163.8	-173.1	174.9	89.4	0	111.4	Y26 L63 P64 L65 I71 Y75	Y26-K67 VanDerWaalsContact CD1-O 3.26Å; Y26-K67 WeakPolarHBondContact CD1-O 3.4Å; Y26-K67 WeakPolarHBondContact CE1-O 3.35Å; L63-K67 HydrophobicContact CD2-CD 4.06Å; P64-K67 WeakPolarHBondContact O-CB 3.12Å; P64-K67 PolarHBondContact O-N 3.31Å; L65-K67 PolarHBondContact O-N 3.16Å; K67-I71 HydrophobicContact CG-CD1 4.49Å; K67-Y75 HydrophobicContact CD-CD2 4.44Å; K67-Y75 HydrophobicContact CD-CE2 3.7Å
68	T	95.4	Very high	94.9	Very high	57 Å²	57	46.4 Å²	46.4	35%	0.35	25%	0.253	S	S	.	.			trans	-84.6	171.7	176.1	65.8	0	0	0	0	112.1	D23 Q24 Y26 S66	D23-T68 WeakPolarHBondContact O-CB 3.45Å; D23-T68 PolarHBondContact O-OG1 2.8Å; Q24-T68 WeakPolarHBondContact O-CG2 3.32Å; Y26-T68 HydrophobicContact CE1-CG2 3.95Å; S66-T68 VanDerWaalsContact C-N 3.29Å; S66-T68 PolarHBondContact O-N 3.03Å
69	G	94.8	Very high	94.8	Very high	16 Å²	16	48 Å²	48	17%	0.165	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	89.5	-153.5	-177.3	0	0	0	0	0	112.7	C25 E27 I71	C25-G69 WeakPolarHBondContact O-CA 3.12Å; C25-G69 PolarHBondContact O-N 2.81Å; E27-G69 PolarHBondContact N-O 2.68Å; G69-I71 PolarHBondContact O-N 2.66Å
70	R	95.4	Very high	94.6	Very high	186 Å²	186	48.9 Å²	48.9	70%	0.702	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	120.9	-176.3	-169.7	-178	-172.5	-165.3	3	111.4	D28	D28-R70 HydrophobicContact CB-CG 4.22Å; D28-R70 IonicContact OD2-CZ 3.32Å; D28-R70 VanDerWaalsContact OD2-CZ 3.32Å; D28-R70 IonicContact OD2-NE 3.49Å; D28-R70 PolarHBondContact OD2-NE 3.03Å; D28-R70 IonicContact OD2-NH2 2.99Å; D28-R70 PolarHBondContact OD2-NH2 3.45Å
71	I	94.9	Very high	94.6	Very high	7 Å²	7	49.2 Å²	49.2	4%	0.036	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-88.3	133.7	176.5	-51.4	-54.9	0	0	0	109.6	E27 I29 L63 K67 G69 Y75	E27-I71 WeakPolarHBondContact O-CB 3.42Å; E27-I71 PolarHBondContact O-N 3.24Å; I29-I71 HydrophobicContact CD1-CG1 4.46Å; I29-I71 HydrophobicContact CG1-CB 4.5Å; I29-I71 HydrophobicContact CG1-CG1 4.13Å; L63-I71 HydrophobicContact CD1-CD1 3.89Å; L63-I71 HydrophobicContact CD1-CG1 3.94Å; L63-I71 HydrophobicContact CD2-CD1 4.07Å; L63-I71 HydrophobicContact CD2-CG1 4.5Å; L63-I71 HydrophobicContact CD2-CG2 4.14Å; K67-I71 HydrophobicContact CG-CD1 4.49Å; G69-I71 PolarHBondContact O-N 2.66Å; I71-Y75 HydrophobicContact CG2-CG 4.11Å
72	D	92.6	Very high	94.6	Very high	112 Å²	112	54.5 Å²	54.5	60%	0.599	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-64.8	139.5	176.7	-162.5	-48	0	0	0	110.2	A74 Y75	D72-A74 PolarHBondContact O-N 2.95Å; D72-A74 PolarHBondContact OD1-N 3.38Å; D72-Y75 WeakPolarHBondContact O-CB 3.46Å; D72-Y75 PolarHBondContact O-N 2.92Å
73	K	88.3	Confident	94.5	Very high	149 Å²	149	55 Å²	55	65%	0.648	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.5	175.4	-65.5	-179.9	-178.6	176.4	0	112.8	Y75	K73-Y75 VanDerWaalsContact C-N 3.34Å
74	A	91	Very high	94.5	Very high	85 Å²	85	57 Å²	57	70%	0.702	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	5.5	176.8	0	0	0	0	0	112.9	D72	D72-A74 PolarHBondContact O-N 2.95Å; D72-A74 PolarHBondContact OD1-N 3.38Å
75	Y	94.2	Very high	94.6	Very high	32 Å²	32	56 Å²	56	13%	0.125	32%	0.318	C	S	.	.			trans	-60.1	134.1	177.3	-171.2	-85.9	0	0	0	110.2	L61 V62 L63 K67 I71 D72 K73	L61-Y75 HydrophobicContact CD1-CD1 3.33Å; L61-Y75 HydrophobicContact CD1-CE1 3.76Å; L61-Y75 HydrophobicContact CD1-CG 4.38Å; V62-Y75 WeakPolarHBondContact O-CE1 3.24Å; V62-Y75 PolarHBondContact O-OH 3.16Å; L63-Y75 HydrophobicContact CD2-CD1 3.95Å; L63-Y75 HydrophobicContact CD2-CE1 3.53Å; L63-Y75 HydrophobicContact CD2-CE2 4.26Å; L63-Y75 HydrophobicContact CD2-CG 4.44Å; K67-Y75 HydrophobicContact CD-CD2 4.44Å; K67-Y75 HydrophobicContact CD-CE2 3.7Å; I71-Y75 HydrophobicContact CG2-CG 4.11Å; D72-Y75 WeakPolarHBondContact O-CB 3.46Å; D72-Y75 PolarHBondContact O-N 2.92Å; K73-Y75 VanDerWaalsContact C-N 3.34Å
76	P	95.3	Very high	94.7	Very high	18 Å²	18	54.5 Å²	54.5	12%	0.117	31%	0.31	C	S	.	.			trans	-62.8	143	-175.2	24.2	-34.9	0	0	0	112.6	L117 S119 P120	P76-L117 HydrophobicContact CB-CB 4.02Å; P76-L117 HydrophobicContact CG-CB 3.65Å; P76-L117 VanDerWaalsContact CG-O 3.24Å; P76-L117 WeakPolarHBondContact CG-O 3.16Å; P76-L117 WeakPolarHBondContact O-CD1 3.35Å; P76-S119 WeakPolarHBondContact CB-O 3.31Å; P76-P120 HydrophobicContact CB-CG 4.3Å
77	T	95.8	Very high	94.9	Very high	36 Å²	36	50.1 Å²	50.1	22%	0.221	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	164.3	177	54.1	0	0	0	0	110.5	V52 F60 L61 P120 L121	V52-T77 HydrophobicContact CG2-CG2 4.24Å; F60-T77 WeakPolarHBondContact O-CB 3.36Å; L61-T77 HydrophobicContact CD1-CG2 4.34Å; T77-P120 VanDerWaalsContact O-CA 3.29Å; T77-P120 WeakPolarHBondContact O-CA 3.34Å; T77-L121 PolarHBondContact O-N 2.7Å
78	V	97.3	Very high	95.2	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	120.8	163.3	-173.3	0	0	0	0	107.7	A59 F60 V62 W110 I112 L117 L121	A59-V78 WeakPolarHBondContact CA-O 3.3Å; A59-V78 WeakPolarHBondContact CB-O 3.43Å; F60-V78 HydrophobicContact CD1-CB 4Å; F60-V78 HydrophobicContact CD1-CG1 4.32Å; F60-V78 HydrophobicContact CD2-CB 4.13Å; F60-V78 HydrophobicContact CD2-CG2 4.14Å; F60-V78 HydrophobicContact CE1-CB 3.59Å; F60-V78 HydrophobicContact CE1-CG1 3.5Å; F60-V78 VanDerWaalsContact CE1-CG1 3.5Å; F60-V78 HydrophobicContact CE1-CG2 4.32Å; F60-V78 HydrophobicContact CE2-CB 3.73Å; F60-V78 HydrophobicContact CE2-CG1 4.21Å; F60-V78 HydrophobicContact CE2-CG2 3.55Å; F60-V78 HydrophobicContact CG-CB 4.26Å; F60-V78 HydrophobicContact CZ-CB 3.45Å; F60-V78 VanDerWaalsContact CZ-CB 3.45Å; F60-V78 HydrophobicContact CZ-CG1 3.44Å; F60-V78 VanDerWaalsContact CZ-CG1 3.44Å; F60-V78 HydrophobicContact CZ-CG2 3.67Å; F60-V78 PolarHBondContact N-O 3.35Å; F60-V78 VanDerWaalsContact N-O 3.13Å; F60-V78 PolarHBondContact O-N 3.18Å; V62-V78 HydrophobicContact CG2-CG2 3.91Å; V78-W110 HydrophobicContact CG1-CD2 3.33Å; V78-W110 HydrophobicContact CG1-CE3 3.36Å; V78-W110 HydrophobicContact CG1-CG 3.93Å; V78-W110 HydrophobicContact CG1-CH2 3.89Å; V78-W110 HydrophobicContact CG1-CZ2 3.85Å; V78-W110 HydrophobicContact CG1-CZ3 3.64Å; V78-I112 HydrophobicContact CG2-CD1 4.08Å; V78-L117 HydrophobicContact CG2-CD1 3.9Å; V78-L121 CarbonylContact C-O 3.42Å; V78-L121 WeakPolarHBondContact CA-O 3.48Å; V78-L121 HydrophobicContact CG1-CB 4.36Å; V78-L121 HydrophobicContact CG1-CD2 4.33Å; V78-L121 HydrophobicContact CG1-CG 4.48Å; V78-L121 HydrophobicContact CG2-CB 4.26Å; V78-L121 HydrophobicContact CG2-CD2 4.23Å
79	C	91.9	Very high	95.3	Very high	40 Å²	40	46 Å²	46	27%	0.27	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	84	-170.7	52.8	0	0	0	0	111.2	A59 L121 T122	A59-C79 HydrophobicContact CB-CB 4.24Å; C79-L121 PolarHBondContact N-O 3.07Å; C79-T122 WeakPolarHBondContact O-CA 3.17Å; C79-T122 WeakPolarHBondContact O-CG2 3.39Å
80	G	92.1	Very high	95.5	Very high	25 Å²	25	45.9 Å²	45.9	26%	0.258	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	-11.3	166.1	0	0	0	0	0	114.2	T122	G80-T122 WeakPolarHBondContact CA-O 3.19Å
81	H	97.3	Very high	95.6	Very high	8 Å²	8	37.3 Å²	37.3	4%	0.037	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	141.3	175.1	-80.3	-64.2	0	0	0	112.3	G57 G58 V85 S100 S102 D104 T106 M108	G57-H81 WeakPolarHBondContact CA-O 2.88Å; G58-H81 PolarHBondContact N-O 2.88Å; H81-V85 HydrophobicContact CB-CG2 4.3Å; H81-S100 PolarHBondContact CD2-OG 3.43Å; H81-S100 PolarHBondContact NE2-O 2.62Å; H81-S100 PolarHBondContact NE2-OG 3.15Å; H81-S102 WeakPolarHBondContact CE1-CB 3.49Å; H81-S102 WeakPolarHBondContact ND1-CB 3.42Å; H81-S102 PolarHBondContact ND1-OG 2.98Å; H81-D104 VanDerWaalsContact CA-OD2 3.27Å; H81-D104 WeakPolarHBondContact CA-OD2 3.35Å; H81-D104 VanDerWaalsContact CB-OD2 3.28Å; H81-D104 WeakPolarHBondContact CB-OD2 3.18Å; H81-D104 IonicContact CE1-OD1 2.73Å; H81-D104 IonicContact CG-OD2 3.84Å; H81-D104 IonicContact ND1-OD1 3.78Å; H81-D104 PolarHBondContact ND1-OD1 3.2Å; H81-D104 IonicContact ND1-OD2 3.08Å; H81-D104 PolarHBondContact ND1-OD2 2.82Å; H81-T106 PolarHBondContact CE1-OG1 2.92Å; H81-T106 VanDerWaalsContact CE1-OG1 3.32Å; H81-T106 PolarHBondContact ND1-OG1 3.41Å; H81-M108 VanDerWaalsContact CE1-CG 3.46Å; H81-M108 WeakPolarHBondContact CE1-CG 3.46Å
82	T	96.4	Very high	95.7	Very high	120 Å²	120	39 Å²	39	74%	0.736	23%	0.232	S	C	*	.	S	Bend	trans	-92.5	-8.9	179.3	62.8	0	0	0	0	113	D104	T82-D104 PolarHBondContact N-OD2 2.87Å; T82-D104 WeakPolarHBondContact OG1-CB 3.23Å
83	G	96.1	Very high	95.8	Very high	10 Å²	10	34.8 Å²	34.8	10%	0.103	21%	0.209	C	C	.	.	S	Bend	trans	-129.9	167.7	171.5	0	0	0	0	0	111.9	G57 G58 V85 S102	G57-G83 CarbonylContact C-O 3.51Å; G58-G83 WeakPolarHBondContact CA-O 3.46Å; G58-G83 PolarHBondContact N-O 3.38Å; G83-V85 PolarHBondContact O-N 3.23Å; G83-S102 PolarHBondContact O-OG 3.08Å
84	P	97	Very high	96.1	Very high	42 Å²	42	30.5 Å²	30.5	27%	0.273	19%	0.193	S	C	.	.			trans	-52.3	136.3	177.6	-28.2	33.1	0	0	0	113.9	V34 S102 E103	V34-P84 HydrophobicContact CG2-CB 3.92Å; V34-P84 HydrophobicContact CG2-CG 4.43Å; P84-S102 WeakPolarHBondContact O-CA 3.2Å; P84-S102 PolarHBondContact O-OG 2.75Å; P84-E103 HydrophobicContact CB-CG 4.21Å; P84-E103 WeakPolarHBondContact CD-OE2 3.25Å; P84-E103 HydrophobicContact CG-CG 4.43Å; P84-E103 WeakPolarHBondContact CG-OE2 3.39Å; P84-E103 PolarHBondContact O-N 3.15Å
85	V	98.2	Very high	96.3	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.012	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	129.2	171.6	-177.3	0	0	0	0	108.7	I51 F60 H81 G83 I88	I51-V85 HydrophobicContact CD1-CG1 4Å; I51-V85 HydrophobicContact CG1-CG1 4.3Å; I51-V85 HydrophobicContact CG2-CB 4.12Å; I51-V85 WeakPolarHBondContact CG2-O 3.45Å; F60-V85 HydrophobicContact CD1-CG2 4.33Å; H81-V85 HydrophobicContact CB-CG2 4.3Å; G83-V85 PolarHBondContact O-N 3.23Å; V85-I88 HydrophobicContact CG1-CG2 3.76Å
86	L	97.9	Very high	96.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-32	-176.7	-64.8	-176	0	0	0	112.2	V34 W36 S38 G101 E103 R134	V34-L86 HydrophobicContact CG1-CD2 3.81Å; W36-L86 HydrophobicContact CB-CD2 4.22Å; W36-L86 HydrophobicContact CD2-CD1 4.24Å; W36-L86 HydrophobicContact CD2-CD2 4.19Å; W36-L86 HydrophobicContact CE3-CD1 4.42Å; W36-L86 HydrophobicContact CE3-CD2 4.49Å; W36-L86 HydrophobicContact CG-CB 4.31Å; W36-L86 HydrophobicContact CG-CD2 4.06Å; W36-L86 HydrophobicContact CZ2-CD1 4.43Å; S38-L86 WeakPolarHBondContact CB-O 3.44Å; S38-L86 PolarHBondContact OG-O 2.97Å; L86-G101 PolarHBondContact N-O 3.07Å; L86-E103 HydrophobicContact CD1-CG 3.86Å; L86-E103 HydrophobicContact CD2-CG 3.84Å; L86-E103 HydrophobicContact CG-CG 3.88Å; L86-R134 HydrophobicContact CD1-CB 3.86Å; L86-R134 HydrophobicContact CD1-CG 3.91Å
87	D	98.4	Very high	96.5	Very high	20 Å²	20	28.2 Å²	28.2	11%	0.107	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	149.8	-178.5	-157.6	18.8	0	0	0	111.5	S38 S100 G101 I137 I138	S38-D87 WeakPolarHBondContact CB-OD1 3.48Å; D87-S100 WeakPolarHBondContact O-CA 3.5Å; D87-G101 PolarHBondContact N-O 3.14Å; D87-G101 PolarHBondContact O-N 3.27Å; D87-I137 WeakPolarHBondContact OD2-CA 3.44Å; D87-I138 HydrophobicContact CB-CG1 4.02Å; D87-I138 PolarHBondContact OD2-N 3.14Å
88	I	98.6	Very high	96.6	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.015	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	136.2	179.9	52.1	171.5	0	0	0	109.3	A42 A49 I51 F60 V85 I98 A99	A42-I88 HydrophobicContact CB-CD1 4.06Å; A42-I88 HydrophobicContact CB-CG1 3.92Å; A42-I88 WeakPolarHBondContact CB-O 3.35Å; A49-I88 HydrophobicContact CB-CD1 3.77Å; I51-I88 HydrophobicContact CD1-CG1 4.12Å; I51-I88 HydrophobicContact CD1-CG2 4.28Å; I51-I88 HydrophobicContact CG1-CD1 3.75Å; I51-I88 HydrophobicContact CG1-CG1 3.86Å; I51-I88 HydrophobicContact CG1-CG2 4.07Å; F60-I88 HydrophobicContact CB-CG2 4.47Å; F60-I88 HydrophobicContact CD1-CG2 4.19Å; F60-I88 HydrophobicContact CD2-CG2 4.48Å; F60-I88 HydrophobicContact CG-CG2 4.15Å; V85-I88 HydrophobicContact CG1-CG2 3.76Å; I88-I98 HydrophobicContact CB-CD1 4.17Å; I88-A99 WeakPolarHBondContact CA-O 3.34Å
89	D	98.6	Very high	96.7	Very high	53 Å²	53	26.5 Å²	26.5	28%	0.283	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	132.7	180	-166.3	24.2	0	0	0	111.7	I98 A99 I138 W140	D89-I98 WeakPolarHBondContact O-CG1 3.37Å; D89-A99 PolarHBondContact N-O 3.26Å; D89-A99 PolarHBondContact O-N 2.73Å; D89-I138 HydrophobicContact CB-CD1 3.88Å; D89-I138 HydrophobicContact CB-CG1 4.02Å; D89-W140 PolarHBondContact O-NE1 2.73Å; D89-W140 PolarHBondContact OD2-N 3.31Å
90	W	98.4	Very high	97	Very high	14 Å²	14	24.6 Å²	24.6	5%	0.053	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	139.5	179.6	-72.8	104.8	0	0	0	109.9	A42 N44 F47 A49 V62 I98 I112 W140	A42-W90 VanDerWaalsContact C-CD1 3.48Å; A42-W90 VanDerWaalsContact C-NE1 3.27Å; A42-W90 PolarHBondContact O-NE1 3.29Å; N44-W90 HydrophobicContact CB-CB 4.23Å; N44-W90 HydrophobicContact CB-CD2 4.29Å; N44-W90 HydrophobicContact CB-CG 3.95Å; N44-W90 VanDerWaalsContact ND2-CD2 3.29Å; F47-W90 HydrophobicContact CB-CH2 3.54Å; F47-W90 HydrophobicContact CB-CZ2 3.45Å; F47-W90 VanDerWaalsContact CB-CZ2 3.45Å; F47-W90 AromaticContact CD2-CH2 3.76Å; F47-W90 HydrophobicContact CD2-CH2 3.76Å; F47-W90 HydrophobicContact CD2-CZ2 4.47Å; F47-W90 HydrophobicContact CD2-CZ3 4.06Å; F47-W90 AromaticContact CG-CH2 3.91Å; F47-W90 HydrophobicContact CG-CH2 3.91Å; F47-W90 HydrophobicContact CG-CZ2 4.33Å; A49-W90 HydrophobicContact CB-CZ2 3.73Å; V62-W90 HydrophobicContact CG1-CH2 3.82Å; V62-W90 HydrophobicContact CG1-CZ2 4.07Å; W90-I98 HydrophobicContact CD2-CB 4.02Å; W90-I98 HydrophobicContact CD2-CD1 3.97Å; W90-I98 HydrophobicContact CD2-CG1 4.05Å; W90-I98 HydrophobicContact CE3-CB 3.61Å; W90-I98 HydrophobicContact CE3-CD1 4.37Å; W90-I98 HydrophobicContact CE3-CG1 4.18Å; W90-I98 HydrophobicContact CG-CD1 4.47Å; W90-I98 HydrophobicContact CG-CG1 4.44Å; W90-I98 HydrophobicContact CH2-CB 4.23Å; W90-I98 HydrophobicContact CH2-CD1 4.28Å; W90-I98 HydrophobicContact CH2-CG2 4.45Å; W90-I98 HydrophobicContact CZ2-CD1 3.88Å; W90-I98 HydrophobicContact CZ3-CB 3.72Å; W90-I98 HydrophobicContact CZ3-CG2 4.2Å; W90-I112 HydrophobicContact CH2-CG1 3.87Å; W90-I112 HydrophobicContact CZ3-CG1 3.92Å; W90-W140 VanDerWaalsContact C-CD1 3.49Å; W90-W140 VanDerWaalsContact O-CD1 3.23Å
91	C	97.8	Very high	97.3	Very high	6 Å²	6	23.4 Å²	23.4	4%	0.041	13%	0.134	C	C	.	.			trans	-62.6	125.4	173.2	-176.7	0	0	0	0	109.4	H93 N94 V97 W140	C91-H93 PolarHBondContact O-N 3.01Å; C91-N94 HydrophobicContact CB-CB 4.43Å; C91-N94 CarbonylContact O-C 3.48Å; C91-N94 PolarHBondContact O-N 3.48Å; C91-V97 HydrophobicContact CB-CB 3.82Å; C91-V97 HydrophobicContact CB-CG1 3.96Å; C91-V97 WeakPolarHBondContact CB-O 3.34Å; C91-V97 PolarHBondContact N-O 2.74Å; C91-W140 HydrophobicContact CB-CD2 4.05Å; C91-W140 HydrophobicContact CB-CE3 4.4Å; C91-W140 HydrophobicContact CB-CH2 4.33Å; C91-W140 HydrophobicContact CB-CZ2 3.98Å
92	P	95.7	Very high	97.4	Very high	42 Å²	42	23 Å²	23	27%	0.273	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-25	-179.8	24.9	-32.9	0	0	0	111.8	W140 R325	P92-W140 HydrophobicContact CG-CB 4Å; P92-R325 PolarHBondContact O-NH2 2.94Å
93	H	94.7	Very high	97.4	Very high	25 Å²	25	20.3 Å²	20.3	12%	0.116	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-5.1	-176.3	-40.4	115.4	0	0	0	114.9	C91 H141 P142 A144 P370	C91-H93 PolarHBondContact O-N 3.01Å; H93-H141 PolarHBondContact CE1-O 3Å; H93-H141 VanDerWaalsContact CE1-O 3.25Å; H93-P142 PolarHBondContact NE2-O 2.91Å; H93-A144 PolarHBondContact CE1-O 3.05Å; H93-P370 CarbonylContact C-O 3.54Å; H93-P370 WeakPolarHBondContact CA-O 3.39Å; H93-P370 VanDerWaalsContact CB-O 3.3Å; H93-P370 WeakPolarHBondContact CB-O 3.49Å
94	N	95	Very high	97.5	Very high	58 Å²	58	21.2 Å²	21.2	31%	0.31	11%	0.114	S	C	.	.			trans	-150.3	109.9	176.8	-171.8	-19.7	0	0	0	111	C91 E96 V97	C91-N94 HydrophobicContact CB-CB 4.43Å; C91-N94 CarbonylContact O-C 3.48Å; C91-N94 PolarHBondContact O-N 3.48Å; N94-E96 PolarHBondContact O-N 3.03Å; N94-E96 PolarHBondContact OD1-N 3.19Å; N94-V97 HydrophobicContact CB-CB 4.18Å; N94-V97 HydrophobicContact CB-CG2 4Å; N94-V97 WeakPolarHBondContact ND2-CG2 3.29Å; N94-V97 PolarHBondContact O-N 2.81Å; N94-V97 VanDerWaalsContact O-N 3.08Å
95	D	95.5	Very high	97.6	Very high	27 Å²	27	20.8 Å²	20.8	14%	0.144	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-5.1	-177.3	-68.3	-25.3	0	0	0	113.9	N44 K46 F47 R325	N44-D95 VanDerWaalsContact ND2-C 3.34Å; N44-D95 VanDerWaalsContact ND2-CA 3.33Å; N44-D95 WeakPolarHBondContact ND2-CA 3.19Å; N44-D95 PolarHBondContact ND2-O 3.43Å; K46-D95 HydrophobicContact CD-CB 4.06Å; K46-D95 HydrophobicContact CG-CB 4.13Å; F47-D95 VanDerWaalsContact CD2-O 3.3Å; F47-D95 WeakPolarHBondContact CD2-O 3.29Å; F47-D95 WeakPolarHBondContact CE2-O 3.47Å; D95-R325 IonicContact OD1-CZ 3.87Å; D95-R325 IonicContact OD1-NH1 2.58Å; D95-R325 PolarHBondContact OD1-NH1 3.03Å; D95-R325 VanDerWaalsContact OD1-NH1 3.08Å; D95-R325 IonicContact OD1-NH2 3.19Å; D95-R325 PolarHBondContact OD1-NH2 3.01Å; D95-R325 IonicContact OD2-CZ 3.24Å; D95-R325 IonicContact OD2-NH1 3.16Å; D95-R325 PolarHBondContact OD2-NH1 2.72Å; D95-R325 IonicContact OD2-NH2 3.02Å
96	E	96.4	Very high	97.6	Very high	41 Å²	41	21.4 Å²	21.4	19%	0.192	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-2.6	176.8	-68.7	167	-163	0	0	112.8	K46 F47 N94 Q111 I112	K46-E96 HydrophobicContact CD-CG 4.47Å; K46-E96 IonicContact NZ-OE1 3.36Å; K46-E96 PolarHBondContact NZ-OE1 3.35Å; F47-E96 HydrophobicContact CE2-CG 4Å; N94-E96 PolarHBondContact O-N 3.03Å; N94-E96 PolarHBondContact OD1-N 3.19Å; E96-Q111 PolarHBondContact OE2-NE2 2.8Å; E96-Q111 VanDerWaalsContact OE2-NE2 3.13Å; E96-I112 WeakPolarHBondContact O-CB 3.43Å; E96-I112 PolarHBondContact O-N 3.26Å
97	V	97.8	Very high	97.6	Very high	20 Å²	20	21.5 Å²	21.5	12%	0.121	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.7	-179.4	176.4	0	0	0	0	110.5	C91 N94 V109 W110 Q111 W140	C91-V97 HydrophobicContact CB-CB 3.82Å; C91-V97 HydrophobicContact CB-CG1 3.96Å; C91-V97 WeakPolarHBondContact CB-O 3.34Å; C91-V97 PolarHBondContact N-O 2.74Å; N94-V97 HydrophobicContact CB-CB 4.18Å; N94-V97 HydrophobicContact CB-CG2 4Å; N94-V97 WeakPolarHBondContact ND2-CG2 3.29Å; N94-V97 PolarHBondContact O-N 2.81Å; N94-V97 VanDerWaalsContact O-N 3.08Å; V97-V109 HydrophobicContact CG1-CG1 3.53Å; V97-W110 WeakPolarHBondContact CA-O 3.4Å; V97-Q111 VanDerWaalsContact CG2-OE1 3.23Å; V97-W140 HydrophobicContact CG1-CH2 3.99Å; V97-W140 HydrophobicContact CG1-CZ2 3.87Å
98	I	98.6	Very high	97.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	141.4	175.3	-167.8	173.4	0	0	0	110.1	A49 F60 I88 D89 W90 W110 I112	A49-I98 HydrophobicContact CB-CD1 3.5Å; A49-I98 VanDerWaalsContact CB-CD1 3.5Å; F60-I98 HydrophobicContact CD2-CD1 4.5Å; F60-I98 HydrophobicContact CE2-CD1 3.95Å; F60-I98 HydrophobicContact CE2-CG2 3.96Å; F60-I98 HydrophobicContact CZ-CG2 3.98Å; I88-I98 HydrophobicContact CB-CD1 4.17Å; D89-I98 WeakPolarHBondContact O-CG1 3.37Å; W90-I98 HydrophobicContact CD2-CB 4.02Å; W90-I98 HydrophobicContact CD2-CD1 3.97Å; W90-I98 HydrophobicContact CD2-CG1 4.05Å; W90-I98 HydrophobicContact CE3-CB 3.61Å; W90-I98 HydrophobicContact CE3-CD1 4.37Å; W90-I98 HydrophobicContact CE3-CG1 4.18Å; W90-I98 HydrophobicContact CG-CD1 4.47Å; W90-I98 HydrophobicContact CG-CG1 4.44Å; W90-I98 HydrophobicContact CH2-CB 4.23Å; W90-I98 HydrophobicContact CH2-CD1 4.28Å; W90-I98 HydrophobicContact CH2-CG2 4.45Å; W90-I98 HydrophobicContact CZ2-CD1 3.88Å; W90-I98 HydrophobicContact CZ3-CB 3.72Å; W90-I98 HydrophobicContact CZ3-CG2 4.2Å; I98-W110 HydrophobicContact CG2-CB 3.89Å; I98-W110 HydrophobicContact CG2-CG 4.35Å; I98-W110 PolarHBondContact N-O 3.46Å; I98-W110 VanDerWaalsContact N-O 3.07Å; I98-W110 PolarHBondContact O-N 2.99Å; I98-I112 HydrophobicContact CG2-CD1 4.05Å; I98-I112 HydrophobicContact CG2-CG1 4.03Å
99	A	98.7	Very high	97.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	150.8	170.7	0	0	0	0	0	110.4	I88 D89 M108 V109 I138 W140 L148	I88-A99 WeakPolarHBondContact CA-O 3.34Å; D89-A99 PolarHBondContact N-O 3.26Å; D89-A99 PolarHBondContact O-N 2.73Å; A99-M108 CarbonylContact C-O 3.55Å; A99-M108 WeakPolarHBondContact CA-O 3.37Å; A99-V109 HydrophobicContact CB-CG2 4.29Å; A99-I138 VanDerWaalsContact C-CD1 3.45Å; A99-I138 HydrophobicContact CB-CD1 3.81Å; A99-I138 WeakPolarHBondContact O-CD1 3.29Å; A99-W140 HydrophobicContact CB-CZ2 3.8Å; A99-L148 HydrophobicContact CB-CD1 4.28Å; A99-L148 HydrophobicContact CB-CD2 3.84Å
100	S	98.7	Very high	97.6	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	133.3	173.5	59.4	0	0	0	0	111.8	H81 D87 V107 M108 W110	H81-S100 PolarHBondContact CD2-OG 3.43Å; H81-S100 PolarHBondContact NE2-O 2.62Å; H81-S100 PolarHBondContact NE2-OG 3.15Å; D87-S100 WeakPolarHBondContact O-CA 3.5Å; S100-V107 VanDerWaalsContact O-CA 3.31Å; S100-V107 WeakPolarHBondContact O-CA 3.49Å; S100-M108 PolarHBondContact N-O 3.31Å; S100-M108 PolarHBondContact O-N 2.81Å; S100-W110 PolarHBondContact OG-NE1 3.43Å
101	G	98.4	Very high	97.5	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	142	171.7	0	0	0	0	0	111.2	L86 D87 V135	L86-G101 PolarHBondContact N-O 3.07Å; D87-G101 PolarHBondContact N-O 3.14Å; D87-G101 PolarHBondContact O-N 3.27Å; G101-V135 CarbonylContact C-O 3.55Å
102	S	98.3	Very high	97.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	162.5	-168.2	172.2	0	0	0	0	114.5	H81 G83 P84 D104 C105 T106 R134 V135	H81-S102 WeakPolarHBondContact CE1-CB 3.49Å; H81-S102 WeakPolarHBondContact ND1-CB 3.42Å; H81-S102 PolarHBondContact ND1-OG 2.98Å; G83-S102 PolarHBondContact O-OG 3.08Å; P84-S102 WeakPolarHBondContact O-CA 3.2Å; P84-S102 PolarHBondContact O-OG 2.75Å; S102-D104 VanDerWaalsContact CB-OD1 3.23Å; S102-D104 WeakPolarHBondContact CB-OD1 3.22Å; S102-D104 PolarHBondContact O-N 3.39Å; S102-D104 PolarHBondContact OG-N 3.04Å; S102-D104 PolarHBondContact OG-OD1 3.4Å; S102-D104 PolarHBondContact OG-OD2 3.42Å; S102-C105 PolarHBondContact O-N 3.28Å; S102-T106 PolarHBondContact N-O 2.93Å; S102-R134 WeakPolarHBondContact O-CA 3.32Å; S102-V135 PolarHBondContact N-O 2.96Å; S102-V135 VanDerWaalsContact N-O 3.13Å; S102-V135 PolarHBondContact O-N 2.86Å
103	E	97.5	Very high	97.5	Very high	64 Å²	64	22.7 Å²	22.7	30%	0.299	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.8	168.8	-68.3	-160.4	151.7	0	0	114.6	P84 L86 C105 R134	P84-E103 HydrophobicContact CB-CG 4.21Å; P84-E103 WeakPolarHBondContact CD-OE2 3.25Å; P84-E103 HydrophobicContact CG-CG 4.43Å; P84-E103 WeakPolarHBondContact CG-OE2 3.39Å; P84-E103 PolarHBondContact O-N 3.15Å; L86-E103 HydrophobicContact CD1-CG 3.86Å; L86-E103 HydrophobicContact CD2-CG 3.84Å; L86-E103 HydrophobicContact CG-CG 3.88Å; E103-C105 PolarHBondContact O-N 2.99Å; E103-R134 HydrophobicContact CB-CB 4.29Å; E103-R134 HydrophobicContact CG-CB 4.2Å; E103-R134 IonicContact OE1-CZ 2.73Å; E103-R134 IonicContact OE1-NH1 3.94Å; E103-R134 PolarHBondContact OE1-NH1 3.41Å
104	D	97.4	Very high	97.2	Very high	28 Å²	28	27.7 Å²	27.7	15%	0.15	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	7.1	174.1	62.7	27	0	0	0	114.5	H81 T82 S102 T106	H81-D104 VanDerWaalsContact CA-OD2 3.27Å; H81-D104 WeakPolarHBondContact CA-OD2 3.35Å; H81-D104 VanDerWaalsContact CB-OD2 3.28Å; H81-D104 WeakPolarHBondContact CB-OD2 3.18Å; H81-D104 IonicContact CE1-OD1 2.73Å; H81-D104 IonicContact CG-OD2 3.84Å; H81-D104 IonicContact ND1-OD1 3.78Å; H81-D104 PolarHBondContact ND1-OD1 3.2Å; H81-D104 IonicContact ND1-OD2 3.08Å; H81-D104 PolarHBondContact ND1-OD2 2.82Å; T82-D104 PolarHBondContact N-OD2 2.87Å; T82-D104 WeakPolarHBondContact OG1-CB 3.23Å; S102-D104 VanDerWaalsContact CB-OD1 3.23Å; S102-D104 WeakPolarHBondContact CB-OD1 3.22Å; S102-D104 PolarHBondContact O-N 3.39Å; S102-D104 PolarHBondContact OG-N 3.04Å; S102-D104 PolarHBondContact OG-OD1 3.4Å; S102-D104 PolarHBondContact OG-OD2 3.42Å; D104-T106 PolarHBondContact O-N 3.28Å; D104-T106 WeakPolarHBondContact OD1-CB 3.46Å; D104-T106 PolarHBondContact OD1-N 3.34Å; D104-T106 PolarHBondContact OD1-OG1 3.23Å
105	C	98.3	Very high	96.9	Very high	33 Å²	33	31.8 Å²	31.8	22%	0.223	17%	0.167	C	C	.	.	S	Bend	trans	70.8	7	178.7	-43.2	0	0	0	0	114.8	S102 E103 K133	S102-C105 PolarHBondContact O-N 3.28Å; E103-C105 PolarHBondContact O-N 2.99Å; C105-K133 WeakPolarHBondContact SG-CA 3.5Å
106	T	98.3	Very high	96.7	Very high	16 Å²	16	30.6 Å²	30.6	10%	0.098	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	155.1	177.8	70.8	0	0	0	0	111.8	H81 S102 D104 V127 E129	H81-T106 PolarHBondContact CE1-OG1 2.92Å; H81-T106 VanDerWaalsContact CE1-OG1 3.32Å; H81-T106 PolarHBondContact ND1-OG1 3.41Å; S102-T106 PolarHBondContact N-O 2.93Å; D104-T106 PolarHBondContact O-N 3.28Å; D104-T106 WeakPolarHBondContact OD1-CB 3.46Å; D104-T106 PolarHBondContact OD1-N 3.34Å; D104-T106 PolarHBondContact OD1-OG1 3.23Å; T106-V127 HydrophobicContact CG2-CG1 4.3Å; T106-E129 HydrophobicContact CG2-CG 4.29Å
107	V	98.8	Very high	96.6	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.006	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	128.8	160.5	178.8	0	0	0	0	107.9	S100 L128 V135 I138 L148	S100-V107 VanDerWaalsContact O-CA 3.31Å; S100-V107 WeakPolarHBondContact O-CA 3.49Å; V107-L128 HydrophobicContact CB-CB 4.16Å; V107-L128 HydrophobicContact CB-CD1 4.25Å; V107-L128 HydrophobicContact CG1-CD1 4.11Å; V107-L128 PolarHBondContact N-O 2.96Å; V107-L128 VanDerWaalsContact N-O 3.11Å; V107-L128 PolarHBondContact O-N 3.37Å; V107-V135 HydrophobicContact CG2-CB 4.19Å; V107-V135 HydrophobicContact CG2-CG1 3.62Å; V107-V135 HydrophobicContact CG2-CG2 4.28Å; V107-I138 HydrophobicContact CG1-CG2 4.18Å; V107-I138 HydrophobicContact CG2-CG2 4.08Å; V107-L148 HydrophobicContact CG1-CD2 3.82Å
108	M	98.7	Very high	96.3	Very high	19 Å²	19	34.5 Å²	34.5	9%	0.094	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	140.3	177.6	-68.8	-178	-178.5	0	0	110.2	H81 A99 S100 W110 P124 V126 V127	H81-M108 VanDerWaalsContact CE1-CG 3.46Å; H81-M108 WeakPolarHBondContact CE1-CG 3.46Å; A99-M108 CarbonylContact C-O 3.55Å; A99-M108 WeakPolarHBondContact CA-O 3.37Å; S100-M108 PolarHBondContact N-O 3.31Å; S100-M108 PolarHBondContact O-N 2.81Å; M108-W110 HydrophobicContact CB-CH2 4.37Å; M108-W110 HydrophobicContact CB-CZ2 3.48Å; M108-W110 VanDerWaalsContact CB-CZ2 3.48Å; M108-W110 HydrophobicContact CG-CZ2 4.07Å; M108-W110 PolarHBondContact O-NE1 3.03Å; M108-W110 HydrophobicContact SD-CH2 3.65Å; M108-W110 HydrophobicContact SD-CZ2 3.44Å; M108-W110 WeakPolarHBondContact SD-CZ2 3.41Å; M108-P124 HydrophobicContact CB-CB 3.92Å; M108-P124 HydrophobicContact CB-CG 4.35Å; M108-P124 HydrophobicContact CG-CB 4.23Å; M108-P124 HydrophobicContact CG-CG 4.11Å; M108-P124 HydrophobicContact SD-CB 4.36Å; M108-P124 HydrophobicContact SD-CG 3.93Å; M108-V126 WeakPolarHBondContact CA-O 3.15Å; M108-V127 HydrophobicContact CE-CG1 4.36Å; M108-V127 HydrophobicContact CE-CG2 4.45Å; M108-V127 HydrophobicContact CG-CG1 4.37Å; M108-V127 HydrophobicContact CG-CG2 4.33Å
109	V	98.6	Very high	96.1	Very high	4 Å²	4	38 Å²	38	2%	0.024	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	133.6	175.5	-176.8	0	0	0	0	109.6	V97 A99 P124 V125 V126 W140 L148 V162	V97-V109 HydrophobicContact CG1-CG1 3.53Å; A99-V109 HydrophobicContact CB-CG2 4.29Å; V109-P124 CarbonylContact O-C 3.59Å; V109-P124 WeakPolarHBondContact O-CB 3.2Å; V109-V125 PolarHBondContact O-N 2.93Å; V109-V126 HydrophobicContact CB-CB 4.28Å; V109-V126 PolarHBondContact N-O 3.07Å; V109-V126 PolarHBondContact O-N 3.41Å; V109-W140 HydrophobicContact CG1-CH2 4.16Å; V109-W140 HydrophobicContact CG1-CZ2 4.22Å; V109-W140 HydrophobicContact CG2-CH2 4.49Å; V109-L148 HydrophobicContact CG2-CD2 4.32Å; V109-V162 HydrophobicContact CB-CG1 4.12Å; V109-V162 HydrophobicContact CG1-CG1 3.97Å; V109-V162 HydrophobicContact CG2-CG1 3.79Å; V109-V162 HydrophobicContact CG2-CG2 4.22Å
110	W	98.4	Very high	95.9	Very high	1 Å²	1	41.5 Å²	41.5	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	137.1	-170	-47.3	87	0	0	0	110.7	F60 V78 V97 I98 S100 M108 I112 L121 P124	F60-W110 AromaticContact CE1-NE1 3.74Å; F60-W110 AromaticContact CZ-CD1 3.69Å; F60-W110 HydrophobicContact CZ-CG 4.13Å; F60-W110 AromaticContact CZ-NE1 3.84Å; V78-W110 HydrophobicContact CG1-CD2 3.33Å; V78-W110 HydrophobicContact CG1-CE3 3.36Å; V78-W110 HydrophobicContact CG1-CG 3.93Å; V78-W110 HydrophobicContact CG1-CH2 3.89Å; V78-W110 HydrophobicContact CG1-CZ2 3.85Å; V78-W110 HydrophobicContact CG1-CZ3 3.64Å; V97-W110 WeakPolarHBondContact CA-O 3.4Å; I98-W110 HydrophobicContact CG2-CB 3.89Å; I98-W110 HydrophobicContact CG2-CG 4.35Å; I98-W110 PolarHBondContact N-O 3.46Å; I98-W110 VanDerWaalsContact N-O 3.07Å; I98-W110 PolarHBondContact O-N 2.99Å; S100-W110 PolarHBondContact OG-NE1 3.43Å; M108-W110 HydrophobicContact CB-CH2 4.37Å; M108-W110 HydrophobicContact CB-CZ2 3.48Å; M108-W110 VanDerWaalsContact CB-CZ2 3.48Å; M108-W110 HydrophobicContact CG-CZ2 4.07Å; M108-W110 PolarHBondContact O-NE1 3.03Å; M108-W110 HydrophobicContact SD-CH2 3.65Å; M108-W110 HydrophobicContact SD-CZ2 3.44Å; M108-W110 WeakPolarHBondContact SD-CZ2 3.41Å; W110-I112 HydrophobicContact CB-CD1 4.31Å; W110-L121 HydrophobicContact CB-CD2 4.22Å; W110-L121 HydrophobicContact CE3-CD2 3.98Å; W110-L121 HydrophobicContact CE3-CG 4.01Å; W110-L121 HydrophobicContact CZ3-CG 4.44Å; W110-P124 HydrophobicContact CD2-CB 4.06Å; W110-P124 HydrophobicContact CE3-CB 3.79Å; W110-P124 HydrophobicContact CH2-CB 3.9Å; W110-P124 HydrophobicContact CH2-CG 4.23Å; W110-P124 HydrophobicContact CZ2-CB 4.18Å; W110-P124 HydrophobicContact CZ3-CB 3.72Å; W110-P124 HydrophobicContact CZ3-CG 4.27Å
111	Q	97.2	Very high	95.8	Very high	78 Å²	78	43.3 Å²	43.3	36%	0.364	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	118.1	166.2	-177	72.9	34.2	0	0	108.5	E96 V97 V125	E96-Q111 PolarHBondContact OE2-NE2 2.8Å; E96-Q111 VanDerWaalsContact OE2-NE2 3.13Å; V97-Q111 VanDerWaalsContact CG2-OE1 3.23Å; Q111-V125 HydrophobicContact CB-CG2 3.63Å
112	I	96.8	Very high	95.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-89.2	130.4	176.9	-54.7	-54	0	0	0	108.8	F47 V62 V78 W90 E96 I98 W110 L121	F47-I112 HydrophobicContact CD1-CG2 4.32Å; F47-I112 HydrophobicContact CD2-CG2 4.41Å; F47-I112 HydrophobicContact CE1-CG2 4.03Å; F47-I112 HydrophobicContact CE2-CB 4.47Å; F47-I112 HydrophobicContact CE2-CG2 4.13Å; F47-I112 HydrophobicContact CZ-CG2 3.93Å; V62-I112 HydrophobicContact CG1-CD1 4.48Å; V62-I112 HydrophobicContact CG1-CG1 4.31Å; V62-I112 HydrophobicContact CG1-CG2 3.85Å; V62-I112 HydrophobicContact CG2-CD1 4.11Å; V78-I112 HydrophobicContact CG2-CD1 4.08Å; W90-I112 HydrophobicContact CH2-CG1 3.87Å; W90-I112 HydrophobicContact CZ3-CG1 3.92Å; E96-I112 WeakPolarHBondContact O-CB 3.43Å; E96-I112 PolarHBondContact O-N 3.26Å; I98-I112 HydrophobicContact CG2-CD1 4.05Å; I98-I112 HydrophobicContact CG2-CG1 4.03Å; W110-I112 HydrophobicContact CB-CD1 4.31Å; I112-L121 HydrophobicContact CD1-CD2 4.05Å
113	P	95.3	Very high	95.6	Very high	62 Å²	62	54.6 Å²	54.6	40%	0.403	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-61	142.7	173.9	-20.4	31.8	0	0	0	111.4	F47 N115 G116	F47-P113 WeakPolarHBondContact CZ-O 3.42Å; P113-N115 PolarHBondContact O-N 3.24Å; P113-G116 WeakPolarHBondContact O-CA 3.48Å; P113-G116 PolarHBondContact O-N 2.93Å
114	E	88.1	Confident	95.5	Very high	129 Å²	129	53.2 Å²	53.2	60%	0.603	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-37.6	-176.9	-174.6	178.9	-165.4	0	0	113.7	F47 G116	F47-E114 WeakPolarHBondContact CZ-O 3.42Å; E114-G116 VanDerWaalsContact C-N 3.31Å; E114-G116 PolarHBondContact O-N 2.82Å
115	N	88.8	Confident	95.5	Very high	145 Å²	145	56.4 Å²	56.4	78%	0.775	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	9.2	-179.2	-65	-54.6	0	0	0	114.1	P113	P113-N115 PolarHBondContact O-N 3.24Å
116	G	91.7	Very high	95.5	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.01	32%	0.315	C	S	.	.			trans	80.6	-176.5	-171.9	0	0	0	0	0	113.5	P113 E114	P113-G116 WeakPolarHBondContact O-CA 3.48Å; P113-G116 PolarHBondContact O-N 2.93Å; E114-G116 VanDerWaalsContact C-N 3.31Å; E114-G116 PolarHBondContact O-N 2.82Å
117	L	93.7	Very high	95.4	Very high	11 Å²	11	58 Å²	58	6%	0.058	33%	0.327	C	S	.	.			trans	-76.6	128.1	-174.6	-60.1	178	0	0	0	112.1	V62 P76 V78 L121	V62-L117 HydrophobicContact CB-CD1 4.24Å; P76-L117 HydrophobicContact CB-CB 4.02Å; P76-L117 HydrophobicContact CG-CB 3.65Å; P76-L117 VanDerWaalsContact CG-O 3.24Å; P76-L117 WeakPolarHBondContact CG-O 3.16Å; P76-L117 WeakPolarHBondContact O-CD1 3.35Å; V78-L117 HydrophobicContact CG2-CD1 3.9Å; L117-L121 HydrophobicContact CD2-CB 4.01Å; L117-L121 HydrophobicContact CD2-CD2 4.34Å
118	T	92.6	Very high	95.4	Very high	132 Å²	132	58.1 Å²	58.1	81%	0.81	33%	0.328	S	S	*	.	S	Bend	trans	-101.2	-25.4	171.1	52.7	0	0	0	0	113
119	S	94.3	Very high	95.4	Very high	73 Å²	73	64.3 Å²	64.3	51%	0.51	36%	0.356	S	S	.	.	S	Bend	trans	-139.5	159.2	175.3	54	0	0	0	0	108.9	P76 L121	P76-S119 WeakPolarHBondContact CB-O 3.31Å; S119-L121 PolarHBondContact O-N 3.16Å
120	P	95.1	Very high	95.3	Very high	74 Å²	74	65.2 Å²	65.2	48%	0.481	37%	0.366	S	S	.	.			trans	-55.3	134.6	175	-23.1	33.5	0	0	0	110.7	P76 T77	P76-P120 HydrophobicContact CB-CG 4.3Å; T77-P120 VanDerWaalsContact O-CA 3.29Å; T77-P120 WeakPolarHBondContact O-CA 3.34Å
121	L	96.3	Very high	95.3	Very high	39 Å²	39	65.9 Å²	65.9	20%	0.204	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-95.7	107.3	178.8	-176.5	63.2	0	0	0	108.4	T77 V78 C79 W110 I112 L117 S119	T77-L121 PolarHBondContact O-N 2.7Å; V78-L121 CarbonylContact C-O 3.42Å; V78-L121 WeakPolarHBondContact CA-O 3.48Å; V78-L121 HydrophobicContact CG1-CB 4.36Å; V78-L121 HydrophobicContact CG1-CD2 4.33Å; V78-L121 HydrophobicContact CG1-CG 4.48Å; V78-L121 HydrophobicContact CG2-CB 4.26Å; V78-L121 HydrophobicContact CG2-CD2 4.23Å; C79-L121 PolarHBondContact N-O 3.07Å; W110-L121 HydrophobicContact CB-CD2 4.22Å; W110-L121 HydrophobicContact CE3-CD2 3.98Å; W110-L121 HydrophobicContact CE3-CG 4.01Å; W110-L121 HydrophobicContact CZ3-CG 4.44Å; I112-L121 HydrophobicContact CD1-CD2 4.05Å; L117-L121 HydrophobicContact CD2-CB 4.01Å; L117-L121 HydrophobicContact CD2-CD2 4.34Å; S119-L121 PolarHBondContact O-N 3.16Å
122	T	95.5	Very high	95.3	Very high	79 Å²	79	67.1 Å²	67.1	49%	0.485	38%	0.383	S	S	.	.			trans	-105.6	-25.1	-173.9	54.6	0	0	0	0	113.5	C79 G80	C79-T122 WeakPolarHBondContact O-CA 3.17Å; C79-T122 WeakPolarHBondContact O-CG2 3.39Å; G80-T122 WeakPolarHBondContact CA-O 3.19Å
123	E	95.8	Very high	95.4	Very high	157 Å²	157	72.4 Å²	72.4	73%	0.734	41%	0.406	S	S	*	.			trans	-101.9	116	-177.2	-66.4	-177.8	178	0	0	109.6
124	P	97.1	Very high	95.5	Very high	35 Å²	35	74.7 Å²	74.7	23%	0.227	41%	0.406	C	S	.	.			trans	-75	158.9	172.3	32.1	-34.5	0	0	0	110.8	M108 V109 W110 V127	M108-P124 HydrophobicContact CB-CB 3.92Å; M108-P124 HydrophobicContact CB-CG 4.35Å; M108-P124 HydrophobicContact CG-CB 4.23Å; M108-P124 HydrophobicContact CG-CG 4.11Å; M108-P124 HydrophobicContact SD-CB 4.36Å; M108-P124 HydrophobicContact SD-CG 3.93Å; V109-P124 CarbonylContact O-C 3.59Å; V109-P124 WeakPolarHBondContact O-CB 3.2Å; W110-P124 HydrophobicContact CD2-CB 4.06Å; W110-P124 HydrophobicContact CE3-CB 3.79Å; W110-P124 HydrophobicContact CH2-CB 3.9Å; W110-P124 HydrophobicContact CH2-CG 4.23Å; W110-P124 HydrophobicContact CZ2-CB 4.18Å; W110-P124 HydrophobicContact CZ3-CB 3.72Å; W110-P124 HydrophobicContact CZ3-CG 4.27Å; P124-V127 HydrophobicContact CB-CG2 4.47Å; P124-V127 HydrophobicContact CG-CG2 3.45Å; P124-V127 VanDerWaalsContact CG-CG2 3.45Å
125	V	96.7	Very high	96	Very high	96 Å²	96	68.5 Å²	68.5	58%	0.582	38%	0.378	S	S	*	.	S	Bend	trans	-70.4	-39.9	172.4	-174.9	0	0	0	0	110.1	V109 Q111	V109-V125 PolarHBondContact O-N 2.93Å; Q111-V125 HydrophobicContact CB-CG2 3.63Å
126	V	97.1	Very high	96.5	Very high	22 Å²	22	61.7 Å²	61.7	13%	0.133	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	137.6	-178.7	-174.9	0	0	0	0	109.3	M108 V109 L128 V162 A165	M108-V126 WeakPolarHBondContact CA-O 3.15Å; V109-V126 HydrophobicContact CB-CB 4.28Å; V109-V126 PolarHBondContact N-O 3.07Å; V109-V126 PolarHBondContact O-N 3.41Å; V126-L128 HydrophobicContact CG1-CD2 3.59Å; V126-L128 HydrophobicContact CG1-CG 4.09Å; V126-V162 HydrophobicContact CB-CG1 4.47Å; V126-V162 HydrophobicContact CG2-CG1 4.15Å; V126-V162 WeakPolarHBondContact CG2-O 3.44Å; V126-A165 HydrophobicContact CG1-CB 3.7Å
127	V	98.1	Very high	96.8	Very high	60 Å²	60	62.4 Å²	62.4	36%	0.364	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.9	167.7	-172.3	0	0	0	0	107.4	T106 M108 P124 E129	T106-V127 HydrophobicContact CG2-CG1 4.3Å; M108-V127 HydrophobicContact CE-CG1 4.36Å; M108-V127 HydrophobicContact CE-CG2 4.45Å; M108-V127 HydrophobicContact CG-CG1 4.37Å; M108-V127 HydrophobicContact CG-CG2 4.33Å; P124-V127 HydrophobicContact CB-CG2 4.47Å; P124-V127 HydrophobicContact CG-CG2 3.45Å; P124-V127 VanDerWaalsContact CG-CG2 3.45Å; V127-E129 HydrophobicContact CG1-CG 3.93Å
128	L	98.3	Very high	97	Very high	3 Å²	3	62.3 Å²	62.3	2%	0.016	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	113.5	178.5	-54.2	170.6	0	0	0	108.1	V107 V126 L148 W160 V162 A165	V107-L128 HydrophobicContact CB-CB 4.16Å; V107-L128 HydrophobicContact CB-CD1 4.25Å; V107-L128 HydrophobicContact CG1-CD1 4.11Å; V107-L128 PolarHBondContact N-O 2.96Å; V107-L128 VanDerWaalsContact N-O 3.11Å; V107-L128 PolarHBondContact O-N 3.37Å; V126-L128 HydrophobicContact CG1-CD2 3.59Å; V126-L128 HydrophobicContact CG1-CG 4.09Å; L128-L148 HydrophobicContact CD1-CD2 3.98Å; L128-W160 HydrophobicContact CB-CD2 4.06Å; L128-W160 HydrophobicContact CB-CE3 4.18Å; L128-W160 HydrophobicContact CB-CH2 4.32Å; L128-W160 HydrophobicContact CB-CZ2 4.19Å; L128-W160 HydrophobicContact CB-CZ3 4.31Å; L128-W160 HydrophobicContact CD1-CB 3.93Å; L128-W160 HydrophobicContact CD1-CD2 4.04Å; L128-W160 HydrophobicContact CD1-CG 3.71Å; L128-W160 HydrophobicContact CD2-CB 4.36Å; L128-W160 HydrophobicContact CD2-CD2 4.18Å; L128-W160 HydrophobicContact CD2-CE3 3.95Å; L128-W160 HydrophobicContact CD2-CG 4.39Å; L128-W160 HydrophobicContact CG-CD2 4.32Å; L128-W160 HydrophobicContact CG-CE3 4.48Å; L128-W160 HydrophobicContact CG-CG 4.46Å; L128-V162 HydrophobicContact CD1-CG2 4.39Å; L128-A165 HydrophobicContact CD2-CB 4.28Å
129	E	97.7	Very high	97.3	Very high	149 Å²	149	56.7 Å²	56.7	70%	0.696	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	124.6	-178	-59.5	-173.6	154	0	0	109.4	T106 V127 W160	T106-E129 HydrophobicContact CG2-CG 4.29Å; V127-E129 HydrophobicContact CG1-CG 3.93Å; E129-W160 WeakPolarHBondContact O-CH2 3.23Å
130	G	96.9	Very high	97.5	Very high	23 Å²	23	53.8 Å²	53.8	24%	0.237	29%	0.289	C	S	.	.			trans	178.6	-20.1	179.9	0	0	0	0	0	114.8	R170	G130-R170 PolarHBondContact O-NH1 2.94Å; G130-R170 PolarHBondContact O-NH2 3.38Å
131	H	98.5	Very high	97.6	Very high	15 Å²	15	50.3 Å²	50.3	7%	0.069	27%	0.266	C	S	.	.			trans	-80	146.7	168.4	-71.5	-73.5	0	0	0	111.4	V135 S150 G152 D154 V156	H131-V135 HydrophobicContact CB-CG2 3.65Å; H131-V135 WeakPolarHBondContact CD2-CG2 3.16Å; H131-S150 PolarHBondContact CD2-OG 3.2Å; H131-S150 PolarHBondContact NE2-OG 3.09Å; H131-G152 PolarHBondContact CE1-N 2.82Å; H131-G152 VanDerWaalsContact CE1-N 3.34Å; H131-D154 VanDerWaalsContact CA-OD2 3.28Å; H131-D154 WeakPolarHBondContact CA-OD2 3.21Å; H131-D154 IonicContact CE1-OD1 2.74Å; H131-D154 IonicContact CG-OD2 3.44Å; H131-D154 IonicContact ND1-OD1 2.66Å; H131-D154 PolarHBondContact ND1-OD1 2.58Å; H131-D154 IonicContact ND1-OD2 2.65Å; H131-D154 PolarHBondContact ND1-OD2 3.04Å; H131-V156 PolarHBondContact CE1-O 3.34Å; H131-V156 VanDerWaalsContact CE1-O 3.26Å
132	T	98	Very high	97.7	Very high	105 Å²	105	50.2 Å²	50.2	64%	0.644	27%	0.268	S	S	*	.	S	Bend	trans	-102.8	-6.5	179.9	59.4	0	0	0	0	113.1	D154	T132-D154 PolarHBondContact N-OD2 3.36Å; T132-D154 VanDerWaalsContact OG1-CB 3.29Å; T132-D154 WeakPolarHBondContact OG1-CB 3.39Å; T132-D154 PolarHBondContact OG1-OD2 3.47Å
133	K	98.4	Very high	97.7	Very high	111 Å²	111	46.5 Å²	46.5	48%	0.483	25%	0.245	S	C	.	.	S	Bend	trans	-138.7	169.6	175.7	-66.6	177.8	-174.2	167.4	0	109.3	C105 V135 C153 D154	C105-K133 WeakPolarHBondContact SG-CA 3.5Å; K133-V135 PolarHBondContact O-N 2.9Å; K133-C153 HydrophobicContact CB-CB 4Å; K133-C153 HydrophobicContact CD-CB 4.35Å; K133-C153 WeakPolarHBondContact CD-O 3.33Å; K133-D154 HydrophobicContact CB-CB 4.15Å; K133-D154 HydrophobicContact CD-CB 4.19Å; K133-D154 HydrophobicContact CG-CB 4.21Å
134	R	97.8	Very high	97.8	Very high	109 Å²	109	39 Å²	39	41%	0.411	21%	0.21	S	C	.	.			trans	-43.7	136.2	179.7	70.5	-175.7	95.9	-164.9	7.2	112.9	L86 S102 E103 G152 C153	L86-R134 HydrophobicContact CD1-CB 3.86Å; L86-R134 HydrophobicContact CD1-CG 3.91Å; S102-R134 WeakPolarHBondContact O-CA 3.32Å; E103-R134 HydrophobicContact CB-CB 4.29Å; E103-R134 HydrophobicContact CG-CB 4.2Å; E103-R134 IonicContact OE1-CZ 2.73Å; E103-R134 IonicContact OE1-NH1 3.94Å; E103-R134 PolarHBondContact OE1-NH1 3.41Å; R134-G152 CarbonylContact O-C 3.57Å; R134-G152 WeakPolarHBondContact O-CA 3.49Å; R134-C153 HydrophobicContact CG-CB 3.8Å; R134-C153 WeakPolarHBondContact CG-SG 3.32Å; R134-C153 PolarHBondContact O-N 3.29Å
135	V	98.5	Very high	97.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	117.7	176.6	-173.9	0	0	0	0	108.5	G101 S102 V107 H131 K133 I138	G101-V135 CarbonylContact C-O 3.55Å; S102-V135 PolarHBondContact N-O 2.96Å; S102-V135 VanDerWaalsContact N-O 3.13Å; S102-V135 PolarHBondContact O-N 2.86Å; V107-V135 HydrophobicContact CG2-CB 4.19Å; V107-V135 HydrophobicContact CG2-CG1 3.62Å; V107-V135 HydrophobicContact CG2-CG2 4.28Å; H131-V135 HydrophobicContact CB-CG2 3.65Å; H131-V135 WeakPolarHBondContact CD2-CG2 3.16Å; K133-V135 PolarHBondContact O-N 2.9Å; V135-I138 HydrophobicContact CG1-CG2 4.34Å
136	G	97.4	Very high	97.6	Very high	2 Å²	2	40.9 Å²	40.9	2%	0.021	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	6.2	-172.8	0	0	0	0	0	115	W36 A151	W36-G136 PolarHBondContact NE1-O 2.83Å; G136-A151 PolarHBondContact N-O 2.88Å
137	I	98.5	Very high	97.7	Very high	15 Å²	15	39.8 Å²	39.8	8%	0.077	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	124.3	175.6	-59.5	161.5	0	0	0	106.8	D87 S150 A151 I179 V182	D87-I137 WeakPolarHBondContact OD2-CA 3.44Å; I137-S150 WeakPolarHBondContact O-CA 3.47Å; I137-A151 HydrophobicContact CB-CB 4.05Å; I137-A151 HydrophobicContact CD1-CB 4.12Å; I137-A151 HydrophobicContact CG2-CB 4.41Å; I137-A151 PolarHBondContact N-O 3.31Å; I137-A151 PolarHBondContact O-N 3.25Å; I137-I179 HydrophobicContact CD1-CB 4.2Å; I137-I179 HydrophobicContact CD1-CG2 3.8Å; I137-I179 WeakPolarHBondContact CD1-O 3.38Å; I137-V182 HydrophobicContact CG2-CB 4.16Å; I137-V182 HydrophobicContact CG2-CG2 4.38Å
138	I	98.4	Very high	97.7	Very high	9 Å²	9	37 Å²	37	5%	0.046	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	145.8	168	54.3	167.9	0	0	0	109.5	D87 D89 A99 V107 V135 L149	D87-I138 HydrophobicContact CB-CG1 4.02Å; D87-I138 PolarHBondContact OD2-N 3.14Å; D89-I138 HydrophobicContact CB-CD1 3.88Å; D89-I138 HydrophobicContact CB-CG1 4.02Å; A99-I138 VanDerWaalsContact C-CD1 3.45Å; A99-I138 HydrophobicContact CB-CD1 3.81Å; A99-I138 WeakPolarHBondContact O-CD1 3.29Å; V107-I138 HydrophobicContact CG1-CG2 4.18Å; V107-I138 HydrophobicContact CG2-CG2 4.08Å; V135-I138 HydrophobicContact CG1-CG2 4.34Å; I138-L149 CarbonylContact C-O 3.48Å; I138-L149 VanDerWaalsContact CA-O 3.31Å; I138-L149 WeakPolarHBondContact CA-O 3.21Å
139	A	98.3	Very high	97.7	Very high	14 Å²	14	36.8 Å²	36.8	12%	0.116	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	117	177.2	0	0	0	0	0	110.4	L149 W184	A139-L149 PolarHBondContact N-O 3.24Å; A139-L149 WeakPolarHBondContact O-CB 3.46Å; A139-L149 PolarHBondContact O-N 2.9Å; A139-W184 PolarHBondContact O-NE1 2.91Å
140	W	98.6	Very high	97.8	Very high	13 Å²	13	29.7 Å²	29.7	5%	0.049	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	146	172.5	-71.6	96.3	0	0	0	111.4	D89 W90 C91 P92 V97 A99 V109 L148 V162 W184	D89-W140 PolarHBondContact O-NE1 2.73Å; D89-W140 PolarHBondContact OD2-N 3.31Å; W90-W140 VanDerWaalsContact C-CD1 3.49Å; W90-W140 VanDerWaalsContact O-CD1 3.23Å; C91-W140 HydrophobicContact CB-CD2 4.05Å; C91-W140 HydrophobicContact CB-CE3 4.4Å; C91-W140 HydrophobicContact CB-CH2 4.33Å; C91-W140 HydrophobicContact CB-CZ2 3.98Å; P92-W140 HydrophobicContact CG-CB 4Å; V97-W140 HydrophobicContact CG1-CH2 3.99Å; V97-W140 HydrophobicContact CG1-CZ2 3.87Å; A99-W140 HydrophobicContact CB-CZ2 3.8Å; V109-W140 HydrophobicContact CG1-CH2 4.16Å; V109-W140 HydrophobicContact CG1-CZ2 4.22Å; V109-W140 HydrophobicContact CG2-CH2 4.49Å; W140-L148 HydrophobicContact CD2-CD1 3.77Å; W140-L148 HydrophobicContact CE3-CB 4.13Å; W140-L148 HydrophobicContact CE3-CD1 4.21Å; W140-L148 HydrophobicContact CG-CD1 3.91Å; W140-L148 HydrophobicContact CZ3-CB 4.22Å; W140-V162 HydrophobicContact CH2-CB 4.34Å; W140-V162 HydrophobicContact CH2-CG1 4.22Å; W140-V162 HydrophobicContact CH2-CG2 3.85Å; W140-V162 HydrophobicContact CZ3-CB 4.34Å; W140-V162 HydrophobicContact CZ3-CG2 3.81Å; W140-W184 VanDerWaalsContact O-CD1 3.27Å
141	H	98.5	Very high	97.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.138	C	C	.	.			trans	-66.5	135.9	172.8	-164.6	-88	0	0	0	110.1	H93 T143 A144 V147 W184 G188 W379	H93-H141 PolarHBondContact CE1-O 3Å; H93-H141 VanDerWaalsContact CE1-O 3.25Å; H141-T143 VanDerWaalsContact C-N 3.34Å; H141-T143 PolarHBondContact CE1-OG1 3.46Å; H141-T143 PolarHBondContact ND1-N 2.86Å; H141-T143 PolarHBondContact ND1-OG1 2.83Å; H141-T143 PolarHBondContact O-N 3.23Å; H141-A144 HydrophobicContact CB-CB 4.39Å; H141-A144 WeakPolarHBondContact ND1-CB 3.23Å; H141-A144 PolarHBondContact ND1-N 3.08Å; H141-V147 HydrophobicContact CB-CB 3.61Å; H141-V147 HydrophobicContact CB-CG1 3.82Å; H141-V147 VanDerWaalsContact CB-O 3.31Å; H141-V147 WeakPolarHBondContact CB-O 3.04Å; H141-V147 PolarHBondContact N-O 3.16Å; H141-W184 AromaticContact CD2-CH2 3.69Å; H141-W184 AromaticContact CD2-CZ2 3.78Å; H141-W184 AromaticContact CD2-CZ3 3.84Å; H141-G188 WeakPolarHBondContact NE2-CA 3.3Å; H141-G188 PolarHBondContact NE2-O 3.25Å; H141-W379 AromaticContact CD2-CE2 3.98Å; H141-W379 AromaticContact CE1-CD1 3.73Å; H141-W379 AromaticContact CE1-NE1 3.6Å; H141-W379 AromaticContact NE2-CD1 3.65Å; H141-W379 AromaticContact NE2-CE2 3.36Å; H141-W379 AromaticContact NE2-CZ2 3.78Å; H141-W379 AromaticContact NE2-NE1 3.05Å; H141-W379 PolarHBondContact NE2-NE1 2.79Å
142	P	96.9	Very high	97.8	Very high	37 Å²	37	28.2 Å²	28.2	24%	0.24	14%	0.137	C	C	.	.	S	Bend	trans	-70	-28.8	-174.1	25.7	-34.3	0	0	0	113.5	H93 W184	H93-P142 PolarHBondContact NE2-O 2.91Å; P142-W184 HydrophobicContact CG-CB 4.11Å
143	T	97.1	Very high	97.8	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.006	11%	0.113	C	C	.	.	S	Bend	trans	-126.3	-13.3	-167.8	58.6	0	0	0	0	115.3	H141 N187 A372 A373 L374 A385 P387	H141-T143 VanDerWaalsContact C-N 3.34Å; H141-T143 PolarHBondContact CE1-OG1 3.46Å; H141-T143 PolarHBondContact ND1-N 2.86Å; H141-T143 PolarHBondContact ND1-OG1 2.83Å; H141-T143 PolarHBondContact O-N 3.23Å; T143-N187 PolarHBondContact OG1-O 3.07Å; T143-A372 CarbonylContact O-C 3.43Å; T143-A373 PolarHBondContact O-N 2.84Å; T143-L374 PolarHBondContact O-N 2.95Å; T143-A385 WeakPolarHBondContact CG2-O 3.26Å; T143-P387 HydrophobicContact CG2-CB 4.13Å; T143-P387 HydrophobicContact CG2-CG 3.62Å
144	A	97.6	Very high	97.8	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.096	C	C	.	.	B	Isolated β-bridge	trans	-113.1	127.9	-171.5	0	0	0	0	0	108.6	H93 H141 V147 L374 W379	H93-A144 PolarHBondContact CE1-O 3.05Å; H141-A144 HydrophobicContact CB-CB 4.39Å; H141-A144 WeakPolarHBondContact ND1-CB 3.23Å; H141-A144 PolarHBondContact ND1-N 3.08Å; A144-V147 HydrophobicContact CB-CB 4.24Å; A144-V147 HydrophobicContact CB-CG2 3.84Å; A144-L374 CarbonylContact C-O 3.51Å; A144-L374 WeakPolarHBondContact CA-O 3Å; A144-L374 HydrophobicContact CB-CB 4.45Å; A144-W379 HydrophobicContact CB-CB 3.87Å; A144-W379 HydrophobicContact CB-CG 4.06Å
145	R	95.8	Very high	97.8	Very high	116 Å²	116	16.2 Å²	16.2	44%	0.438	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	138.4	-176	-162.8	-175.8	-170.4	108.9	6.5	110.3	V147 A372 L374 E375	R145-V147 PolarHBondContact O-N 3.31Å; R145-A372 HydrophobicContact CB-CB 3.79Å; R145-A372 HydrophobicContact CG-CB 4.37Å; R145-L374 PolarHBondContact N-O 3.39Å; R145-E375 WeakPolarHBondContact CB-OE2 3.39Å; R145-E375 WeakPolarHBondContact CD-OE2 3.45Å
146	N	93.8	Very high	97.8	Very high	54 Å²	54	16.7 Å²	16.7	29%	0.289	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	6.1	174.3	-58.6	-26.5	0	0	0	116	V162	N146-V162 HydrophobicContact CB-CB 4.29Å; N146-V162 WeakPolarHBondContact O-CB 3.35Å; N146-V162 WeakPolarHBondContact O-CG2 3.38Å; N146-V162 PolarHBondContact O-N 3Å
147	V	98.5	Very high	97.8	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	124.2	177	-179.5	0	0	0	0	109.5	H141 A144 R145 I159 W160 L168 A376 W379	H141-V147 HydrophobicContact CB-CB 3.61Å; H141-V147 HydrophobicContact CB-CG1 3.82Å; H141-V147 VanDerWaalsContact CB-O 3.31Å; H141-V147 WeakPolarHBondContact CB-O 3.04Å; H141-V147 PolarHBondContact N-O 3.16Å; A144-V147 HydrophobicContact CB-CB 4.24Å; A144-V147 HydrophobicContact CB-CG2 3.84Å; R145-V147 PolarHBondContact O-N 3.31Å; V147-I159 HydrophobicContact CG1-CG2 3.63Å; V147-W160 WeakPolarHBondContact CA-O 3.14Å; V147-L168 HydrophobicContact CG2-CD1 4.32Å; V147-A376 HydrophobicContact CG2-CB 3.79Å; V147-W379 HydrophobicContact CG1-CE3 4.22Å; V147-W379 HydrophobicContact CG1-CH2 4.38Å; V147-W379 HydrophobicContact CG1-CZ3 3.94Å; V147-W379 HydrophobicContact CG2-CE3 4.15Å
148	L	98.7	Very high	97.8	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	134.3	179.9	178	65.8	0	0	0	110.1	A99 V107 V109 L128 W140 I159 W160 V162	A99-L148 HydrophobicContact CB-CD1 4.28Å; A99-L148 HydrophobicContact CB-CD2 3.84Å; V107-L148 HydrophobicContact CG1-CD2 3.82Å; V109-L148 HydrophobicContact CG2-CD2 4.32Å; L128-L148 HydrophobicContact CD1-CD2 3.98Å; W140-L148 HydrophobicContact CD2-CD1 3.77Å; W140-L148 HydrophobicContact CE3-CB 4.13Å; W140-L148 HydrophobicContact CE3-CD1 4.21Å; W140-L148 HydrophobicContact CG-CD1 3.91Å; W140-L148 HydrophobicContact CZ3-CB 4.22Å; L148-I159 WeakPolarHBondContact O-CA 3.46Å; L148-W160 PolarHBondContact N-O 2.97Å; L148-W160 PolarHBondContact O-N 2.94Å; L148-V162 HydrophobicContact CB-CG2 3.68Å; L148-V162 HydrophobicContact CD2-CG2 4.12Å
149	L	98.8	Very high	97.8	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	138.5	170.5	-175.7	150.6	0	0	0	110	I138 A139 V157 L158 I159 V182 W184 F191	I138-L149 CarbonylContact C-O 3.48Å; I138-L149 VanDerWaalsContact CA-O 3.31Å; I138-L149 WeakPolarHBondContact CA-O 3.21Å; A139-L149 PolarHBondContact N-O 3.24Å; A139-L149 WeakPolarHBondContact O-CB 3.46Å; A139-L149 PolarHBondContact O-N 2.9Å; L149-V157 HydrophobicContact CD1-CG1 3.7Å; L149-V157 HydrophobicContact CD2-CG1 3.91Å; L149-V157 HydrophobicContact CG-CG1 3.66Å; L149-L158 WeakPolarHBondContact CA-O 3.45Å; L149-I159 HydrophobicContact CD1-CG1 4.38Å; L149-I159 HydrophobicContact CG-CG1 4.44Å; L149-V182 HydrophobicContact CD1-CG1 3.75Å; L149-V182 HydrophobicContact CD2-CB 3.97Å; L149-V182 HydrophobicContact CD2-CG1 3.72Å; L149-V182 HydrophobicContact CD2-CG2 4.17Å; L149-V182 HydrophobicContact CG-CG1 4.42Å; L149-W184 HydrophobicContact CB-CZ2 3.87Å; L149-W184 HydrophobicContact CD1-CH2 4.31Å; L149-W184 HydrophobicContact CD1-CZ2 3.64Å; L149-W184 HydrophobicContact CG-CZ2 4.42Å; L149-F191 HydrophobicContact CD1-CD1 4.1Å; L149-F191 HydrophobicContact CD1-CE1 4.4Å; L149-F191 HydrophobicContact CD1-CG 4.26Å
150	S	98.7	Very high	97.8	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	144.9	167.1	65.4	0	0	0	0	111.4	H131 I137 V157 L158 W160	H131-S150 PolarHBondContact CD2-OG 3.2Å; H131-S150 PolarHBondContact NE2-OG 3.09Å; I137-S150 WeakPolarHBondContact O-CA 3.47Å; S150-V157 WeakPolarHBondContact O-CA 3.47Å; S150-L158 PolarHBondContact N-O 3.05Å; S150-L158 PolarHBondContact O-N 3.28Å; S150-W160 PolarHBondContact OG-NE1 2.88Å
151	A	98.6	Very high	97.8	Very high	2 Å²	2	14.7 Å²	14.7	2%	0.017	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	131.1	171.6	0	0	0	0	0	111.3	G136 I137 V156 V157 I179 V182	G136-A151 PolarHBondContact N-O 2.88Å; I137-A151 HydrophobicContact CB-CB 4.05Å; I137-A151 HydrophobicContact CD1-CB 4.12Å; I137-A151 HydrophobicContact CG2-CB 4.41Å; I137-A151 PolarHBondContact N-O 3.31Å; I137-A151 PolarHBondContact O-N 3.25Å; A151-V156 WeakPolarHBondContact CA-O 3.44Å; A151-V157 HydrophobicContact CB-CG2 4.05Å; A151-I179 HydrophobicContact CB-CD1 4.09Å; A151-I179 HydrophobicContact CB-CG2 4.47Å; A151-V182 HydrophobicContact CB-CG2 4.36Å
152	G	97.4	Very high	97.7	Very high	4 Å²	4	15.2 Å²	15.2	4%	0.041	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	166.5	-175.4	0	0	0	0	0	113.4	H131 R134 D154 N155 V156	H131-G152 PolarHBondContact CE1-N 2.82Å; H131-G152 VanDerWaalsContact CE1-N 3.34Å; R134-G152 CarbonylContact O-C 3.57Å; R134-G152 WeakPolarHBondContact O-CA 3.49Å; G152-D154 WeakPolarHBondContact CA-OD1 3.49Å; G152-D154 PolarHBondContact O-N 2.95Å; G152-D154 VanDerWaalsContact O-N 3.14Å; G152-N155 PolarHBondContact O-N 3.49Å; G152-V156 PolarHBondContact N-O 2.79Å
153	C	97.6	Very high	97.4	Very high	22 Å²	22	16 Å²	16	15%	0.149	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	1.8	170.2	-72.6	0	0	0	0	113.6	W36 K133 R134 L178	W36-C153 VanDerWaalsContact CH2-SG 3.55Å; K133-C153 HydrophobicContact CB-CB 4Å; K133-C153 HydrophobicContact CD-CB 4.35Å; K133-C153 WeakPolarHBondContact CD-O 3.33Å; R134-C153 HydrophobicContact CG-CB 3.8Å; R134-C153 WeakPolarHBondContact CG-SG 3.32Å; R134-C153 PolarHBondContact O-N 3.29Å; C153-L178 HydrophobicContact CB-CD1 4.21Å; C153-L178 VanDerWaalsContact SG-CD1 3.59Å
154	D	97.8	Very high	97.3	Very high	21 Å²	21	19.2 Å²	19.2	11%	0.112	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	1.9	165	55.3	1.7	0	0	0	112.5	H131 T132 K133 G152 V156	H131-D154 VanDerWaalsContact CA-OD2 3.28Å; H131-D154 WeakPolarHBondContact CA-OD2 3.21Å; H131-D154 IonicContact CE1-OD1 2.74Å; H131-D154 IonicContact CG-OD2 3.44Å; H131-D154 IonicContact ND1-OD1 2.66Å; H131-D154 PolarHBondContact ND1-OD1 2.58Å; H131-D154 IonicContact ND1-OD2 2.65Å; H131-D154 PolarHBondContact ND1-OD2 3.04Å; T132-D154 PolarHBondContact N-OD2 3.36Å; T132-D154 VanDerWaalsContact OG1-CB 3.29Å; T132-D154 WeakPolarHBondContact OG1-CB 3.39Å; T132-D154 PolarHBondContact OG1-OD2 3.47Å; K133-D154 HydrophobicContact CB-CB 4.15Å; K133-D154 HydrophobicContact CD-CB 4.19Å; K133-D154 HydrophobicContact CG-CB 4.21Å; G152-D154 WeakPolarHBondContact CA-OD1 3.49Å; G152-D154 PolarHBondContact O-N 2.95Å; G152-D154 VanDerWaalsContact O-N 3.14Å; D154-V156 HydrophobicContact CB-CG2 4.31Å; D154-V156 PolarHBondContact O-N 2.96Å; D154-V156 PolarHBondContact OD1-N 3.32Å
155	N	97.9	Very high	97.2	Very high	30 Å²	30	21.6 Å²	21.6	16%	0.16	13%	0.132	C	C	.	.	S	Bend	trans	63.3	20.4	179.9	-47	-22.2	0	0	0	112.7	G152 H175 D177 L178	G152-N155 PolarHBondContact O-N 3.49Å; N155-H175 HydrophobicContact CB-CB 4.32Å; N155-H175 WeakPolarHBondContact CB-O 3.19Å; N155-D177 VanDerWaalsContact CG-O 3.24Å; N155-D177 WeakPolarHBondContact ND2-CA 3.24Å; N155-D177 PolarHBondContact OD1-O 3.38Å; N155-L178 VanDerWaalsContact OD1-CA 3.31Å; N155-L178 WeakPolarHBondContact OD1-CA 3.47Å; N155-L178 PolarHBondContact OD1-N 2.85Å
156	V	98.1	Very high	97.2	Very high	11 Å²	11	21.3 Å²	21.3	7%	0.067	14%	0.136	C	C	.	.			trans	-97	140.2	175	-175.6	0	0	0	0	108.4	H131 A151 G152 D154 L158 R170 L171 D172	H131-V156 PolarHBondContact CE1-O 3.34Å; H131-V156 VanDerWaalsContact CE1-O 3.26Å; A151-V156 WeakPolarHBondContact CA-O 3.44Å; G152-V156 PolarHBondContact N-O 2.79Å; D154-V156 HydrophobicContact CB-CG2 4.31Å; D154-V156 PolarHBondContact O-N 2.96Å; D154-V156 PolarHBondContact OD1-N 3.32Å; V156-L158 HydrophobicContact CG1-CD2 3.6Å; V156-L158 HydrophobicContact CG1-CG 3.95Å; V156-R170 HydrophobicContact CG1-CG 4.03Å; V156-L171 WeakPolarHBondContact CA-O 3.3Å; V156-D172 HydrophobicContact CG1-CB 4.19Å; V156-D172 HydrophobicContact CG2-CB 3.94Å
157	V	98.6	Very high	97.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	126.7	163.4	-178.6	0	0	0	0	108.2	L149 S150 A151 L171 I179 F191	L149-V157 HydrophobicContact CD1-CG1 3.7Å; L149-V157 HydrophobicContact CD2-CG1 3.91Å; L149-V157 HydrophobicContact CG-CG1 3.66Å; S150-V157 WeakPolarHBondContact O-CA 3.47Å; A151-V157 HydrophobicContact CB-CG2 4.05Å; V157-L171 HydrophobicContact CB-CB 4.16Å; V157-L171 HydrophobicContact CB-CD1 4.31Å; V157-L171 HydrophobicContact CG1-CD1 4.4Å; V157-L171 PolarHBondContact N-O 3.4Å; V157-L171 PolarHBondContact O-N 3Å; V157-I179 HydrophobicContact CG2-CD1 3.55Å; V157-F191 HydrophobicContact CG1-CZ 4.25Å; V157-F191 HydrophobicContact CG2-CZ 4.48Å
158	L	98.6	Very high	97.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	142.3	175.6	-61.4	-179.1	0	0	0	109.7	L149 S150 V156 W160 E167 Y169 R170	L149-L158 WeakPolarHBondContact CA-O 3.45Å; S150-L158 PolarHBondContact N-O 3.05Å; S150-L158 PolarHBondContact O-N 3.28Å; V156-L158 HydrophobicContact CG1-CD2 3.6Å; V156-L158 HydrophobicContact CG1-CG 3.95Å; L158-W160 HydrophobicContact CB-CZ2 3.76Å; L158-W160 HydrophobicContact CD1-CH2 3.87Å; L158-W160 HydrophobicContact CD1-CZ2 3.34Å; L158-W160 HydrophobicContact CG-CZ2 4.15Å; L158-E167 HydrophobicContact CD2-CG 4.27Å; L158-E167 WeakPolarHBondContact CD2-OE2 3.33Å; L158-Y169 WeakPolarHBondContact CA-O 3.4Å; L158-R170 HydrophobicContact CD2-CB 3.69Å; L158-R170 HydrophobicContact CD2-CG 3.56Å
159	I	98.6	Very high	97.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	129.7	174.5	-59	176.4	0	0	0	107.7	V147 L148 L149 L168 Y169 W184 P205 W379	V147-I159 HydrophobicContact CG1-CG2 3.63Å; L148-I159 WeakPolarHBondContact O-CA 3.46Å; L149-I159 HydrophobicContact CD1-CG1 4.38Å; L149-I159 HydrophobicContact CG-CG1 4.44Å; I159-L168 HydrophobicContact CG2-CB 4.4Å; I159-L168 HydrophobicContact CG2-CD1 4.33Å; I159-L168 WeakPolarHBondContact O-CB 3.2Å; I159-L168 PolarHBondContact O-N 3.1Å; I159-Y169 HydrophobicContact CB-CD2 4.27Å; I159-Y169 HydrophobicContact CD1-CD2 4.3Å; I159-Y169 HydrophobicContact CG2-CD2 4.33Å; I159-Y169 PolarHBondContact N-O 2.84Å; I159-Y169 PolarHBondContact O-N 2.91Å; I159-W184 HydrophobicContact CD1-CH2 4.06Å; I159-W184 HydrophobicContact CD1-CZ2 4.45Å; I159-P205 HydrophobicContact CD1-CB 3.19Å; I159-P205 HydrophobicContact CD1-CG 4.13Å; I159-W379 HydrophobicContact CD1-CH2 4.14Å; I159-W379 HydrophobicContact CG2-CH2 4Å; I159-W379 HydrophobicContact CG2-CZ3 3.98Å
160	W	98.6	Very high	97.3	Very high	6 Å²	6	31.1 Å²	31.1	2%	0.023	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	145.6	-169.6	-53.6	95.5	0	0	0	110.9	L128 E129 V147 L148 S150 L158 E166 E167	L128-W160 HydrophobicContact CB-CD2 4.06Å; L128-W160 HydrophobicContact CB-CE3 4.18Å; L128-W160 HydrophobicContact CB-CH2 4.32Å; L128-W160 HydrophobicContact CB-CZ2 4.19Å; L128-W160 HydrophobicContact CB-CZ3 4.31Å; L128-W160 HydrophobicContact CD1-CB 3.93Å; L128-W160 HydrophobicContact CD1-CD2 4.04Å; L128-W160 HydrophobicContact CD1-CG 3.71Å; L128-W160 HydrophobicContact CD2-CB 4.36Å; L128-W160 HydrophobicContact CD2-CD2 4.18Å; L128-W160 HydrophobicContact CD2-CE3 3.95Å; L128-W160 HydrophobicContact CD2-CG 4.39Å; L128-W160 HydrophobicContact CG-CD2 4.32Å; L128-W160 HydrophobicContact CG-CE3 4.48Å; L128-W160 HydrophobicContact CG-CG 4.46Å; E129-W160 WeakPolarHBondContact O-CH2 3.23Å; V147-W160 WeakPolarHBondContact CA-O 3.14Å; L148-W160 PolarHBondContact N-O 2.97Å; L148-W160 PolarHBondContact O-N 2.94Å; S150-W160 PolarHBondContact OG-NE1 2.88Å; L158-W160 HydrophobicContact CB-CZ2 3.76Å; L158-W160 HydrophobicContact CD1-CH2 3.87Å; L158-W160 HydrophobicContact CD1-CZ2 3.34Å; L158-W160 HydrophobicContact CG-CZ2 4.15Å; W160-E166 WeakPolarHBondContact CA-O 3.31Å; W160-E167 HydrophobicContact CE3-CB 4.06Å; W160-E167 HydrophobicContact CH2-CB 4.5Å; W160-E167 HydrophobicContact CZ3-CB 3.79Å; W160-E167 HydrophobicContact CZ3-CG 4.32Å
161	N	97.9	Very high	97.2	Very high	5 Å²	5	31.5 Å²	31.5	3%	0.027	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	106.1	155.2	-174.7	-17.6	0	0	0	107.7	G163 T164 A165 E166 L168 A376 E377	N161-G163 PolarHBondContact O-N 2.81Å; N161-G163 WeakPolarHBondContact OD1-CA 3.42Å; N161-G163 PolarHBondContact OD1-N 2.86Å; N161-T164 WeakPolarHBondContact CB-OG1 3.4Å; N161-T164 PolarHBondContact O-N 2.85Å; N161-A165 VanDerWaalsContact O-CA 3.32Å; N161-A165 WeakPolarHBondContact O-CA 3.43Å; N161-A165 PolarHBondContact O-N 3.45Å; N161-E166 PolarHBondContact N-O 3.11Å; N161-E166 PolarHBondContact O-N 2.97Å; N161-L168 HydrophobicContact CB-CD1 3.99Å; N161-L168 HydrophobicContact CB-CD2 3.97Å; N161-L168 HydrophobicContact CB-CG 3.96Å; N161-A376 WeakPolarHBondContact ND2-CB 3.43Å; N161-E377 PolarHBondContact ND2-OE1 3.4Å
162	V	95.6	Very high	97.1	Very high	11 Å²	11	36 Å²	36	7%	0.067	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-28.2	179.6	176.9	0	0	0	0	111.6	V109 V126 L128 W140 N146 L148 T164	V109-V162 HydrophobicContact CB-CG1 4.12Å; V109-V162 HydrophobicContact CG1-CG1 3.97Å; V109-V162 HydrophobicContact CG2-CG1 3.79Å; V109-V162 HydrophobicContact CG2-CG2 4.22Å; V126-V162 HydrophobicContact CB-CG1 4.47Å; V126-V162 HydrophobicContact CG2-CG1 4.15Å; V126-V162 WeakPolarHBondContact CG2-O 3.44Å; L128-V162 HydrophobicContact CD1-CG2 4.39Å; W140-V162 HydrophobicContact CH2-CB 4.34Å; W140-V162 HydrophobicContact CH2-CG1 4.22Å; W140-V162 HydrophobicContact CH2-CG2 3.85Å; W140-V162 HydrophobicContact CZ3-CB 4.34Å; W140-V162 HydrophobicContact CZ3-CG2 3.81Å; N146-V162 HydrophobicContact CB-CB 4.29Å; N146-V162 WeakPolarHBondContact O-CB 3.35Å; N146-V162 WeakPolarHBondContact O-CG2 3.38Å; N146-V162 PolarHBondContact O-N 3Å; L148-V162 HydrophobicContact CB-CG2 3.68Å; L148-V162 HydrophobicContact CD2-CG2 4.12Å; V162-T164 VanDerWaalsContact C-N 3.33Å; V162-T164 PolarHBondContact O-N 3.4Å
163	G	92.1	Very high	96.8	Very high	54 Å²	54	40.8 Å²	40.8	56%	0.557	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-31.8	179.5	0	0	0	0	0	113.4	N161	N161-G163 PolarHBondContact O-N 2.81Å; N161-G163 WeakPolarHBondContact OD1-CA 3.42Å; N161-G163 PolarHBondContact OD1-N 2.86Å
164	T	94.8	Very high	96.7	Very high	67 Å²	67	41.1 Å²	41.1	41%	0.411	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-8.3	179.9	61.1	0	0	0	0	113.6	N161 V162 E166	N161-T164 WeakPolarHBondContact CB-OG1 3.4Å; N161-T164 PolarHBondContact O-N 2.85Å; V162-T164 VanDerWaalsContact C-N 3.33Å; V162-T164 PolarHBondContact O-N 3.4Å; T164-E166 WeakPolarHBondContact CB-OE2 3.3Å; T164-E166 PolarHBondContact O-N 2.96Å; T164-E166 WeakPolarHBondContact OG1-CB 3.38Å; T164-E166 WeakPolarHBondContact OG1-CG 3.45Å; T164-E166 PolarHBondContact OG1-OE2 3.21Å
165	A	94.8	Very high	96.7	Very high	50 Å²	50	40.4 Å²	40.4	41%	0.413	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	26	-170.5	0	0	0	0	0	113.8	V126 L128 N161	V126-A165 HydrophobicContact CG1-CB 3.7Å; L128-A165 HydrophobicContact CD2-CB 4.28Å; N161-A165 VanDerWaalsContact O-CA 3.32Å; N161-A165 WeakPolarHBondContact O-CA 3.43Å; N161-A165 PolarHBondContact O-N 3.45Å
166	E	96.3	Very high	96.6	Very high	110 Å²	110	43.4 Å²	43.4	51%	0.514	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	142.3	-179	-67.8	170.4	151.4	0	0	112	W160 N161 T164 L168	W160-E166 WeakPolarHBondContact CA-O 3.31Å; N161-E166 PolarHBondContact N-O 3.11Å; N161-E166 PolarHBondContact O-N 2.97Å; T164-E166 WeakPolarHBondContact CB-OE2 3.3Å; T164-E166 PolarHBondContact O-N 2.96Å; T164-E166 WeakPolarHBondContact OG1-CB 3.38Å; T164-E166 WeakPolarHBondContact OG1-CG 3.45Å; T164-E166 PolarHBondContact OG1-OE2 3.21Å; E166-L168 PolarHBondContact O-N 3.47Å
167	E	97.6	Very high	96.6	Very high	82 Å²	82	45.5 Å²	45.5	38%	0.383	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	109.2	165.9	-171.6	-175.3	98.8	0	0	108.3	L158 W160 R170	L158-E167 HydrophobicContact CD2-CG 4.27Å; L158-E167 WeakPolarHBondContact CD2-OE2 3.33Å; W160-E167 HydrophobicContact CE3-CB 4.06Å; W160-E167 HydrophobicContact CH2-CB 4.5Å; W160-E167 HydrophobicContact CZ3-CB 3.79Å; W160-E167 HydrophobicContact CZ3-CG 4.32Å; E167-R170 WeakPolarHBondContact OE1-CB 3.46Å; E167-R170 IonicContact OE1-NH1 2.85Å; E167-R170 IonicContact OE2-NH1 3.54Å; E167-R170 PolarHBondContact OE2-NH1 3.24Å
168	L	97.4	Very high	96.5	Very high	42 Å²	42	47.5 Å²	47.5	22%	0.22	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-45.9	177.5	-65	177.9	0	0	0	111.4	V147 I159 N161 E166 W379 V380	V147-L168 HydrophobicContact CG2-CD1 4.32Å; I159-L168 HydrophobicContact CG2-CB 4.4Å; I159-L168 HydrophobicContact CG2-CD1 4.33Å; I159-L168 WeakPolarHBondContact O-CB 3.2Å; I159-L168 PolarHBondContact O-N 3.1Å; N161-L168 HydrophobicContact CB-CD1 3.99Å; N161-L168 HydrophobicContact CB-CD2 3.97Å; N161-L168 HydrophobicContact CB-CG 3.96Å; E166-L168 PolarHBondContact O-N 3.47Å; L168-W379 HydrophobicContact CD1-CZ3 4.29Å; L168-V380 HydrophobicContact CD1-CG2 3.81Å; L168-V380 HydrophobicContact CD2-CG2 3.93Å; L168-V380 HydrophobicContact CG-CG2 4.33Å
169	Y	98	Very high	96.4	Very high	42 Å²	42	47.7 Å²	47.7	17%	0.165	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	142.7	-178	-58.2	-76.1	0	0	0	111.5	L158 I159 R206 W379 V380	L158-Y169 WeakPolarHBondContact CA-O 3.4Å; I159-Y169 HydrophobicContact CB-CD2 4.27Å; I159-Y169 HydrophobicContact CD1-CD2 4.3Å; I159-Y169 HydrophobicContact CG2-CD2 4.33Å; I159-Y169 PolarHBondContact N-O 2.84Å; I159-Y169 PolarHBondContact O-N 2.91Å; Y169-R206 HydrophobicContact CE1-CB 4.32Å; Y169-R206 WeakPolarHBondContact CE1-O 3.14Å; Y169-R206 HydrophobicContact CE2-CB 4.35Å; Y169-R206 HydrophobicContact CE2-CG 3.88Å; Y169-W379 HydrophobicContact CD2-CH2 4.1Å; Y169-W379 HydrophobicContact CD2-CZ3 4.01Å; Y169-W379 HydrophobicContact CE2-CE3 4.46Å; Y169-W379 AromaticContact CE2-CH2 3.91Å; Y169-W379 HydrophobicContact CE2-CH2 3.91Å; Y169-W379 AromaticContact CE2-CZ3 3.59Å; Y169-W379 HydrophobicContact CE2-CZ3 3.59Å; Y169-V380 HydrophobicContact CE2-CG2 4.2Å; Y169-V380 PolarHBondContact OH-O 3.21Å
170	R	97.8	Very high	96.4	Very high	94 Å²	94	49.1 Å²	49.1	36%	0.355	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	121.6	175	177.2	169.7	-155.6	104.9	4	110.8	G130 V156 L158 E167 D172	G130-R170 PolarHBondContact O-NH1 2.94Å; G130-R170 PolarHBondContact O-NH2 3.38Å; V156-R170 HydrophobicContact CG1-CG 4.03Å; L158-R170 HydrophobicContact CD2-CB 3.69Å; L158-R170 HydrophobicContact CD2-CG 3.56Å; E167-R170 WeakPolarHBondContact OE1-CB 3.46Å; E167-R170 IonicContact OE1-NH1 2.85Å; E167-R170 IonicContact OE2-NH1 3.54Å; E167-R170 PolarHBondContact OE2-NH1 3.24Å; R170-D172 HydrophobicContact CG-CB 4.44Å
171	L	97.8	Very high	96.3	Very high	9 Å²	9	49.7 Å²	49.7	5%	0.047	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	91	-179	-50.2	175.8	0	0	0	108.6	V156 V157 L174 F191 I203 P205	V156-L171 WeakPolarHBondContact CA-O 3.3Å; V157-L171 HydrophobicContact CB-CB 4.16Å; V157-L171 HydrophobicContact CB-CD1 4.31Å; V157-L171 HydrophobicContact CG1-CD1 4.4Å; V157-L171 PolarHBondContact N-O 3.4Å; V157-L171 PolarHBondContact O-N 3Å; L171-L174 HydrophobicContact CB-CD1 4.08Å; L171-L174 HydrophobicContact CD1-CD1 4.2Å; L171-L174 HydrophobicContact CD2-CD1 4.28Å; L171-L174 HydrophobicContact CG-CD1 4.43Å; L171-F191 HydrophobicContact CD1-CE1 3.63Å; L171-F191 HydrophobicContact CD1-CZ 3.69Å; L171-I203 HydrophobicContact CD1-CG2 4.17Å; L171-P205 HydrophobicContact CD1-CB 4.45Å
172	D	94.9	Very high	96.3	Very high	97 Å²	97	50.1 Å²	50.1	52%	0.519	29%	0.285	S	S	.	.			trans	-106.9	-11.5	-171.9	61.6	-3.3	0	0	0	114.5	V156 R170	V156-D172 HydrophobicContact CG1-CB 4.19Å; V156-D172 HydrophobicContact CG2-CB 3.94Å; R170-D172 HydrophobicContact CG-CB 4.44Å
173	S	92.6	Very high	96.5	Very high	103 Å²	103	50.9 Å²	50.9	72%	0.72	29%	0.291	S	S	*	.	S	Bend	trans	-111.9	-5.2	-173.3	48.8	0	0	0	0	114.2
174	L	94.7	Very high	96.7	Very high	29 Å²	29	49.3 Å²	49.3	15%	0.152	27%	0.268	C	S	.	.	S	Bend	trans	-83.1	-20.7	-175.5	-61.2	-178.3	0	0	0	113.7	L171 I203	L171-L174 HydrophobicContact CB-CD1 4.08Å; L171-L174 HydrophobicContact CD1-CD1 4.2Å; L171-L174 HydrophobicContact CD2-CD1 4.28Å; L171-L174 HydrophobicContact CG-CD1 4.43Å; L174-I203 HydrophobicContact CB-CD1 4.37Å; L174-I203 HydrophobicContact CD1-CB 4.5Å; L174-I203 HydrophobicContact CD1-CD1 3.85Å; L174-I203 HydrophobicContact CD1-CG1 4.1Å; L174-I203 HydrophobicContact CD1-CG2 3.57Å
175	H	97.4	Very high	96.9	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.028	25%	0.254	C	S	.	.			trans	-124.6	109	-173.7	-60.9	93.1	0	0	0	111	N155 D177 I179 S193	N155-H175 HydrophobicContact CB-CB 4.32Å; N155-H175 WeakPolarHBondContact CB-O 3.19Å; H175-D177 VanDerWaalsContact C-N 3.33Å; H175-D177 PolarHBondContact O-N 2.99Å; H175-I179 HydrophobicContact CB-CD1 4.05Å; H175-I179 HydrophobicContact CB-CG1 3.86Å; H175-S193 PolarHBondContact NE2-OG 3.21Å
176	P	96.5	Very high	96.9	Very high	94 Å²	94	49.1 Å²	49.1	61%	0.61	25%	0.251	S	S	*	.	S	Bend	trans	-78.5	-14.7	-178.1	31.2	-35.8	0	0	0	113.9	D197	P176-D197 WeakPolarHBondContact CD-OD2 3.33Å; P176-D197 HydrophobicContact CG-CB 4.24Å; P176-D197 VanDerWaalsContact CG-OD2 3.23Å; P176-D197 WeakPolarHBondContact CG-OD2 3.37Å
177	D	96.8	Very high	96.9	Very high	54 Å²	54	45.5 Å²	45.5	29%	0.289	24%	0.235	S	C	.	.	S	Bend	trans	-143.1	-177.3	179.4	-156.9	-14.9	0	0	0	109.8	N155 H175 I179 C195 K196	N155-D177 VanDerWaalsContact CG-O 3.24Å; N155-D177 WeakPolarHBondContact ND2-CA 3.24Å; N155-D177 PolarHBondContact OD1-O 3.38Å; H175-D177 VanDerWaalsContact C-N 3.33Å; H175-D177 PolarHBondContact O-N 2.99Å; D177-I179 PolarHBondContact O-N 3.28Å; D177-C195 PolarHBondContact O-SG 2.61Å; D177-C195 VanDerWaalsContact O-SG 3.38Å; D177-K196 HydrophobicContact CB-CB 4.07Å; D177-K196 IonicContact OD1-NZ 2.69Å; D177-K196 WeakPolarHBondContact OD2-CD 3.27Å; D177-K196 WeakPolarHBondContact OD2-CG 3.34Å; D177-K196 IonicContact OD2-NZ 2.93Å
178	L	96.8	Very high	96.8	Very high	42 Å²	42	41.6 Å²	41.6	22%	0.22	22%	0.217	C	C	.	.			trans	-52.5	127.5	-174.4	-177.5	65.2	0	0	0	112.5	C153 N155 Y180 K196	C153-L178 HydrophobicContact CB-CD1 4.21Å; C153-L178 VanDerWaalsContact SG-CD1 3.59Å; N155-L178 VanDerWaalsContact OD1-CA 3.31Å; N155-L178 WeakPolarHBondContact OD1-CA 3.47Å; N155-L178 PolarHBondContact OD1-N 2.85Å; L178-Y180 HydrophobicContact CD2-CD1 4.34Å; L178-Y180 HydrophobicContact CD2-CE1 4.09Å; L178-K196 HydrophobicContact CB-CB 4.04Å; L178-K196 HydrophobicContact CB-CD 4.06Å; L178-K196 WeakPolarHBondContact O-CB 3.46Å; L178-K196 PolarHBondContact O-N 3.38Å
179	I	98.1	Very high	96.8	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.026	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	122.8	171.5	-53.7	170.7	0	0	0	107.9	I137 A151 V157 H175 D177 V182	I137-I179 HydrophobicContact CD1-CB 4.2Å; I137-I179 HydrophobicContact CD1-CG2 3.8Å; I137-I179 WeakPolarHBondContact CD1-O 3.38Å; A151-I179 HydrophobicContact CB-CD1 4.09Å; A151-I179 HydrophobicContact CB-CG2 4.47Å; V157-I179 HydrophobicContact CG2-CD1 3.55Å; H175-I179 HydrophobicContact CB-CD1 4.05Å; H175-I179 HydrophobicContact CB-CG1 3.86Å; D177-I179 PolarHBondContact O-N 3.28Å; I179-V182 HydrophobicContact CG2-CG2 3.94Å
180	Y	97.4	Very high	96.8	Very high	30 Å²	30	40 Å²	40	12%	0.118	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-47	179.1	-71.8	-43.4	0	0	0	111.8	L178 A194 K196 P223 M224 R225	L178-Y180 HydrophobicContact CD2-CD1 4.34Å; L178-Y180 HydrophobicContact CD2-CE1 4.09Å; Y180-A194 WeakPolarHBondContact CB-O 3.43Å; Y180-A194 PolarHBondContact N-O 3.12Å; Y180-K196 HydrophobicContact CE1-CB 4.2Å; Y180-K196 HydrophobicContact CE2-CB 3.83Å; Y180-K196 HydrophobicContact CE2-CG 4.43Å; Y180-K196 VanDerWaalsContact OH-CG 3.26Å; Y180-K196 WeakPolarHBondContact OH-CG 3.47Å; Y180-P223 HydrophobicContact CD1-CB 3.94Å; Y180-P223 HydrophobicContact CD1-CG 4.4Å; Y180-P223 HydrophobicContact CD2-CB 4.34Å; Y180-P223 HydrophobicContact CE1-CB 3.89Å; Y180-P223 HydrophobicContact CE1-CG 3.93Å; Y180-P223 HydrophobicContact CE2-CB 4.26Å; Y180-P223 HydrophobicContact CG-CB 4.17Å; Y180-M224 WeakPolarHBondContact CB-O 3.41Å; Y180-M224 HydrophobicContact CD2-CG 4.45Å; Y180-R225 PolarHBondContact O-NH1 2.83Å
181	N	97.6	Very high	96.8	Very high	18 Å²	18	35.6 Å²	35.6	10%	0.096	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	163.6	172.4	91.7	-79.4	0	0	0	111.2	S193 A194 R225 A226	N181-S193 VanDerWaalsContact O-CA 3.3Å; N181-S193 WeakPolarHBondContact O-CA 3.18Å; N181-A194 PolarHBondContact O-N 2.83Å; N181-A194 VanDerWaalsContact O-N 3.09Å; N181-A194 WeakPolarHBondContact OD1-CB 3.41Å; N181-R225 VanDerWaalsContact OD1-CA 3.26Å; N181-R225 WeakPolarHBondContact OD1-CA 3.21Å; N181-A226 PolarHBondContact ND2-O 3.07Å; N181-A226 PolarHBondContact OD1-N 3.27Å; N181-A226 PolarHBondContact OD1-O 2.84Å
182	V	98.1	Very high	96.8	Very high	14 Å²	14	35.1 Å²	35.1	9%	0.085	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	149.9	167.4	175.6	0	0	0	0	108.6	I137 L149 A151 I179 F191 C192	I137-V182 HydrophobicContact CG2-CB 4.16Å; I137-V182 HydrophobicContact CG2-CG2 4.38Å; L149-V182 HydrophobicContact CD1-CG1 3.75Å; L149-V182 HydrophobicContact CD2-CB 3.97Å; L149-V182 HydrophobicContact CD2-CG1 3.72Å; L149-V182 HydrophobicContact CD2-CG2 4.17Å; L149-V182 HydrophobicContact CG-CG1 4.42Å; A151-V182 HydrophobicContact CB-CG2 4.36Å; I179-V182 HydrophobicContact CG2-CG2 3.94Å; V182-F191 HydrophobicContact CG1-CB 3.9Å; V182-F191 HydrophobicContact CG1-CD2 3.49Å; V182-F191 VanDerWaalsContact CG1-CD2 3.49Å; V182-F191 HydrophobicContact CG1-CE2 4.2Å; V182-F191 HydrophobicContact CG1-CG 3.86Å; V182-F191 HydrophobicContact CG2-CD2 4.49Å; V182-C192 CarbonylContact C-O 3.51Å; V182-C192 WeakPolarHBondContact CA-O 3.47Å
183	S	97.9	Very high	97	Very high	26 Å²	26	30.5 Å²	30.5	18%	0.182	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	127.8	171.6	178.9	0	0	0	0	109.7	F191 C192 F228	S183-F191 CarbonylContact O-C 3.57Å; S183-F191 VanDerWaalsContact O-CA 3.23Å; S183-F191 WeakPolarHBondContact O-CA 3.22Å; S183-F191 WeakPolarHBondContact O-CB 3.34Å; S183-C192 PolarHBondContact N-O 3.05Å; S183-C192 PolarHBondContact O-N 3.38Å; S183-F228 WeakPolarHBondContact O-CD2 3.36Å
184	W	98.4	Very high	97.2	Very high	22 Å²	22	25.6 Å²	25.6	8%	0.083	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	149.7	169.5	-70.9	110.3	0	0	0	111.3	A139 W140 H141 P142 L149 I159 G188 F191 P205 W379	A139-W184 PolarHBondContact O-NE1 2.91Å; W140-W184 VanDerWaalsContact O-CD1 3.27Å; H141-W184 AromaticContact CD2-CH2 3.69Å; H141-W184 AromaticContact CD2-CZ2 3.78Å; H141-W184 AromaticContact CD2-CZ3 3.84Å; P142-W184 HydrophobicContact CG-CB 4.11Å; L149-W184 HydrophobicContact CB-CZ2 3.87Å; L149-W184 HydrophobicContact CD1-CH2 4.31Å; L149-W184 HydrophobicContact CD1-CZ2 3.64Å; L149-W184 HydrophobicContact CG-CZ2 4.42Å; I159-W184 HydrophobicContact CD1-CH2 4.06Å; I159-W184 HydrophobicContact CD1-CZ2 4.45Å; W184-G188 VanDerWaalsContact CZ3-O 3.22Å; W184-G188 WeakPolarHBondContact CZ3-O 3.48Å; W184-F191 HydrophobicContact CD2-CB 4.29Å; W184-F191 HydrophobicContact CE3-CB 4.01Å; W184-F191 HydrophobicContact CZ3-CB 4.38Å; W184-F191 HydrophobicContact CZ3-CD1 4.47Å; W184-P205 HydrophobicContact CH2-CB 4.41Å; W184-P205 HydrophobicContact CH2-CG 3.87Å; W184-P205 HydrophobicContact CZ3-CG 3.79Å; W184-W379 HydrophobicContact CH2-CH2 4.24Å; W184-W379 AromaticContact CH2-CZ2 3.96Å; W184-W379 HydrophobicContact CH2-CZ2 3.96Å; W184-W379 HydrophobicContact CZ3-CZ2 4.24Å
185	N	97.5	Very high	97.3	Very high	22 Å²	22	24.2 Å²	24.2	12%	0.118	13%	0.127	C	C	.	.			trans	-77.2	174.4	163.3	72.4	-15.7	0	0	0	110.2	N187 G188 S189 L190 F228	N185-N187 VanDerWaalsContact C-N 3.33Å; N185-N187 VanDerWaalsContact CG-OD1 3.25Å; N185-N187 PolarHBondContact ND2-OD1 3.4Å; N185-N187 PolarHBondContact O-N 2.87Å; N185-N187 PolarHBondContact OD1-OD1 3.47Å; N185-N187 VanDerWaalsContact OD1-OD1 3.05Å; N185-G188 PolarHBondContact O-N 3.44Å; N185-G188 VanDerWaalsContact O-N 3.16Å; N185-G188 VanDerWaalsContact OD1-C 3.31Å; N185-G188 WeakPolarHBondContact OD1-CA 3.33Å; N185-G188 PolarHBondContact OD1-N 3.16Å; N185-S189 PolarHBondContact ND2-OG 3.07Å; N185-S189 PolarHBondContact OD1-N 3.02Å; N185-L190 VanDerWaalsContact CG-O 3.31Å; N185-L190 PolarHBondContact N-O 3.24Å; N185-L190 PolarHBondContact ND2-N 2.87Å; N185-L190 PolarHBondContact OD1-N 3.48Å; N185-L190 VanDerWaalsContact OD1-N 3.11Å; N185-L190 PolarHBondContact OD1-O 3Å; N185-F228 HydrophobicContact CB-CB 4.26Å; N185-F228 HydrophobicContact CB-CD1 4.18Å; N185-F228 HydrophobicContact CB-CD2 3.55Å; N185-F228 HydrophobicContact CB-CE1 4.39Å; N185-F228 HydrophobicContact CB-CE2 3.72Å; N185-F228 HydrophobicContact CB-CG 3.76Å; N185-F228 HydrophobicContact CB-CZ 4.16Å
186	R	95	Very high	97.3	Very high	90 Å²	90	28.5 Å²	28.5	34%	0.34	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-40.1	-171.3	-173.1	175.1	-176.7	124.9	4.7	114.4	P387	R186-P387 HydrophobicContact CG-CG 4.37Å; R186-P387 WeakPolarHBondContact O-CD 3.23Å; R186-P387 WeakPolarHBondContact O-CG 3.42Å
187	N	95.5	Very high	97.2	Very high	34 Å²	34	26.2 Å²	26.2	18%	0.182	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-4.2	-178.1	67.2	-3.5	0	0	0	113.6	T143 N185 S189 A385	T143-N187 PolarHBondContact OG1-O 3.07Å; N185-N187 VanDerWaalsContact C-N 3.33Å; N185-N187 VanDerWaalsContact CG-OD1 3.25Å; N185-N187 PolarHBondContact ND2-OD1 3.4Å; N185-N187 PolarHBondContact O-N 2.87Å; N185-N187 PolarHBondContact OD1-OD1 3.47Å; N185-N187 VanDerWaalsContact OD1-OD1 3.05Å; N187-S189 VanDerWaalsContact C-N 3.29Å; N187-S189 PolarHBondContact O-N 2.93Å; N187-S189 WeakPolarHBondContact OD1-CB 3.42Å; N187-S189 PolarHBondContact OD1-N 3.14Å; N187-S189 PolarHBondContact OD1-OG 3.41Å; N187-A385 WeakPolarHBondContact CB-O 3.31Å
188	G	96.6	Very high	97.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	72.7	13.8	-177.3	0	0	0	0	0	115	H141 W184 N185 L190 W379	H141-G188 WeakPolarHBondContact NE2-CA 3.3Å; H141-G188 PolarHBondContact NE2-O 3.25Å; W184-G188 VanDerWaalsContact CZ3-O 3.22Å; W184-G188 WeakPolarHBondContact CZ3-O 3.48Å; N185-G188 PolarHBondContact O-N 3.44Å; N185-G188 VanDerWaalsContact O-N 3.16Å; N185-G188 VanDerWaalsContact OD1-C 3.31Å; N185-G188 WeakPolarHBondContact OD1-CA 3.33Å; N185-G188 PolarHBondContact OD1-N 3.16Å; G188-L190 VanDerWaalsContact C-N 3.32Å; G188-W379 PolarHBondContact O-NE1 2.84Å
189	S	97.3	Very high	97.1	Very high	15 Å²	15	25 Å²	25	11%	0.105	12%	0.119	C	C	.	.	S	Bend	trans	-72.5	-27.1	175.5	70.8	0	0	0	0	112.9	N185 N187 P205 D384	N185-S189 PolarHBondContact ND2-OG 3.07Å; N185-S189 PolarHBondContact OD1-N 3.02Å; N187-S189 VanDerWaalsContact C-N 3.29Å; N187-S189 PolarHBondContact O-N 2.93Å; N187-S189 WeakPolarHBondContact OD1-CB 3.42Å; N187-S189 PolarHBondContact OD1-N 3.14Å; N187-S189 PolarHBondContact OD1-OG 3.41Å; S189-P205 WeakPolarHBondContact O-CD 3.48Å; S189-D384 WeakPolarHBondContact CB-OD1 3.11Å
190	L	97.9	Very high	97.1	Very high	37 Å²	37	25.1 Å²	25.1	19%	0.194	12%	0.121	C	C	.	.			trans	-135.7	155.7	-177.9	-58.9	174.6	0	0	0	110.3	N185 G188 I202 I203 D204 M211 F228	N185-L190 VanDerWaalsContact CG-O 3.31Å; N185-L190 PolarHBondContact N-O 3.24Å; N185-L190 PolarHBondContact ND2-N 2.87Å; N185-L190 PolarHBondContact OD1-N 3.48Å; N185-L190 VanDerWaalsContact OD1-N 3.11Å; N185-L190 PolarHBondContact OD1-O 3Å; G188-L190 VanDerWaalsContact C-N 3.32Å; L190-I202 HydrophobicContact CB-CG2 4.37Å; L190-I202 HydrophobicContact CD1-CG2 3.93Å; L190-I203 WeakPolarHBondContact CA-O 3.45Å; L190-D204 HydrophobicContact CD2-CB 3.8Å; L190-M211 HydrophobicContact CD2-CG 3.95Å; L190-F228 HydrophobicContact CB-CE2 4.35Å; L190-F228 HydrophobicContact CB-CZ 4.27Å
191	F	98.3	Very high	97.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	150.2	162.8	72.7	-95.5	0	0	0	110.8	L149 V157 L171 V182 S183 W184 I203 P205 F228	L149-F191 HydrophobicContact CD1-CD1 4.1Å; L149-F191 HydrophobicContact CD1-CE1 4.4Å; L149-F191 HydrophobicContact CD1-CG 4.26Å; V157-F191 HydrophobicContact CG1-CZ 4.25Å; V157-F191 HydrophobicContact CG2-CZ 4.48Å; L171-F191 HydrophobicContact CD1-CE1 3.63Å; L171-F191 HydrophobicContact CD1-CZ 3.69Å; V182-F191 HydrophobicContact CG1-CB 3.9Å; V182-F191 HydrophobicContact CG1-CD2 3.49Å; V182-F191 VanDerWaalsContact CG1-CD2 3.49Å; V182-F191 HydrophobicContact CG1-CE2 4.2Å; V182-F191 HydrophobicContact CG1-CG 3.86Å; V182-F191 HydrophobicContact CG2-CD2 4.49Å; S183-F191 CarbonylContact O-C 3.57Å; S183-F191 VanDerWaalsContact O-CA 3.23Å; S183-F191 WeakPolarHBondContact O-CA 3.22Å; S183-F191 WeakPolarHBondContact O-CB 3.34Å; W184-F191 HydrophobicContact CD2-CB 4.29Å; W184-F191 HydrophobicContact CE3-CB 4.01Å; W184-F191 HydrophobicContact CZ3-CB 4.38Å; W184-F191 HydrophobicContact CZ3-CD1 4.47Å; F191-I203 HydrophobicContact CD1-CB 4.39Å; F191-I203 HydrophobicContact CD1-CG2 4.49Å; F191-I203 HydrophobicContact CD2-CB 4.46Å; F191-I203 HydrophobicContact CE1-CB 3.87Å; F191-I203 HydrophobicContact CE1-CG2 3.64Å; F191-I203 HydrophobicContact CE2-CB 3.99Å; F191-I203 HydrophobicContact CE2-CD1 3.58Å; F191-I203 HydrophobicContact CE2-CG1 4.32Å; F191-I203 HydrophobicContact CE2-CG2 4.43Å; F191-I203 HydrophobicContact CZ-CB 3.66Å; F191-I203 HydrophobicContact CZ-CD1 3.65Å; F191-I203 HydrophobicContact CZ-CG1 4.25Å; F191-I203 HydrophobicContact CZ-CG2 3.61Å; F191-I203 PolarHBondContact N-O 2.58Å; F191-I203 VanDerWaalsContact N-O 3.1Å; F191-I203 PolarHBondContact O-N 3.17Å; F191-P205 HydrophobicContact CD1-CB 4.11Å; F191-P205 HydrophobicContact CD1-CG 4.22Å; F191-P205 HydrophobicContact CE1-CB 3.94Å; F191-F228 VanDerWaalsContact C-CE2 3.49Å
192	C	97.9	Very high	97.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	147.3	169.4	70.6	0	0	0	0	109.6	V182 S183 R201 I202 A226 F228	V182-C192 CarbonylContact C-O 3.51Å; V182-C192 WeakPolarHBondContact CA-O 3.47Å; S183-C192 PolarHBondContact N-O 3.05Å; S183-C192 PolarHBondContact O-N 3.38Å; C192-R201 CarbonylContact C-O 3.6Å; C192-R201 WeakPolarHBondContact CA-O 3.46Å; C192-I202 HydrophobicContact CB-CG1 4.46Å; C192-A226 PolarHBondContact SG-O 2.94Å; C192-A226 VanDerWaalsContact SG-O 3.42Å; C192-F228 HydrophobicContact CB-CD2 3.96Å; C192-F228 HydrophobicContact CB-CE2 3.61Å; C192-F228 HydrophobicContact CB-CZ 3.98Å
193	S	97.9	Very high	97.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	144.2	179	57.4	0	0	0	0	111.3	H175 N181 V200 R201	H175-S193 PolarHBondContact NE2-OG 3.21Å; N181-S193 VanDerWaalsContact O-CA 3.3Å; N181-S193 WeakPolarHBondContact O-CA 3.18Å; S193-V200 CarbonylContact O-C 3.19Å; S193-V200 VanDerWaalsContact O-CA 3.3Å; S193-V200 WeakPolarHBondContact O-CA 3.39Å; S193-R201 PolarHBondContact N-O 3.36Å; S193-R201 PolarHBondContact O-N 3.22Å
194	A	97.5	Very high	97.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130	171	0	0	0	0	0	109.5	Y180 N181 M224 A226	Y180-A194 WeakPolarHBondContact CB-O 3.43Å; Y180-A194 PolarHBondContact N-O 3.12Å; N181-A194 PolarHBondContact O-N 2.83Å; N181-A194 VanDerWaalsContact O-N 3.09Å; N181-A194 WeakPolarHBondContact OD1-CB 3.41Å; A194-M224 HydrophobicContact CB-CG 3.68Å; A194-A226 HydrophobicContact CB-CB 4.18Å
195	C	97	Very high	97	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	155.5	-175.2	-177.2	0	0	0	0	111.9	D177 D197 K198 S199	D177-C195 PolarHBondContact O-SG 2.61Å; D177-C195 VanDerWaalsContact O-SG 3.38Å; C195-D197 WeakPolarHBondContact CB-OD1 3.29Å; C195-D197 PolarHBondContact O-N 3.45Å; C195-D197 PolarHBondContact SG-OD1 2.96Å; C195-D197 PolarHBondContact SG-OD2 3.43Å; C195-K198 WeakPolarHBondContact O-CA 3.48Å; C195-K198 PolarHBondContact O-N 3.04Å; C195-S199 PolarHBondContact N-O 3.21Å
196	K	96.6	Very high	97	Very high	96 Å²	96	22.6 Å²	22.6	42%	0.417	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-19.9	179	178.1	169.1	165.8	-137.8	0	114.4	D177 L178 Y180 K198	D177-K196 HydrophobicContact CB-CB 4.07Å; D177-K196 IonicContact OD1-NZ 2.69Å; D177-K196 WeakPolarHBondContact OD2-CD 3.27Å; D177-K196 WeakPolarHBondContact OD2-CG 3.34Å; D177-K196 IonicContact OD2-NZ 2.93Å; L178-K196 HydrophobicContact CB-CB 4.04Å; L178-K196 HydrophobicContact CB-CD 4.06Å; L178-K196 WeakPolarHBondContact O-CB 3.46Å; L178-K196 PolarHBondContact O-N 3.38Å; Y180-K196 HydrophobicContact CE1-CB 4.2Å; Y180-K196 HydrophobicContact CE2-CB 3.83Å; Y180-K196 HydrophobicContact CE2-CG 4.43Å; Y180-K196 VanDerWaalsContact OH-CG 3.26Å; Y180-K196 WeakPolarHBondContact OH-CG 3.47Å; K196-K198 PolarHBondContact O-N 3.09Å; K196-K198 VanDerWaalsContact O-N 3.11Å
197	D	95.5	Very high	96.9	Very high	46 Å²	46	26.9 Å²	26.9	25%	0.246	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-1.8	166.9	65.7	3.1	0	0	0	113.8	P176 C195 S199 R201	P176-D197 WeakPolarHBondContact CD-OD2 3.33Å; P176-D197 HydrophobicContact CG-CB 4.24Å; P176-D197 VanDerWaalsContact CG-OD2 3.23Å; P176-D197 WeakPolarHBondContact CG-OD2 3.37Å; C195-D197 WeakPolarHBondContact CB-OD1 3.29Å; C195-D197 PolarHBondContact O-N 3.45Å; C195-D197 PolarHBondContact SG-OD1 2.96Å; C195-D197 PolarHBondContact SG-OD2 3.43Å; D197-S199 VanDerWaalsContact C-N 3.29Å; D197-S199 WeakPolarHBondContact OD1-CB 3.5Å; D197-S199 PolarHBondContact OD1-N 3.08Å; D197-R201 IonicContact OD1-NH1 3.3Å; D197-R201 IonicContact OD2-CZ 2.68Å; D197-R201 VanDerWaalsContact OD2-CZ 3.22Å; D197-R201 IonicContact OD2-NH1 3.24Å; D197-R201 PolarHBondContact OD2-NH1 3.02Å; D197-R201 IonicContact OD2-NH2 2.66Å; D197-R201 PolarHBondContact OD2-NH2 3Å
198	K	95.4	Very high	96.8	Very high	64 Å²	64	26.9 Å²	26.9	28%	0.278	13%	0.128	S	C	.	.	S	Bend	trans	75.5	10.4	-177.8	-46.6	178	-179	-173.1	0	114.6	C195 K196 K216 A217 E219 G220 M224	C195-K198 WeakPolarHBondContact O-CA 3.48Å; C195-K198 PolarHBondContact O-N 3.04Å; K196-K198 PolarHBondContact O-N 3.09Å; K196-K198 VanDerWaalsContact O-N 3.11Å; K198-K216 VanDerWaalsContact O-CA 3.27Å; K198-K216 WeakPolarHBondContact O-CA 3.41Å; K198-K216 PolarHBondContact O-N 2.91Å; K198-A217 PolarHBondContact O-N 2.8Å; K198-A217 VanDerWaalsContact O-N 3.14Å; K198-E219 PolarHBondContact NZ-O 2.84Å; K198-G220 VanDerWaalsContact CE-O 3.26Å; K198-G220 WeakPolarHBondContact CE-O 3.4Å; K198-M224 HydrophobicContact CB-CE 3.98Å; K198-M224 HydrophobicContact CG-CE 4.5Å
199	S	96.1	Very high	96.7	Very high	5 Å²	5	29.3 Å²	29.3	4%	0.035	14%	0.143	C	C	.	.			trans	-88.9	143.7	175	-67.7	0	0	0	0	111.9	C195 D197 E213 R214	C195-S199 PolarHBondContact N-O 3.21Å; D197-S199 VanDerWaalsContact C-N 3.29Å; D197-S199 WeakPolarHBondContact OD1-CB 3.5Å; D197-S199 PolarHBondContact OD1-N 3.08Å; S199-E213 WeakPolarHBondContact CB-OE1 3.44Å; S199-E213 PolarHBondContact OG-OE1 3.39Å; S199-R214 CarbonylContact C-O 3.6Å; S199-R214 VanDerWaalsContact CA-O 3.24Å; S199-R214 WeakPolarHBondContact CA-O 3.19Å
200	V	97.4	Very high	96.7	Very high	9 Å²	9	32 Å²	32	6%	0.055	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.9	164.1	174.9	0	0	0	0	108	S193 E213 R214 A217 M224 A226 V234 T236	S193-V200 CarbonylContact O-C 3.19Å; S193-V200 VanDerWaalsContact O-CA 3.3Å; S193-V200 WeakPolarHBondContact O-CA 3.39Å; V200-E213 WeakPolarHBondContact O-CA 3.43Å; V200-R214 PolarHBondContact N-O 3.29Å; V200-R214 PolarHBondContact O-N 2.91Å; V200-A217 HydrophobicContact CB-CB 4.34Å; V200-A217 HydrophobicContact CG2-CB 3.68Å; V200-M224 HydrophobicContact CG2-SD 3.94Å; V200-A226 HydrophobicContact CG1-CB 3.76Å; V200-A226 HydrophobicContact CG2-CB 4.21Å; V200-V234 HydrophobicContact CG1-CG1 4.18Å; V200-T236 HydrophobicContact CG1-CG2 4.49Å; V200-T236 HydrophobicContact CG2-CG2 4.06Å
201	R	97.7	Very high	96.6	Very high	16 Å²	16	35.2 Å²	35.2	6%	0.06	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	136.2	-175.1	-66.6	-175.8	177.6	90.2	3.4	111.1	C192 S193 D197 I203 L210 E213	C192-R201 CarbonylContact C-O 3.6Å; C192-R201 WeakPolarHBondContact CA-O 3.46Å; S193-R201 PolarHBondContact N-O 3.36Å; S193-R201 PolarHBondContact O-N 3.22Å; D197-R201 IonicContact OD1-NH1 3.3Å; D197-R201 IonicContact OD2-CZ 2.68Å; D197-R201 VanDerWaalsContact OD2-CZ 3.22Å; D197-R201 IonicContact OD2-NH1 3.24Å; D197-R201 PolarHBondContact OD2-NH1 3.02Å; D197-R201 IonicContact OD2-NH2 2.66Å; D197-R201 PolarHBondContact OD2-NH2 3Å; R201-I203 HydrophobicContact CB-CD1 4Å; R201-I203 HydrophobicContact CB-CG1 4.14Å; R201-L210 HydrophobicContact CB-CD1 3.63Å; R201-L210 HydrophobicContact CG-CD1 3.74Å; R201-E213 HydrophobicContact CG-CB 4.33Å; R201-E213 HydrophobicContact CG-CG 4.06Å; R201-E213 IonicContact CZ-OE1 3.63Å; R201-E213 VanDerWaalsContact CZ-OE1 3.24Å; R201-E213 IonicContact CZ-OE2 3.58Å; R201-E213 IonicContact NE-OE1 3.72Å; R201-E213 PolarHBondContact NE-OE1 3.4Å; R201-E213 IonicContact NE-OE2 2.7Å; R201-E213 PolarHBondContact NE-OE2 2.84Å; R201-E213 IonicContact NH2-OE1 3.67Å; R201-E213 PolarHBondContact NH2-OE1 3.35Å; R201-E213 IonicContact NH2-OE2 2.63Å
202	I	97.9	Very high	96.4	Very high	6 Å²	6	36.3 Å²	36.3	3%	0.031	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	122.5	168.8	-60.1	176.2	0	0	0	107.4	L190 C192 M211 A212 F228 V234 P252	L190-I202 HydrophobicContact CB-CG2 4.37Å; L190-I202 HydrophobicContact CD1-CG2 3.93Å; C192-I202 HydrophobicContact CB-CG1 4.46Å; I202-M211 HydrophobicContact CG2-CB 4.19Å; I202-M211 WeakPolarHBondContact O-CB 3.44Å; I202-M211 PolarHBondContact O-N 2.97Å; I202-A212 HydrophobicContact CB-CB 4.25Å; I202-A212 HydrophobicContact CD1-CB 4.27Å; I202-A212 PolarHBondContact N-O 3.27Å; I202-A212 PolarHBondContact O-N 2.97Å; I202-F228 HydrophobicContact CD1-CE1 4.36Å; I202-F228 HydrophobicContact CD1-CZ 4.43Å; I202-F228 HydrophobicContact CG1-CZ 4.22Å; I202-F228 HydrophobicContact CG2-CZ 3.91Å; I202-V234 HydrophobicContact CD1-CG2 3.84Å; I202-V234 HydrophobicContact CG1-CG2 4.26Å; I202-P252 HydrophobicContact CD1-CB 3.68Å; I202-P252 HydrophobicContact CD1-CG 3.96Å
203	I	98.4	Very high	96.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	136.1	-168.3	-64.9	161.7	0	0	0	109.3	L171 L174 L190 F191 R201 P205 L210	L171-I203 HydrophobicContact CD1-CG2 4.17Å; L174-I203 HydrophobicContact CB-CD1 4.37Å; L174-I203 HydrophobicContact CD1-CB 4.5Å; L174-I203 HydrophobicContact CD1-CD1 3.85Å; L174-I203 HydrophobicContact CD1-CG1 4.1Å; L174-I203 HydrophobicContact CD1-CG2 3.57Å; L190-I203 WeakPolarHBondContact CA-O 3.45Å; F191-I203 HydrophobicContact CD1-CB 4.39Å; F191-I203 HydrophobicContact CD1-CG2 4.49Å; F191-I203 HydrophobicContact CD2-CB 4.46Å; F191-I203 HydrophobicContact CE1-CB 3.87Å; F191-I203 HydrophobicContact CE1-CG2 3.64Å; F191-I203 HydrophobicContact CE2-CB 3.99Å; F191-I203 HydrophobicContact CE2-CD1 3.58Å; F191-I203 HydrophobicContact CE2-CG1 4.32Å; F191-I203 HydrophobicContact CE2-CG2 4.43Å; F191-I203 HydrophobicContact CZ-CB 3.66Å; F191-I203 HydrophobicContact CZ-CD1 3.65Å; F191-I203 HydrophobicContact CZ-CG1 4.25Å; F191-I203 HydrophobicContact CZ-CG2 3.61Å; F191-I203 PolarHBondContact N-O 2.58Å; F191-I203 VanDerWaalsContact N-O 3.1Å; F191-I203 PolarHBondContact O-N 3.17Å; R201-I203 HydrophobicContact CB-CD1 4Å; R201-I203 HydrophobicContact CB-CG1 4.14Å; I203-P205 WeakPolarHBondContact O-CD 3.34Å; I203-L210 HydrophobicContact CG1-CD1 4.12Å
204	D	97.6	Very high	96.2	Very high	15 Å²	15	42.3 Å²	42.3	8%	0.08	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	109.1	162.8	-177.4	-29	0	0	0	108.3	L190 R206 R207 G208 T209 M211	L190-D204 HydrophobicContact CD2-CB 3.8Å; D204-R206 PolarHBondContact O-N 2.93Å; D204-R206 PolarHBondContact OD1-N 3.48Å; D204-R207 HydrophobicContact CB-CB 4.3Å; D204-R207 PolarHBondContact OD1-N 3.14Å; D204-R207 WeakPolarHBondContact OD2-CD 3.47Å; D204-R207 WeakPolarHBondContact OD2-CG 3.39Å; D204-G208 WeakPolarHBondContact O-CA 3.43Å; D204-G208 PolarHBondContact O-N 2.88Å; D204-T209 PolarHBondContact N-O 3.02Å; D204-T209 PolarHBondContact O-N 2.83Å; D204-M211 HydrophobicContact CB-CG 4Å; D204-M211 HydrophobicContact CB-SD 4.06Å
205	P	97	Very high	96.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-34.2	-176.4	23.6	-31.6	0	0	0	113.9	I159 L171 W184 S189 F191 I203 R207 G208 W379	I159-P205 HydrophobicContact CD1-CB 3.19Å; I159-P205 HydrophobicContact CD1-CG 4.13Å; L171-P205 HydrophobicContact CD1-CB 4.45Å; W184-P205 HydrophobicContact CH2-CB 4.41Å; W184-P205 HydrophobicContact CH2-CG 3.87Å; W184-P205 HydrophobicContact CZ3-CG 3.79Å; S189-P205 WeakPolarHBondContact O-CD 3.48Å; F191-P205 HydrophobicContact CD1-CB 4.11Å; F191-P205 HydrophobicContact CD1-CG 4.22Å; F191-P205 HydrophobicContact CE1-CB 3.94Å; I203-P205 WeakPolarHBondContact O-CD 3.34Å; P205-R207 VanDerWaalsContact C-N 3.35Å; P205-G208 PolarHBondContact O-N 2.82Å; P205-W379 HydrophobicContact CG-CH2 4.22Å; P205-W379 HydrophobicContact CG-CZ2 3.89Å
206	R	95.8	Very high	95.9	Very high	41 Å²	41	55 Å²	55	16%	0.155	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-32.7	-173.7	-63.7	174.5	-65.7	-162.3	-4.1	111.4	Y169 D204 W379 G382 R383 D384	Y169-R206 HydrophobicContact CE1-CB 4.32Å; Y169-R206 WeakPolarHBondContact CE1-O 3.14Å; Y169-R206 HydrophobicContact CE2-CB 4.35Å; Y169-R206 HydrophobicContact CE2-CG 3.88Å; D204-R206 PolarHBondContact O-N 2.93Å; D204-R206 PolarHBondContact OD1-N 3.48Å; R206-W379 WeakPolarHBondContact CD-O 3.34Å; R206-W379 HydrophobicContact CG-CH2 3.93Å; R206-W379 HydrophobicContact CG-CZ2 3.81Å; R206-W379 HydrophobicContact CG-CZ3 4.4Å; R206-W379 PolarHBondContact NH1-O 3.25Å; R206-G382 VanDerWaalsContact NH1-C 3.34Å; R206-R383 PolarHBondContact NH1-O 2.92Å; R206-R383 VanDerWaalsContact NH1-O 3.15Å; R206-D384 IonicContact CZ-OD1 3.57Å; R206-D384 IonicContact NH1-OD1 2.79Å; R206-D384 PolarHBondContact NH1-OD1 2.85Å; R206-D384 IonicContact NH2-OD1 2.74Å; R206-D384 PolarHBondContact NH2-OD1 3.37Å; R206-D384 IonicContact NH2-OD2 3.96Å; R206-D384 PolarHBondContact NH2-OD2 2.93Å
207	R	94.3	Very high	95.8	Very high	181 Å²	181	50.9 Å²	50.9	68%	0.683	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-17.1	176.4	-59.7	-179.2	72.8	172.5	0.6	112.6	D204 P205 T209	D204-R207 HydrophobicContact CB-CB 4.3Å; D204-R207 PolarHBondContact OD1-N 3.14Å; D204-R207 WeakPolarHBondContact OD2-CD 3.47Å; D204-R207 WeakPolarHBondContact OD2-CG 3.39Å; P205-R207 VanDerWaalsContact C-N 3.35Å; R207-T209 HydrophobicContact CB-CG2 4.01Å; R207-T209 WeakPolarHBondContact CB-OG1 3.37Å; R207-T209 PolarHBondContact O-N 2.89Å
208	G	93.4	Very high	95.7	Very high	33 Å²	33	48.9 Å²	48.9	34%	0.34	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	27.5	-171.6	0	0	0	0	0	112.9	D204 P205	D204-G208 WeakPolarHBondContact O-CA 3.43Å; D204-G208 PolarHBondContact O-N 2.88Å; P205-G208 PolarHBondContact O-N 2.82Å
209	T	94.6	Very high	95.6	Very high	52 Å²	52	51.4 Å²	51.4	32%	0.319	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	136.6	-173.8	53	0	0	0	0	111.9	D204 R207 M211	D204-T209 PolarHBondContact N-O 3.02Å; D204-T209 PolarHBondContact O-N 2.83Å; R207-T209 HydrophobicContact CB-CG2 4.01Å; R207-T209 WeakPolarHBondContact CB-OG1 3.37Å; R207-T209 PolarHBondContact O-N 2.89Å; T209-M211 PolarHBondContact O-N 3.36Å
210	L	95.9	Very high	95.4	Very high	72 Å²	72	51.4 Å²	51.4	38%	0.377	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	116.2	167	-179.3	65.7	0	0	0	109.4	R201 I203 A212 E213	R201-L210 HydrophobicContact CB-CD1 3.63Å; R201-L210 HydrophobicContact CG-CD1 3.74Å; I203-L210 HydrophobicContact CG1-CD1 4.12Å; L210-A212 WeakPolarHBondContact CD1-O 3.46Å; L210-E213 HydrophobicContact CD1-CB 4.26Å; L210-E213 HydrophobicContact CD2-CB 3.98Å; L210-E213 VanDerWaalsContact CD2-OE2 3.31Å; L210-E213 WeakPolarHBondContact CD2-OE2 3.38Å; L210-E213 HydrophobicContact CG-CB 4.43Å
211	M	96.1	Very high	95	Very high	104 Å²	104	55 Å²	55	51%	0.512	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-41.5	-179.6	-62.3	-62	-68.1	0	0	111.5	L190 I202 D204 T209	L190-M211 HydrophobicContact CD2-CG 3.95Å; I202-M211 HydrophobicContact CG2-CB 4.19Å; I202-M211 WeakPolarHBondContact O-CB 3.44Å; I202-M211 PolarHBondContact O-N 2.97Å; D204-M211 HydrophobicContact CB-CG 4Å; D204-M211 HydrophobicContact CB-SD 4.06Å; T209-M211 PolarHBondContact O-N 3.36Å
212	A	95.3	Very high	94.7	Very high	22 Å²	22	58.4 Å²	58.4	18%	0.182	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	147.5	178	0	0	0	0	0	110.3	I202 L210 L255	I202-A212 HydrophobicContact CB-CB 4.25Å; I202-A212 HydrophobicContact CD1-CB 4.27Å; I202-A212 PolarHBondContact N-O 3.27Å; I202-A212 PolarHBondContact O-N 2.97Å; L210-A212 WeakPolarHBondContact CD1-O 3.46Å; A212-L255 HydrophobicContact CB-CD1 3.5Å
213	E	95.6	Very high	94.5	Very high	62 Å²	62	59.6 Å²	59.6	29%	0.29	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	134.6	177.1	175.6	166	-175.3	0	0	110.9	S199 V200 R201 L210 E215	S199-E213 WeakPolarHBondContact CB-OE1 3.44Å; S199-E213 PolarHBondContact OG-OE1 3.39Å; V200-E213 WeakPolarHBondContact O-CA 3.43Å; R201-E213 HydrophobicContact CG-CB 4.33Å; R201-E213 HydrophobicContact CG-CG 4.06Å; R201-E213 IonicContact CZ-OE1 3.63Å; R201-E213 VanDerWaalsContact CZ-OE1 3.24Å; R201-E213 IonicContact CZ-OE2 3.58Å; R201-E213 IonicContact NE-OE1 3.72Å; R201-E213 PolarHBondContact NE-OE1 3.4Å; R201-E213 IonicContact NE-OE2 2.7Å; R201-E213 PolarHBondContact NE-OE2 2.84Å; R201-E213 IonicContact NH2-OE1 3.67Å; R201-E213 PolarHBondContact NH2-OE1 3.35Å; R201-E213 IonicContact NH2-OE2 2.63Å; L210-E213 HydrophobicContact CD1-CB 4.26Å; L210-E213 HydrophobicContact CD2-CB 3.98Å; L210-E213 VanDerWaalsContact CD2-OE2 3.31Å; L210-E213 WeakPolarHBondContact CD2-OE2 3.38Å; L210-E213 HydrophobicContact CG-CB 4.43Å; E213-E215 HydrophobicContact CG-CG 4.33Å
214	R	96	Very high	94.3	Very high	64 Å²	64	59.7 Å²	59.7	24%	0.242	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	102.1	166	177.9	43.5	171.5	-160.9	-1	109.8	S199 V200 A217 W250 L255 E256	S199-R214 CarbonylContact C-O 3.6Å; S199-R214 VanDerWaalsContact CA-O 3.24Å; S199-R214 WeakPolarHBondContact CA-O 3.19Å; V200-R214 PolarHBondContact N-O 3.29Å; V200-R214 PolarHBondContact O-N 2.91Å; R214-A217 HydrophobicContact CG-CB 3.89Å; R214-W250 HydrophobicContact CG-CE3 4.22Å; R214-W250 HydrophobicContact CG-CH2 4.08Å; R214-W250 HydrophobicContact CG-CZ3 3.91Å; R214-L255 HydrophobicContact CB-CB 4.18Å; R214-L255 HydrophobicContact CB-CD1 4.27Å; R214-L255 HydrophobicContact CB-CD2 4.45Å; R214-L255 WeakPolarHBondContact CD-O 3.46Å; R214-L255 PolarHBondContact NE-O 3.4Å; R214-L255 PolarHBondContact NH1-O 2.77Å; R214-E256 VanDerWaalsContact NH1-C 3.32Å; R214-E256 PolarHBondContact NH1-O 2.88Å; R214-E256 PolarHBondContact NH2-O 2.83Å
215	E	94.6	Very high	94.3	Very high	128 Å²	128	59.9 Å²	59.9	60%	0.598	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	138.2	168.2	-65.1	-171.9	-174.8	0	0	111.4	E213 A217	E213-E215 HydrophobicContact CG-CG 4.33Å; E215-A217 VanDerWaalsContact C-N 3.32Å; E215-A217 PolarHBondContact O-N 3.43Å
216	K	92.9	Very high	94.4	Very high	140 Å²	140	59.9 Å²	59.9	61%	0.609	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	48.4	178.2	-55.5	174.9	-173.1	165.8	0	112.4	K198 H218	K198-K216 VanDerWaalsContact O-CA 3.27Å; K198-K216 WeakPolarHBondContact O-CA 3.41Å; K198-K216 PolarHBondContact O-N 2.91Å; K216-H218 PolarHBondContact O-N 3.42Å; K216-H218 VanDerWaalsContact O-N 3.1Å
217	A	93.4	Very high	94.5	Very high	9 Å²	9	58.8 Å²	58.8	7%	0.074	30%	0.298	C	S	.	.	S	Bend	trans	-51.7	-35	174	0	0	0	0	0	111.7	K198 V200 R214 E215 M224 W250	K198-A217 PolarHBondContact O-N 2.8Å; K198-A217 VanDerWaalsContact O-N 3.14Å; V200-A217 HydrophobicContact CB-CB 4.34Å; V200-A217 HydrophobicContact CG2-CB 3.68Å; R214-A217 HydrophobicContact CG-CB 3.89Å; E215-A217 VanDerWaalsContact C-N 3.32Å; E215-A217 PolarHBondContact O-N 3.43Å; A217-M224 HydrophobicContact CB-SD 4.31Å; A217-W250 HydrophobicContact CB-CZ2 4.06Å; A217-W250 WeakPolarHBondContact O-CZ2 3.49Å
218	H	95.4	Very high	94.7	Very high	3 Å²	3	50.9 Å²	50.9	1%	0.014	27%	0.268	C	S	.	.	S	Bend	trans	-131	142.2	167.3	-64.5	-80.5	0	0	0	109.8	K216 G220 M224 T236 G238 F239 Q246	K216-H218 PolarHBondContact O-N 3.42Å; K216-H218 VanDerWaalsContact O-N 3.1Å; H218-G220 VanDerWaalsContact C-N 3.34Å; H218-G220 PolarHBondContact O-N 2.92Å; H218-M224 HydrophobicContact CB-CE 4.25Å; H218-T236 PolarHBondContact NE2-OG1 3.04Å; H218-G238 PolarHBondContact NE2-N 2.89Å; H218-F239 WeakPolarHBondContact CB-O 3.46Å; H218-Q246 PolarHBondContact ND1-OE1 2.83Å
219	E	92.1	Very high	94.8	Very high	117 Å²	117	49.6 Å²	49.6	55%	0.547	25%	0.254	S	S	.	.	S	Bend	trans	-76	-22.6	-176.7	-65.7	-164.1	166.4	0	0	113.7	K198 R241	K198-E219 PolarHBondContact NZ-O 2.84Å; E219-R241 HydrophobicContact CB-CB 4Å; E219-R241 WeakPolarHBondContact OE2-CB 3.5Å
220	G	91.8	Very high	94.7	Very high	6 Å²	6	48.7 Å²	48.7	6%	0.062	25%	0.251	C	S	.	.	S	Bend	trans	-63.4	160.1	-178.9	0	0	0	0	0	113.5	K198 H218 F239 S240	K198-G220 VanDerWaalsContact CE-O 3.26Å; K198-G220 WeakPolarHBondContact CE-O 3.4Å; H218-G220 VanDerWaalsContact C-N 3.34Å; H218-G220 PolarHBondContact O-N 2.92Å; G220-F239 VanDerWaalsContact CA-O 3.23Å; G220-F239 WeakPolarHBondContact CA-O 3.49Å; G220-F239 PolarHBondContact N-O 3.02Å; G220-S240 WeakPolarHBondContact CA-O 3.45Å
221	A	88.4	Confident	94.5	Very high	85 Å²	85	49.1 Å²	49.1	70%	0.702	25%	0.254	S	S	*	.	S	Bend	trans	-94.8	-4.6	179.8	0	0	0	0	0	113.8
222	R	92.7	Very high	94.3	Very high	86 Å²	86	45.5 Å²	45.5	33%	0.325	24%	0.244	S	C	.	.	S	Bend	trans	-82.3	161.4	-177.1	-73.3	175.5	-176.1	-94.6	0.1	111.3	F239 N268	R222-F239 HydrophobicContact CB-CB 4.25Å; R222-F239 HydrophobicContact CB-CD1 4.23Å; R222-F239 HydrophobicContact CB-CD2 3.26Å; R222-F239 HydrophobicContact CB-CE1 4.38Å; R222-F239 HydrophobicContact CB-CE2 3.48Å; R222-F239 VanDerWaalsContact CB-CE2 3.48Å; R222-F239 HydrophobicContact CB-CG 3.67Å; R222-F239 HydrophobicContact CB-CZ 4.04Å; R222-F239 VanDerWaalsContact CD-CD1 3.47Å; R222-F239 VanDerWaalsContact CD-CE1 3.4Å; R222-F239 HydrophobicContact CG-CD1 4.47Å; R222-F239 HydrophobicContact CG-CD2 4.3Å; R222-F239 HydrophobicContact CG-CE2 4.41Å; R222-F239 HydrophobicContact CG-CG 4.32Å; R222-N268 VanDerWaalsContact CZ-OD1 3.26Å; R222-N268 PolarHBondContact NH1-O 2.78Å; R222-N268 PolarHBondContact NH1-OD1 2.83Å; R222-N268 PolarHBondContact NH2-OD1 3.24Å
223	P	93.4	Very high	94.4	Very high	31 Å²	31	46.2 Å²	46.2	20%	0.201	24%	0.243	C	C	.	.			trans	-55.6	141	179.4	-25.1	34.7	0	0	0	112.6	Y180 F239 A270	Y180-P223 HydrophobicContact CD1-CB 3.94Å; Y180-P223 HydrophobicContact CD1-CG 4.4Å; Y180-P223 HydrophobicContact CD2-CB 4.34Å; Y180-P223 HydrophobicContact CE1-CB 3.89Å; Y180-P223 HydrophobicContact CE1-CG 3.93Å; Y180-P223 HydrophobicContact CE2-CB 4.26Å; Y180-P223 HydrophobicContact CG-CB 4.17Å; P223-F239 VanDerWaalsContact O-CE2 3.32Å; P223-F239 WeakPolarHBondContact O-CE2 3.36Å; P223-A270 HydrophobicContact CB-CB 4.25Å
224	M	94.9	Very high	94.5	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.01	23%	0.229	C	C	.	.			trans	-118	164.7	173	74.7	-175.1	69.4	0	0	110.4	Y180 A194 K198 V200 A217 H218 T237	Y180-M224 WeakPolarHBondContact CB-O 3.41Å; Y180-M224 HydrophobicContact CD2-CG 4.45Å; A194-M224 HydrophobicContact CB-CG 3.68Å; K198-M224 HydrophobicContact CB-CE 3.98Å; K198-M224 HydrophobicContact CG-CE 4.5Å; V200-M224 HydrophobicContact CG2-SD 3.94Å; A217-M224 HydrophobicContact CB-SD 4.31Å; H218-M224 HydrophobicContact CB-CE 4.25Å; M224-T237 CarbonylContact C-O 3.49Å; M224-T237 WeakPolarHBondContact CA-O 3.2Å; M224-T237 VanDerWaalsContact CB-O 3.25Å; M224-T237 WeakPolarHBondContact CB-O 3.47Å
225	R	97.6	Very high	94.6	Very high	19 Å²	19	40.3 Å²	40.3	7%	0.072	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	146.1	172.9	-60.5	-66.7	-176.9	-136.9	20.6	109.3	D37 Y180 N181 T236 T237 L271 L272 P273	D37-R225 VanDerWaalsContact C-NH2 3.31Å; D37-R225 PolarHBondContact O-NH2 3.48Å; Y180-R225 PolarHBondContact O-NH1 2.83Å; N181-R225 VanDerWaalsContact OD1-CA 3.26Å; N181-R225 WeakPolarHBondContact OD1-CA 3.21Å; R225-T236 CarbonylContact O-C 3.53Å; R225-T236 WeakPolarHBondContact O-CA 3.32Å; R225-T236 WeakPolarHBondContact O-CB 3.4Å; R225-T237 PolarHBondContact N-O 2.99Å; R225-T237 PolarHBondContact O-N 3.42Å; R225-L271 WeakPolarHBondContact CG-O 3.32Å; R225-L272 HydrophobicContact CG-CD2 4.37Å; R225-P273 HydrophobicContact CB-CG 3.99Å
226	A	97.8	Very high	94.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	129	172.2	0	0	0	0	0	109.1	N181 C192 A194 V200 V234 F235 T236	N181-A226 PolarHBondContact ND2-O 3.07Å; N181-A226 PolarHBondContact OD1-N 3.27Å; N181-A226 PolarHBondContact OD1-O 2.84Å; C192-A226 PolarHBondContact SG-O 2.94Å; C192-A226 VanDerWaalsContact SG-O 3.42Å; A194-A226 HydrophobicContact CB-CB 4.18Å; V200-A226 HydrophobicContact CG1-CB 3.76Å; V200-A226 HydrophobicContact CG2-CB 4.21Å; A226-V234 HydrophobicContact CB-CG1 4.14Å; A226-F235 WeakPolarHBondContact CA-O 3.38Å; A226-T236 HydrophobicContact CB-CG2 3.96Å
227	I	98.1	Very high	95	Very high	18 Å²	18	27.7 Å²	27.7	9%	0.092	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	150.2	175	60.5	165.1	0	0	0	110.3	V234 F235 P273 Y275	I227-V234 WeakPolarHBondContact O-CA 3.15Å; I227-F235 HydrophobicContact CD1-CD1 4.38Å; I227-F235 HydrophobicContact CG1-CB 4.06Å; I227-F235 HydrophobicContact CG1-CD1 4.23Å; I227-F235 PolarHBondContact N-O 2.83Å; I227-F235 PolarHBondContact O-N 2.75Å; I227-P273 HydrophobicContact CD1-CB 3.7Å; I227-P273 HydrophobicContact CD1-CG 3.93Å; I227-P273 HydrophobicContact CG1-CB 4.2Å; I227-P273 HydrophobicContact CG1-CG 3.99Å; I227-P273 HydrophobicContact CG2-CG 3.83Å; I227-Y275 VanDerWaalsContact CD1-CB 3.49Å
228	F	97.8	Very high	95.2	Very high	16 Å²	16	27.4 Å²	27.4	7%	0.07	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	146.4	169.3	-84.1	-68.4	0	0	0	111.4	S183 N185 L190 F191 C192 I202 G232 V234	S183-F228 WeakPolarHBondContact O-CD2 3.36Å; N185-F228 HydrophobicContact CB-CB 4.26Å; N185-F228 HydrophobicContact CB-CD1 4.18Å; N185-F228 HydrophobicContact CB-CD2 3.55Å; N185-F228 HydrophobicContact CB-CE1 4.39Å; N185-F228 HydrophobicContact CB-CE2 3.72Å; N185-F228 HydrophobicContact CB-CG 3.76Å; N185-F228 HydrophobicContact CB-CZ 4.16Å; L190-F228 HydrophobicContact CB-CE2 4.35Å; L190-F228 HydrophobicContact CB-CZ 4.27Å; F191-F228 VanDerWaalsContact C-CE2 3.49Å; C192-F228 HydrophobicContact CB-CD2 3.96Å; C192-F228 HydrophobicContact CB-CE2 3.61Å; C192-F228 HydrophobicContact CB-CZ 3.98Å; I202-F228 HydrophobicContact CD1-CE1 4.36Å; I202-F228 HydrophobicContact CD1-CZ 4.43Å; I202-F228 HydrophobicContact CG1-CZ 4.22Å; I202-F228 HydrophobicContact CG2-CZ 3.91Å; F228-G232 WeakPolarHBondContact CD1-O 3.48Å; F228-G232 WeakPolarHBondContact CE1-O 3.41Å; F228-V234 HydrophobicContact CD1-CG2 3.92Å; F228-V234 HydrophobicContact CE1-CG2 3.74Å; F228-V234 HydrophobicContact CZ-CG2 4.48Å
229	L	96.8	Very high	95.3	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.026	16%	0.159	C	C	.	.			trans	-98.2	169.3	167.8	-57.1	-170.7	0	0	0	110.4	D231 G232 K233 F235 L249 Y275 I297	L229-D231 VanDerWaalsContact CB-OD1 3.29Å; L229-D231 WeakPolarHBondContact CB-OD1 3.42Å; L229-D231 PolarHBondContact O-N 3.34Å; L229-G232 PolarHBondContact O-N 2.93Å; L229-G232 VanDerWaalsContact O-N 3.09Å; L229-K233 HydrophobicContact CB-CB 4.45Å; L229-K233 HydrophobicContact CD1-CB 4.24Å; L229-K233 PolarHBondContact N-O 3.3Å; L229-F235 HydrophobicContact CD1-CB 4.28Å; L229-F235 HydrophobicContact CD2-CB 3.77Å; L229-F235 HydrophobicContact CG-CB 4.07Å; L229-L249 HydrophobicContact CD1-CD1 3.46Å; L229-L249 VanDerWaalsContact CD1-CD1 3.46Å; L229-Y275 HydrophobicContact CB-CE1 4.15Å; L229-Y275 HydrophobicContact CD2-CD1 3.92Å; L229-Y275 HydrophobicContact CD2-CD2 3.57Å; L229-Y275 HydrophobicContact CD2-CE1 4.05Å; L229-Y275 HydrophobicContact CD2-CE2 3.7Å; L229-Y275 HydrophobicContact CD2-CG 3.66Å; L229-I297 HydrophobicContact CD1-CG1 4.38Å; L229-I297 HydrophobicContact CD1-CG2 3.88Å
230	A	92.3	Very high	95.5	Very high	33 Å²	33	22.2 Å²	22.2	27%	0.273	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-26.1	-175.7	0	0	0	0	0	113.3	G232 Y275 P277	A230-G232 VanDerWaalsContact C-N 3.32Å; A230-Y275 HydrophobicContact CB-CE1 4.06Å; A230-Y275 VanDerWaalsContact CB-OH 3.29Å; A230-Y275 WeakPolarHBondContact CB-OH 3.41Å; A230-Y275 VanDerWaalsContact N-CE1 3.26Å; A230-Y275 PolarHBondContact N-OH 2.83Å; A230-P277 HydrophobicContact CB-CB 3.9Å
231	D	91.2	Very high	95.6	Very high	82 Å²	82	31.6 Å²	31.6	44%	0.439	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	5.7	178.9	63.5	-6.2	0	0	0	113.2	L229 K233	L229-D231 VanDerWaalsContact CB-OD1 3.29Å; L229-D231 WeakPolarHBondContact CB-OD1 3.42Å; L229-D231 PolarHBondContact O-N 3.34Å; D231-K233 VanDerWaalsContact C-N 3.3Å; D231-K233 PolarHBondContact O-N 3.19Å; D231-K233 VanDerWaalsContact OD1-CB 3.31Å; D231-K233 WeakPolarHBondContact OD1-CB 3.42Å; D231-K233 PolarHBondContact OD1-N 3.14Å; D231-K233 VanDerWaalsContact OD2-CD 3.25Å; D231-K233 WeakPolarHBondContact OD2-CD 3.2Å; D231-K233 WeakPolarHBondContact OD2-CE 3.44Å; D231-K233 IonicContact OD2-NZ 2.97Å; D231-K233 PolarHBondContact OD2-NZ 3.1Å
232	G	93.2	Very high	95.8	Very high	28 Å²	28	34.2 Å²	34.2	29%	0.289	17%	0.169	S	C	.	.	S	Bend	trans	84.8	-6.4	-177.7	0	0	0	0	0	114.6	F228 L229 A230 P252	F228-G232 WeakPolarHBondContact CD1-O 3.48Å; F228-G232 WeakPolarHBondContact CE1-O 3.41Å; L229-G232 PolarHBondContact O-N 2.93Å; L229-G232 VanDerWaalsContact O-N 3.09Å; A230-G232 VanDerWaalsContact C-N 3.32Å; G232-P252 WeakPolarHBondContact O-CG 3.26Å
233	K	96	Very high	95.9	Very high	37 Å²	37	32.3 Å²	32.3	16%	0.161	17%	0.168	C	C	.	.			trans	-66.2	158.8	174.9	-66.3	-177.6	-174.5	66.2	0	111.5	L229 D231 L249 W250 M259	L229-K233 HydrophobicContact CB-CB 4.45Å; L229-K233 HydrophobicContact CD1-CB 4.24Å; L229-K233 PolarHBondContact N-O 3.3Å; D231-K233 VanDerWaalsContact C-N 3.3Å; D231-K233 PolarHBondContact O-N 3.19Å; D231-K233 VanDerWaalsContact OD1-CB 3.31Å; D231-K233 WeakPolarHBondContact OD1-CB 3.42Å; D231-K233 PolarHBondContact OD1-N 3.14Å; D231-K233 VanDerWaalsContact OD2-CD 3.25Å; D231-K233 WeakPolarHBondContact OD2-CD 3.2Å; D231-K233 WeakPolarHBondContact OD2-CE 3.44Å; D231-K233 IonicContact OD2-NZ 2.97Å; D231-K233 PolarHBondContact OD2-NZ 3.1Å; K233-L249 HydrophobicContact CB-CD1 4.03Å; K233-L249 HydrophobicContact CD-CD1 4.31Å; K233-L249 HydrophobicContact CD-CD2 4.4Å; K233-L249 HydrophobicContact CD-CG 4.45Å; K233-W250 WeakPolarHBondContact CB-O 3.25Å; K233-M259 HydrophobicContact CD-CE 4.36Å; K233-M259 HydrophobicContact CD-SD 3.72Å
234	V	97.8	Very high	96	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.012	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.7	178.5	-179.2	0	0	0	0	109.7	V200 I202 A226 I227 F228 T236 W250 P252	V200-V234 HydrophobicContact CG1-CG1 4.18Å; I202-V234 HydrophobicContact CD1-CG2 3.84Å; I202-V234 HydrophobicContact CG1-CG2 4.26Å; A226-V234 HydrophobicContact CB-CG1 4.14Å; I227-V234 WeakPolarHBondContact O-CA 3.15Å; F228-V234 HydrophobicContact CD1-CG2 3.92Å; F228-V234 HydrophobicContact CE1-CG2 3.74Å; F228-V234 HydrophobicContact CZ-CG2 4.48Å; V234-T236 HydrophobicContact CG1-CG2 3.98Å; V234-W250 HydrophobicContact CB-CB 4.34Å; V234-W250 PolarHBondContact N-O 2.71Å; V234-W250 PolarHBondContact O-N 3.28Å; V234-P252 HydrophobicContact CG2-CG 4.49Å
235	F	98.2	Very high	96.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	128.1	173.1	-178.8	-92.9	0	0	0	109.7	A226 I227 L229 T237 L247 A248 P273 V282 V284 I297 I304	A226-F235 WeakPolarHBondContact CA-O 3.38Å; I227-F235 HydrophobicContact CD1-CD1 4.38Å; I227-F235 HydrophobicContact CG1-CB 4.06Å; I227-F235 HydrophobicContact CG1-CD1 4.23Å; I227-F235 PolarHBondContact N-O 2.83Å; I227-F235 PolarHBondContact O-N 2.75Å; L229-F235 HydrophobicContact CD1-CB 4.28Å; L229-F235 HydrophobicContact CD2-CB 3.77Å; L229-F235 HydrophobicContact CG-CB 4.07Å; F235-T237 HydrophobicContact CD1-CG2 4.31Å; F235-T237 HydrophobicContact CE1-CG2 3.61Å; F235-T237 HydrophobicContact CZ-CG2 4.41Å; F235-L247 HydrophobicContact CE1-CD2 4.35Å; F235-L247 HydrophobicContact CE2-CB 4.26Å; F235-L247 HydrophobicContact CZ-CB 4Å; F235-L247 HydrophobicContact CZ-CD1 4.19Å; F235-L247 HydrophobicContact CZ-CD2 3.92Å; F235-L247 HydrophobicContact CZ-CG 4.26Å; F235-A248 WeakPolarHBondContact CA-O 3.43Å; F235-P273 HydrophobicContact CD1-CB 3.96Å; F235-P273 HydrophobicContact CE1-CB 3.89Å; F235-V282 HydrophobicContact CD1-CG2 4.11Å; F235-V282 HydrophobicContact CE1-CG1 4.43Å; F235-V282 HydrophobicContact CE1-CG2 3.78Å; F235-V282 HydrophobicContact CE2-CG1 4.1Å; F235-V282 HydrophobicContact CZ-CG1 3.93Å; F235-V282 HydrophobicContact CZ-CG2 4.13Å; F235-V284 HydrophobicContact CE1-CG1 4.17Å; F235-V284 HydrophobicContact CZ-CG1 4.37Å; F235-I297 HydrophobicContact CD2-CD1 4.33Å; F235-I297 HydrophobicContact CE2-CD1 4.23Å; F235-I304 HydrophobicContact CE2-CD1 4.08Å
236	T	98.1	Very high	96.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	145.9	-179.3	67.6	0	0	0	0	111.9	V200 H218 R225 A226 V234 L247 A248 W250	V200-T236 HydrophobicContact CG1-CG2 4.49Å; V200-T236 HydrophobicContact CG2-CG2 4.06Å; H218-T236 PolarHBondContact NE2-OG1 3.04Å; R225-T236 CarbonylContact O-C 3.53Å; R225-T236 WeakPolarHBondContact O-CA 3.32Å; R225-T236 WeakPolarHBondContact O-CB 3.4Å; A226-T236 HydrophobicContact CB-CG2 3.96Å; V234-T236 HydrophobicContact CG1-CG2 3.98Å; T236-L247 WeakPolarHBondContact O-CA 3.26Å; T236-A248 PolarHBondContact N-O 3.08Å; T236-A248 PolarHBondContact O-N 2.74Å; T236-W250 PolarHBondContact OG1-NE1 2.93Å
237	T	98	Very high	96.1	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.018	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130	167.6	70.4	0	0	0	0	108.8	M224 R225 F235 Q246 L247 L271 P273 V284	M224-T237 CarbonylContact C-O 3.49Å; M224-T237 WeakPolarHBondContact CA-O 3.2Å; M224-T237 VanDerWaalsContact CB-O 3.25Å; M224-T237 WeakPolarHBondContact CB-O 3.47Å; R225-T237 PolarHBondContact N-O 2.99Å; R225-T237 PolarHBondContact O-N 3.42Å; F235-T237 HydrophobicContact CD1-CG2 4.31Å; F235-T237 HydrophobicContact CE1-CG2 3.61Å; F235-T237 HydrophobicContact CZ-CG2 4.41Å; T237-Q246 CarbonylContact C-O 3.55Å; T237-Q246 VanDerWaalsContact CA-O 3.32Å; T237-Q246 WeakPolarHBondContact CA-O 3.23Å; T237-L247 HydrophobicContact CG2-CD2 3.63Å; T237-L271 HydrophobicContact CG2-CB 4.14Å; T237-L271 PolarHBondContact OG1-O 3.42Å; T237-P273 HydrophobicContact CG2-CB 4.04Å; T237-P273 HydrophobicContact CG2-CG 4.17Å; T237-V284 HydrophobicContact CG2-CG1 4.24Å
238	G	97	Very high	96.1	Very high	3 Å²	3	32.4 Å²	32.4	3%	0.031	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	-152	-178.1	0	0	0	0	0	111.5	H218 R245 Q246	H218-G238 PolarHBondContact NE2-N 2.89Å; G238-R245 CarbonylContact O-C 3.57Å; G238-R245 WeakPolarHBondContact O-CA 3.33Å; G238-Q246 PolarHBondContact N-O 3.44Å; G238-Q246 PolarHBondContact O-N 3.3Å
239	F	97.2	Very high	96.1	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.018	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	141.4	-174.2	-66.9	-98.6	0	0	0	111.7	H218 G220 R222 P223 E244 R245 S267	H218-F239 WeakPolarHBondContact CB-O 3.46Å; G220-F239 VanDerWaalsContact CA-O 3.23Å; G220-F239 WeakPolarHBondContact CA-O 3.49Å; G220-F239 PolarHBondContact N-O 3.02Å; R222-F239 HydrophobicContact CB-CB 4.25Å; R222-F239 HydrophobicContact CB-CD1 4.23Å; R222-F239 HydrophobicContact CB-CD2 3.26Å; R222-F239 HydrophobicContact CB-CE1 4.38Å; R222-F239 HydrophobicContact CB-CE2 3.48Å; R222-F239 VanDerWaalsContact CB-CE2 3.48Å; R222-F239 HydrophobicContact CB-CG 3.67Å; R222-F239 HydrophobicContact CB-CZ 4.04Å; R222-F239 VanDerWaalsContact CD-CD1 3.47Å; R222-F239 VanDerWaalsContact CD-CE1 3.4Å; R222-F239 HydrophobicContact CG-CD1 4.47Å; R222-F239 HydrophobicContact CG-CD2 4.3Å; R222-F239 HydrophobicContact CG-CE2 4.41Å; R222-F239 HydrophobicContact CG-CG 4.32Å; P223-F239 VanDerWaalsContact O-CE2 3.32Å; P223-F239 WeakPolarHBondContact O-CE2 3.36Å; F239-E244 CarbonylContact C-O 3.51Å; F239-E244 WeakPolarHBondContact CA-O 3.42Å; F239-R245 HydrophobicContact CD1-CG 4.01Å; F239-R245 HydrophobicContact CE1-CG 3.58Å; F239-R245 HydrophobicContact CZ-CG 4.16Å; F239-S267 WeakPolarHBondContact CE1-O 3.09Å
240	S	96.3	Very high	96.1	Very high	7 Å²	7	31.8 Å²	31.8	5%	0.049	16%	0.163	C	C	.	.			trans	-66.9	167.1	168.6	85.2	0	0	0	0	110.3	G220 M242 S243 E244	G220-S240 WeakPolarHBondContact CA-O 3.45Å; S240-M242 PolarHBondContact O-N 3.12Å; S240-M242 PolarHBondContact OG-N 3.45Å; S240-M242 VanDerWaalsContact OG-N 3.13Å; S240-S243 WeakPolarHBondContact O-CA 3.23Å; S240-S243 PolarHBondContact O-N 2.98Å; S240-S243 PolarHBondContact OG-N 3.41Å; S240-E244 PolarHBondContact N-O 3.14Å; S240-E244 WeakPolarHBondContact OG-CB 3.35Å; S240-E244 PolarHBondContact OG-N 2.65Å; S240-E244 PolarHBondContact OG-OE2 2.96Å
241	R	93.9	Very high	96.2	Very high	202 Å²	202	32.5 Å²	32.5	76%	0.762	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-30.2	171.1	-176.9	175.2	175.9	175.9	-1.3	112.4	E219 S243	E219-R241 HydrophobicContact CB-CB 4Å; E219-R241 WeakPolarHBondContact OE2-CB 3.5Å; R241-S243 PolarHBondContact O-N 3.46Å
242	M	93.9	Very high	96.2	Very high	141 Å²	141	30.6 Å²	30.6	70%	0.695	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.2	9.5	176.4	-59.9	-171.5	-62.5	0	0	113	S240 E244	S240-M242 PolarHBondContact O-N 3.12Å; S240-M242 PolarHBondContact OG-N 3.45Å; S240-M242 VanDerWaalsContact OG-N 3.13Å; M242-E244 VanDerWaalsContact C-N 3.34Å; M242-E244 WeakPolarHBondContact CE-OE2 3.39Å
243	S	94.4	Very high	96.1	Very high	45 Å²	45	37.9 Å²	37.9	32%	0.315	18%	0.181	S	C	.	.			trans	65.5	28.5	-177.8	-57.4	0	0	0	0	114.9	S240 R241	S240-S243 WeakPolarHBondContact O-CA 3.23Å; S240-S243 PolarHBondContact O-N 2.98Å; S240-S243 PolarHBondContact OG-N 3.41Å; R241-S243 PolarHBondContact O-N 3.46Å
244	E	96.5	Very high	95.9	Very high	52 Å²	52	40.2 Å²	40.2	24%	0.243	20%	0.196	C	C	.	.			trans	-84.4	137.6	168	-64.1	147.9	146.2	0	0	110	F239 S240 M242 Q246 D265	F239-E244 CarbonylContact C-O 3.51Å; F239-E244 WeakPolarHBondContact CA-O 3.42Å; S240-E244 PolarHBondContact N-O 3.14Å; S240-E244 WeakPolarHBondContact OG-CB 3.35Å; S240-E244 PolarHBondContact OG-N 2.65Å; S240-E244 PolarHBondContact OG-OE2 2.96Å; M242-E244 VanDerWaalsContact C-N 3.34Å; M242-E244 WeakPolarHBondContact CE-OE2 3.39Å; E244-Q246 PolarHBondContact O-N 3.47Å; E244-D265 CarbonylContact C-O 3.55Å; E244-D265 WeakPolarHBondContact CA-O 3.34Å
245	R	97.1	Very high	95.6	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.015	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	132	175.4	-59.6	-166.1	-64.5	-177.1	-6.3	109.9	G238 F239 L264 D265 S267 G269 L271 D289	G238-R245 CarbonylContact O-C 3.57Å; G238-R245 WeakPolarHBondContact O-CA 3.33Å; F239-R245 HydrophobicContact CD1-CG 4.01Å; F239-R245 HydrophobicContact CE1-CG 3.58Å; F239-R245 HydrophobicContact CZ-CG 4.16Å; R245-L264 HydrophobicContact CB-CB 4.27Å; R245-L264 WeakPolarHBondContact O-CB 3.47Å; R245-L264 PolarHBondContact O-N 3.48Å; R245-D265 IonicContact CZ-OD1 3.35Å; R245-D265 VanDerWaalsContact CZ-OD1 3.24Å; R245-D265 IonicContact CZ-OD2 2.84Å; R245-D265 PolarHBondContact N-O 3.04Å; R245-D265 IonicContact NE-OD1 3.85Å; R245-D265 PolarHBondContact NE-OD1 3.33Å; R245-D265 IonicContact NE-OD2 3.7Å; R245-D265 VanDerWaalsContact NH2-CG 3.32Å; R245-D265 IonicContact NH2-OD1 3.23Å; R245-D265 PolarHBondContact NH2-OD1 2.92Å; R245-D265 IonicContact NH2-OD2 3.4Å; R245-D265 PolarHBondContact NH2-OD2 2.81Å; R245-S267 WeakPolarHBondContact CG-O 3.46Å; R245-S267 PolarHBondContact NH2-OG 2.66Å; R245-G269 WeakPolarHBondContact CD-O 3.33Å; R245-G269 PolarHBondContact NH1-O 2.97Å; R245-L271 HydrophobicContact CB-CD1 4.02Å; R245-D289 IonicContact CZ-OD1 3.91Å; R245-D289 IonicContact CZ-OD2 3.04Å; R245-D289 IonicContact NH1-OD1 2.82Å; R245-D289 PolarHBondContact NH1-OD1 2.73Å; R245-D289 IonicContact NH1-OD2 3.54Å; R245-D289 PolarHBondContact NH1-OD2 2.96Å; R245-D289 IonicContact NH2-OD1 3.33Å; R245-D289 PolarHBondContact NH2-OD1 2.86Å; R245-D289 IonicContact NH2-OD2 3.52Å
246	Q	97.2	Very high	95.1	Very high	16 Å²	16	48.4 Å²	48.4	8%	0.075	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	143.7	-175.9	-73	-177.4	-27.4	0	0	110.5	H218 T237 G238 E244 L261 Q262 E263	H218-Q246 PolarHBondContact ND1-OE1 2.83Å; T237-Q246 CarbonylContact C-O 3.55Å; T237-Q246 VanDerWaalsContact CA-O 3.32Å; T237-Q246 WeakPolarHBondContact CA-O 3.23Å; G238-Q246 PolarHBondContact N-O 3.44Å; G238-Q246 PolarHBondContact O-N 3.3Å; E244-Q246 PolarHBondContact O-N 3.47Å; Q246-L261 HydrophobicContact CB-CD1 4.14Å; Q246-L261 HydrophobicContact CG-CD1 4.4Å; Q246-Q262 CarbonylContact C-O 3.48Å; Q246-Q262 WeakPolarHBondContact CA-O 3.24Å; Q246-E263 HydrophobicContact CG-CG 4.08Å; Q246-E263 PolarHBondContact NE2-OE1 3.17Å; Q246-E263 VanDerWaalsContact NE2-OE1 3.07Å
247	L	97.9	Very high	94.8	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	133.5	166.4	-51.7	180	0	0	0	107.7	F235 T236 T237 L261 Q262 L264 L271 V284 F295 I304	F235-L247 HydrophobicContact CE1-CD2 4.35Å; F235-L247 HydrophobicContact CE2-CB 4.26Å; F235-L247 HydrophobicContact CZ-CB 4Å; F235-L247 HydrophobicContact CZ-CD1 4.19Å; F235-L247 HydrophobicContact CZ-CD2 3.92Å; F235-L247 HydrophobicContact CZ-CG 4.26Å; T236-L247 WeakPolarHBondContact O-CA 3.26Å; T237-L247 HydrophobicContact CG2-CD2 3.63Å; L247-L261 CarbonylContact O-C 3.59Å; L247-L261 WeakPolarHBondContact O-CA 3.26Å; L247-Q262 PolarHBondContact N-O 2.77Å; L247-Q262 PolarHBondContact O-N 2.82Å; L247-L264 HydrophobicContact CD1-CD1 3.92Å; L247-L264 HydrophobicContact CD1-CD2 4.06Å; L247-L264 HydrophobicContact CD1-CG 4.25Å; L247-L264 HydrophobicContact CD2-CD1 3.8Å; L247-L264 HydrophobicContact CG-CD1 3.69Å; L247-L264 HydrophobicContact CG-CD2 4.38Å; L247-L264 HydrophobicContact CG-CG 4.05Å; L247-L271 HydrophobicContact CD2-CD1 4.11Å; L247-V284 HydrophobicContact CD2-CG1 4.1Å; L247-F295 HydrophobicContact CD1-CD1 4.33Å; L247-F295 HydrophobicContact CD1-CD2 3.96Å; L247-F295 HydrophobicContact CD1-CE1 3.93Å; L247-F295 HydrophobicContact CD1-CE2 3.56Å; L247-F295 HydrophobicContact CD1-CG 4.36Å; L247-F295 HydrophobicContact CD1-CZ 3.56Å; L247-I304 HydrophobicContact CB-CD1 4.43Å
248	A	97.4	Very high	94.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	148.4	173	0	0	0	0	0	111.8	F235 T236 W250 P258 A260 L261	F235-A248 WeakPolarHBondContact CA-O 3.43Å; T236-A248 PolarHBondContact N-O 3.08Å; T236-A248 PolarHBondContact O-N 2.74Å; A248-W250 HydrophobicContact CB-CZ2 3.96Å; A248-P258 HydrophobicContact CB-CB 4.27Å; A248-A260 CarbonylContact C-O 3.02Å; A248-A260 WeakPolarHBondContact CA-O 3.3Å; A248-L261 HydrophobicContact CB-CD1 3.86Å
249	L	97.6	Very high	94.5	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131	173.9	-178.5	66	0	0	0	108.8	L229 K233 P258 M259 A260 I297 Y303 I304	L229-L249 HydrophobicContact CD1-CD1 3.46Å; L229-L249 VanDerWaalsContact CD1-CD1 3.46Å; K233-L249 HydrophobicContact CB-CD1 4.03Å; K233-L249 HydrophobicContact CD-CD1 4.31Å; K233-L249 HydrophobicContact CD-CD2 4.4Å; K233-L249 HydrophobicContact CD-CG 4.45Å; L249-P258 CarbonylContact O-C 3.53Å; L249-M259 HydrophobicContact CB-CB 4.46Å; L249-M259 HydrophobicContact CD2-CB 4.43Å; L249-M259 HydrophobicContact CD2-SD 4.25Å; L249-M259 HydrophobicContact CG-CB 4.38Å; L249-M259 HydrophobicContact CG-SD 4.24Å; L249-M259 PolarHBondContact O-N 3.22Å; L249-A260 HydrophobicContact CB-CB 4.28Å; L249-A260 PolarHBondContact N-O 3.05Å; L249-I297 HydrophobicContact CD2-CG2 4.18Å; L249-Y303 HydrophobicContact CD2-CG 4.44Å; L249-I304 HydrophobicContact CB-CD1 4.07Å; L249-I304 HydrophobicContact CB-CG1 4.27Å
250	W	96.8	Very high	94.4	Very high	6 Å²	6	60.2 Å²	60.2	2%	0.023	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	140.1	-174.6	-54.7	88.8	0	0	0	110.8	R214 A217 K233 V234 T236 A248 L255 P258	R214-W250 HydrophobicContact CG-CE3 4.22Å; R214-W250 HydrophobicContact CG-CH2 4.08Å; R214-W250 HydrophobicContact CG-CZ3 3.91Å; A217-W250 HydrophobicContact CB-CZ2 4.06Å; A217-W250 WeakPolarHBondContact O-CZ2 3.49Å; K233-W250 WeakPolarHBondContact CB-O 3.25Å; V234-W250 HydrophobicContact CB-CB 4.34Å; V234-W250 PolarHBondContact N-O 2.71Å; V234-W250 PolarHBondContact O-N 3.28Å; T236-W250 PolarHBondContact OG1-NE1 2.93Å; A248-W250 HydrophobicContact CB-CZ2 3.96Å; W250-L255 HydrophobicContact CB-CD2 3.88Å; W250-P258 HydrophobicContact CD2-CB 4.22Å; W250-P258 HydrophobicContact CE3-CB 4.05Å; W250-P258 HydrophobicContact CH2-CB 3.78Å; W250-P258 HydrophobicContact CH2-CG 4.01Å; W250-P258 HydrophobicContact CZ2-CB 3.95Å; W250-P258 HydrophobicContact CZ2-CG 4.49Å; W250-P258 HydrophobicContact CZ3-CB 3.83Å; W250-P258 HydrophobicContact CZ3-CG 4.24Å
251	D	94.8	Very high	94.5	Very high	48 Å²	48	64.2 Å²	64.2	26%	0.257	32%	0.315	S	S	.	.	B	Isolated β-bridge	trans	-91.7	121.3	168.4	-165.9	-23.6	0	0	0	109	E253 N254 L255 M259	D251-E253 PolarHBondContact O-N 2.86Å; D251-E253 PolarHBondContact OD1-N 2.95Å; D251-N254 CarbonylContact O-C 3.55Å; D251-N254 PolarHBondContact O-N 2.8Å; D251-L255 WeakPolarHBondContact O-CD2 3.33Å; D251-L255 PolarHBondContact O-N 2.75Å; D251-M259 HydrophobicContact CB-CG 4.23Å; D251-M259 HydrophobicContact CB-SD 3.93Å
252	P	91.7	Very high	94.6	Very high	42 Å²	42	57.4 Å²	57.4	27%	0.273	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-29.5	175.4	-25.5	33.2	0	0	0	113.9	I202 G232 V234 N254	I202-P252 HydrophobicContact CD1-CB 3.68Å; I202-P252 HydrophobicContact CD1-CG 3.96Å; G232-P252 WeakPolarHBondContact O-CG 3.26Å; V234-P252 HydrophobicContact CG2-CG 4.49Å; P252-N254 VanDerWaalsContact C-N 3.33Å
253	E	90.7	Very high	94.6	Very high	181 Å²	181	55.7 Å²	55.7	85%	0.846	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-28	178.2	-61.7	-170.6	170.8	0	0	112	D251	D251-E253 PolarHBondContact O-N 2.86Å; D251-E253 PolarHBondContact OD1-N 2.95Å
254	N	91.2	Very high	94.6	Very high	87 Å²	87	55.4 Å²	55.4	47%	0.465	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-138.4	90.3	177.7	-175.5	9.4	0	0	0	111.6	D251 P252 E256	D251-N254 CarbonylContact O-C 3.55Å; D251-N254 PolarHBondContact O-N 2.8Å; P252-N254 VanDerWaalsContact C-N 3.33Å; N254-E256 PolarHBondContact OD1-N 3.36Å
255	L	90.7	Very high	94.5	Very high	24 Å²	24	54.6 Å²	54.6	13%	0.126	27%	0.274	C	S	.	.			trans	-87.4	2.1	178.6	-69.3	178.8	0	0	0	113.8	A212 R214 W250 D251	A212-L255 HydrophobicContact CB-CD1 3.5Å; R214-L255 HydrophobicContact CB-CB 4.18Å; R214-L255 HydrophobicContact CB-CD1 4.27Å; R214-L255 HydrophobicContact CB-CD2 4.45Å; R214-L255 WeakPolarHBondContact CD-O 3.46Å; R214-L255 PolarHBondContact NE-O 3.4Å; R214-L255 PolarHBondContact NH1-O 2.77Å; W250-L255 HydrophobicContact CB-CD2 3.88Å; D251-L255 WeakPolarHBondContact O-CD2 3.33Å; D251-L255 PolarHBondContact O-N 2.75Å
256	E	89.3	Confident	94.3	Very high	149 Å²	149	58.9 Å²	58.9	70%	0.696	31%	0.305	S	S	*	.	S	Bend	trans	-68.9	-36.9	-176	-68.2	-169.3	171.6	0	0	113	R214 N254	R214-E256 VanDerWaalsContact NH1-C 3.32Å; R214-E256 PolarHBondContact NH1-O 2.88Å; R214-E256 PolarHBondContact NH2-O 2.83Å; N254-E256 PolarHBondContact OD1-N 3.36Å
257	E	91.1	Very high	94.1	Very high	149 Å²	149	60.1 Å²	60.1	70%	0.696	32%	0.316	S	S	*	.	S	Bend	trans	-134.2	142.5	177.9	-67.4	-166.6	162	0	0	110.9
258	P	94.7	Very high	93.7	Very high	41 Å²	41	65.3 Å²	65.3	27%	0.266	34%	0.343	S	S	.	.			trans	-68.9	137.1	175.1	28.8	-32.7	0	0	0	110.1	A248 L249 W250 A260 L261	A248-P258 HydrophobicContact CB-CB 4.27Å; L249-P258 CarbonylContact O-C 3.53Å; W250-P258 HydrophobicContact CD2-CB 4.22Å; W250-P258 HydrophobicContact CE3-CB 4.05Å; W250-P258 HydrophobicContact CH2-CB 3.78Å; W250-P258 HydrophobicContact CH2-CG 4.01Å; W250-P258 HydrophobicContact CZ2-CB 3.95Å; W250-P258 HydrophobicContact CZ2-CG 4.49Å; W250-P258 HydrophobicContact CZ3-CB 3.83Å; W250-P258 HydrophobicContact CZ3-CG 4.24Å; P258-A260 PolarHBondContact O-N 2.79Å; P258-L261 HydrophobicContact CG-CB 4.14Å
259	M	94.5	Very high	93.5	Very high	56 Å²	56	66.2 Å²	66.2	28%	0.276	35%	0.352	S	S	.	.	S	Bend	trans	-60.1	-37.5	172.2	-62.7	-178.5	68.6	0	0	111.6	K233 L249 D251 Y303	K233-M259 HydrophobicContact CD-CE 4.36Å; K233-M259 HydrophobicContact CD-SD 3.72Å; L249-M259 HydrophobicContact CB-CB 4.46Å; L249-M259 HydrophobicContact CD2-CB 4.43Å; L249-M259 HydrophobicContact CD2-SD 4.25Å; L249-M259 HydrophobicContact CG-CB 4.38Å; L249-M259 HydrophobicContact CG-SD 4.24Å; L249-M259 PolarHBondContact O-N 3.22Å; D251-M259 HydrophobicContact CB-CG 4.23Å; D251-M259 HydrophobicContact CB-SD 3.93Å; M259-Y303 HydrophobicContact CB-CD2 4.23Å; M259-Y303 HydrophobicContact CB-CE2 4.3Å; M259-Y303 HydrophobicContact CE-CD1 4.03Å; M259-Y303 HydrophobicContact CE-CE1 3.82Å; M259-Y303 HydrophobicContact CE-CE2 4.45Å; M259-Y303 HydrophobicContact CE-CG 4.44Å; M259-Y303 WeakPolarHBondContact O-CD2 3.31Å; M259-Y303 WeakPolarHBondContact O-CE2 3.4Å
260	A	95.7	Very high	93.3	Very high	13 Å²	13	66.5 Å²	66.5	11%	0.107	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	138.3	174.7	0	0	0	0	0	109.2	A248 L249 P258 P302 Y303 I304	A248-A260 CarbonylContact C-O 3.02Å; A248-A260 WeakPolarHBondContact CA-O 3.3Å; L249-A260 HydrophobicContact CB-CB 4.28Å; L249-A260 PolarHBondContact N-O 3.05Å; P258-A260 PolarHBondContact O-N 2.79Å; A260-P302 VanDerWaalsContact CB-O 3.27Å; A260-P302 WeakPolarHBondContact CB-O 3.32Å; A260-Y303 HydrophobicContact CB-CD2 4.2Å; A260-I304 HydrophobicContact CB-CD1 3.74Å; A260-I304 HydrophobicContact CB-CG1 3.89Å
261	L	96.5	Very high	93.3	Very high	90 Å²	90	66.6 Å²	66.6	47%	0.471	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	121.2	170	179.7	68.1	0	0	0	107.8	Q246 L247 A248 P258	Q246-L261 HydrophobicContact CB-CD1 4.14Å; Q246-L261 HydrophobicContact CG-CD1 4.4Å; L247-L261 CarbonylContact O-C 3.59Å; L247-L261 WeakPolarHBondContact O-CA 3.26Å; A248-L261 HydrophobicContact CB-CD1 3.86Å; P258-L261 HydrophobicContact CG-CB 4.14Å
262	Q	95.9	Very high	93.4	Very high	60 Å²	60	65 Å²	65	28%	0.28	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124.9	179.5	-176.7	172.6	5.5	0	0	110.4	Q246 L247	Q246-Q262 CarbonylContact C-O 3.48Å; Q246-Q262 WeakPolarHBondContact CA-O 3.24Å; L247-Q262 PolarHBondContact N-O 2.77Å; L247-Q262 PolarHBondContact O-N 2.82Å
263	E	95.6	Very high	93.7	Very high	105 Å²	105	63.8 Å²	63.8	49%	0.491	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	143.7	173.1	-57.3	-171.9	148.5	0	0	110.3	Q246	Q246-E263 HydrophobicContact CG-CG 4.08Å; Q246-E263 PolarHBondContact NE2-OE1 3.17Å; Q246-E263 VanDerWaalsContact NE2-OE1 3.07Å
264	L	94.7	Very high	94.1	Very high	39 Å²	39	56.5 Å²	56.5	20%	0.204	31%	0.305	C	S	.	.			trans	-113	-79.2	-174.4	-67.9	-176.8	0	0	0	112.3	R245 L247 L271 F295	R245-L264 HydrophobicContact CB-CB 4.27Å; R245-L264 WeakPolarHBondContact O-CB 3.47Å; R245-L264 PolarHBondContact O-N 3.48Å; L247-L264 HydrophobicContact CD1-CD1 3.92Å; L247-L264 HydrophobicContact CD1-CD2 4.06Å; L247-L264 HydrophobicContact CD1-CG 4.25Å; L247-L264 HydrophobicContact CD2-CD1 3.8Å; L247-L264 HydrophobicContact CG-CD1 3.69Å; L247-L264 HydrophobicContact CG-CD2 4.38Å; L247-L264 HydrophobicContact CG-CG 4.05Å; L264-L271 HydrophobicContact CD1-CD1 3.57Å; L264-F295 HydrophobicContact CD2-CE1 4.36Å; L264-F295 HydrophobicContact CD2-CZ 3.75Å
265	D	93.9	Very high	94.4	Very high	34 Å²	34	54.5 Å²	54.5	18%	0.182	29%	0.291	C	S	.	.			trans	-156	174.5	-178.1	61.7	51.4	0	0	0	110.5	E244 R245 S267 R293	E244-D265 CarbonylContact C-O 3.55Å; E244-D265 WeakPolarHBondContact CA-O 3.34Å; R245-D265 IonicContact CZ-OD1 3.35Å; R245-D265 VanDerWaalsContact CZ-OD1 3.24Å; R245-D265 IonicContact CZ-OD2 2.84Å; R245-D265 PolarHBondContact N-O 3.04Å; R245-D265 IonicContact NE-OD1 3.85Å; R245-D265 PolarHBondContact NE-OD1 3.33Å; R245-D265 IonicContact NE-OD2 3.7Å; R245-D265 VanDerWaalsContact NH2-CG 3.32Å; R245-D265 IonicContact NH2-OD1 3.23Å; R245-D265 PolarHBondContact NH2-OD1 2.92Å; R245-D265 IonicContact NH2-OD2 3.4Å; R245-D265 PolarHBondContact NH2-OD2 2.81Å; D265-S267 PolarHBondContact O-N 2.9Å; D265-S267 WeakPolarHBondContact OD1-CB 3.45Å; D265-S267 PolarHBondContact OD1-N 3.23Å; D265-S267 PolarHBondContact OD1-OG 3.33Å; D265-R293 IonicContact OD2-CZ 3.72Å; D265-R293 IonicContact OD2-NH1 3.22Å; D265-R293 PolarHBondContact OD2-NH1 2.77Å; D265-R293 IonicContact OD2-NH2 2.71Å; D265-R293 PolarHBondContact OD2-NH2 2.81Å
266	S	93	Very high	94.7	Very high	95 Å²	95	54 Å²	54	66%	0.664	29%	0.289	S	S	*	.			trans	-94.8	28.3	-178.3	51.8	0	0	0	0	114.4
267	S	93.1	Very high	94.9	Very high	42 Å²	42	49.4 Å²	49.4	29%	0.294	27%	0.272	S	S	.	.			trans	-75.2	155	178.5	-46.3	0	0	0	0	111.8	F239 R245 D265	F239-S267 WeakPolarHBondContact CE1-O 3.09Å; R245-S267 WeakPolarHBondContact CG-O 3.46Å; R245-S267 PolarHBondContact NH2-OG 2.66Å; D265-S267 PolarHBondContact O-N 2.9Å; D265-S267 WeakPolarHBondContact OD1-CB 3.45Å; D265-S267 PolarHBondContact OD1-N 3.23Å; D265-S267 PolarHBondContact OD1-OG 3.33Å
268	N	89.5	Confident	95.1	Very high	109 Å²	109	43.4 Å²	43.4	58%	0.583	25%	0.245	S	C	*	.			trans	-84.7	-23.2	-172.9	-72.1	-36	0	0	0	115.3	R222	R222-N268 VanDerWaalsContact CZ-OD1 3.26Å; R222-N268 PolarHBondContact NH1-O 2.78Å; R222-N268 PolarHBondContact NH1-OD1 2.83Å; R222-N268 PolarHBondContact NH2-OD1 3.24Å
269	G	91.7	Very high	95.1	Very high	18 Å²	18	41.8 Å²	41.8	19%	0.186	23%	0.234	C	C	.	.	S	Bend	trans	-74.4	130.9	-172	0	0	0	0	0	112.3	R245 L271	R245-G269 WeakPolarHBondContact CD-O 3.33Å; R245-G269 PolarHBondContact NH1-O 2.97Å; G269-L271 PolarHBondContact O-N 2.85Å
270	A	94.7	Very high	95.1	Very high	9 Å²	9	41.1 Å²	41.1	7%	0.074	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-60.7	130.6	171.8	0	0	0	0	0	109.6	P223 G286	P223-A270 HydrophobicContact CB-CB 4.25Å; A270-G286 WeakPolarHBondContact O-CA 3.19Å
271	L	96.9	Very high	95.2	Very high	8 Å²	8	40.5 Å²	40.5	4%	0.042	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	135.7	178	-72.1	169.6	0	0	0	109.5	R225 T237 R245 L247 L264 G269 V284	R225-L271 WeakPolarHBondContact CG-O 3.32Å; T237-L271 HydrophobicContact CG2-CB 4.14Å; T237-L271 PolarHBondContact OG1-O 3.42Å; R245-L271 HydrophobicContact CB-CD1 4.02Å; L247-L271 HydrophobicContact CD2-CD1 4.11Å; L264-L271 HydrophobicContact CD1-CD1 3.57Å; G269-L271 PolarHBondContact O-N 2.85Å; L271-V284 HydrophobicContact CD2-CB 4.31Å; L271-V284 HydrophobicContact CD2-CG2 4.49Å
272	L	97	Very high	95.2	Very high	13 Å²	13	36.2 Å²	36.2	7%	0.068	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	114.4	171.4	-57.3	177.7	0	0	0	107.7	D37 T39 R225 F274 V284 C285	D37-L272 WeakPolarHBondContact O-CD2 3.21Å; T39-L272 HydrophobicContact CG2-CD1 4.32Å; R225-L272 HydrophobicContact CG-CD2 4.37Å; L272-F274 HydrophobicContact CB-CE2 3.84Å; L272-F274 HydrophobicContact CB-CZ 4.33Å; L272-V284 WeakPolarHBondContact O-CA 3.46Å; L272-C285 WeakPolarHBondContact CB-O 3.35Å; L272-C285 PolarHBondContact N-O 3.09Å; L272-C285 PolarHBondContact O-N 3.31Å
273	P	97.8	Very high	95.4	Very high	17 Å²	17	33.6 Å²	33.6	11%	0.11	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	128.3	175.1	34.2	-34.1	0	0	0	110.7	R225 I227 F235 T237 V282 Y283 V284	R225-P273 HydrophobicContact CB-CG 3.99Å; I227-P273 HydrophobicContact CD1-CB 3.7Å; I227-P273 HydrophobicContact CD1-CG 3.93Å; I227-P273 HydrophobicContact CG1-CB 4.2Å; I227-P273 HydrophobicContact CG1-CG 3.99Å; I227-P273 HydrophobicContact CG2-CG 3.83Å; F235-P273 HydrophobicContact CD1-CB 3.96Å; F235-P273 HydrophobicContact CE1-CB 3.89Å; T237-P273 HydrophobicContact CG2-CB 4.04Å; T237-P273 HydrophobicContact CG2-CG 4.17Å; P273-V282 HydrophobicContact CB-CG2 4.14Å; P273-Y283 CarbonylContact C-O 3.6Å; P273-Y283 WeakPolarHBondContact CA-O 3.37Å; P273-V284 HydrophobicContact CB-CG1 4.35Å
274	F	97.8	Very high	95.5	Very high	28 Å²	28	28.7 Å²	28.7	12%	0.123	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	109.9	171	-61.9	-91.3	0	0	0	107.6	T39 L272 V282 Y283 C285 M319 S321 F337	T39-F274 HydrophobicContact CG2-CE1 4.03Å; T39-F274 HydrophobicContact CG2-CZ 3.84Å; L272-F274 HydrophobicContact CB-CE2 3.84Å; L272-F274 HydrophobicContact CB-CZ 4.33Å; F274-V282 WeakPolarHBondContact O-CA 3.18Å; F274-Y283 PolarHBondContact N-O 2.85Å; F274-Y283 PolarHBondContact O-N 2.86Å; F274-C285 VanDerWaalsContact CE2-SG 3.6Å; F274-M319 HydrophobicContact CE2-CB 4.3Å; F274-M319 HydrophobicContact CE2-CG 4.11Å; F274-M319 HydrophobicContact CZ-CB 4.1Å; F274-M319 HydrophobicContact CZ-CG 4.1Å; F274-S321 WeakPolarHBondContact CD1-OG 3.25Å; F274-F337 HydrophobicContact CB-CE1 4.1Å; F274-F337 HydrophobicContact CB-CZ 4.35Å; F274-F337 HydrophobicContact CD1-CE1 4.43Å; F274-F337 HydrophobicContact CD2-CE1 4.03Å; F274-F337 AromaticContact CG-CE1 3.94Å; F274-F337 HydrophobicContact CG-CE1 3.94Å
275	Y	97.7	Very high	95.5	Very high	46 Å²	46	26.8 Å²	26.8	18%	0.18	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	133.3	-177.6	173.5	-113	0	0	0	111.3	I227 L229 A230 P277 V282	I227-Y275 VanDerWaalsContact CD1-CB 3.49Å; L229-Y275 HydrophobicContact CB-CE1 4.15Å; L229-Y275 HydrophobicContact CD2-CD1 3.92Å; L229-Y275 HydrophobicContact CD2-CD2 3.57Å; L229-Y275 HydrophobicContact CD2-CE1 4.05Å; L229-Y275 HydrophobicContact CD2-CE2 3.7Å; L229-Y275 HydrophobicContact CD2-CG 3.66Å; A230-Y275 HydrophobicContact CB-CE1 4.06Å; A230-Y275 VanDerWaalsContact CB-OH 3.29Å; A230-Y275 WeakPolarHBondContact CB-OH 3.41Å; A230-Y275 VanDerWaalsContact N-CE1 3.26Å; A230-Y275 PolarHBondContact N-OH 2.83Å; Y275-P277 HydrophobicContact CD1-CB 4.45Å; Y275-P277 HydrophobicContact CE1-CB 3.81Å; Y275-V282 HydrophobicContact CD2-CB 4.34Å
276	D	96.9	Very high	95.5	Very high	12 Å²	12	25.2 Å²	25.2	6%	0.064	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	107.1	173.1	-177.7	-7.4	0	0	0	109.5	D278 T279 S280 V281 K324	D276-D278 PolarHBondContact O-N 2.91Å; D276-D278 PolarHBondContact OD1-N 3.05Å; D276-T279 WeakPolarHBondContact CB-OG1 3.38Å; D276-T279 PolarHBondContact OD2-OG1 2.9Å; D276-S280 VanDerWaalsContact O-CA 3.29Å; D276-S280 WeakPolarHBondContact O-CA 3.2Å; D276-S280 PolarHBondContact O-N 2.84Å; D276-V281 WeakPolarHBondContact CB-O 3.48Å; D276-V281 PolarHBondContact N-O 2.93Å; D276-V281 PolarHBondContact O-N 2.92Å; D276-K324 WeakPolarHBondContact OD1-CE 3.48Å; D276-K324 IonicContact OD1-NZ 3.59Å; D276-K324 PolarHBondContact OD1-NZ 2.83Å; D276-K324 VanDerWaalsContact OD1-NZ 3.16Å; D276-K324 VanDerWaalsContact OD2-CE 3.23Å; D276-K324 WeakPolarHBondContact OD2-CE 3.4Å; D276-K324 IonicContact OD2-NZ 2.81Å; D276-K324 PolarHBondContact OD2-NZ 2.73Å
277	P	94.7	Very high	95.6	Very high	54 Å²	54	22.6 Å²	22.6	35%	0.351	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-19.5	-177.3	29.6	-35.8	0	0	0	113.6	A230 Y275	A230-P277 HydrophobicContact CB-CB 3.9Å; Y275-P277 HydrophobicContact CD1-CB 4.45Å; Y275-P277 HydrophobicContact CE1-CB 3.81Å
278	D	94.6	Very high	95.6	Very high	22 Å²	22	23.2 Å²	23.2	12%	0.118	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-33.2	-176.4	-63.5	-14.9	0	0	0	111.2	D276 K324 P365 T367	D276-D278 PolarHBondContact O-N 2.91Å; D276-D278 PolarHBondContact OD1-N 3.05Å; D278-K324 VanDerWaalsContact OD2-CE 3.3Å; D278-K324 WeakPolarHBondContact OD2-CE 3.36Å; D278-K324 WeakPolarHBondContact OD2-CG 3.33Å; D278-P365 HydrophobicContact CB-CG 3.7Å; D278-T367 VanDerWaalsContact OD2-CB 3.24Å; D278-T367 WeakPolarHBondContact OD2-CB 3.34Å; D278-T367 PolarHBondContact OD2-OG1 2.76Å
279	T	93.9	Very high	95.9	Very high	7 Å²	7	18.9 Å²	18.9	4%	0.043	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-8.3	-179.4	67.3	0	0	0	0	113.6	F12 D276 V281	F12-T279 HydrophobicContact CE1-CG2 3.86Å; F12-T279 HydrophobicContact CE2-CG2 4.49Å; F12-T279 VanDerWaalsContact CE2-O 3.25Å; F12-T279 WeakPolarHBondContact CE2-O 3.36Å; F12-T279 HydrophobicContact CZ-CG2 3.59Å; D276-T279 WeakPolarHBondContact CB-OG1 3.38Å; D276-T279 PolarHBondContact OD2-OG1 2.9Å; T279-V281 PolarHBondContact O-N 3.27Å; T279-V281 WeakPolarHBondContact OG1-CB 3.48Å; T279-V281 WeakPolarHBondContact OG1-CG2 3.45Å; T279-V281 PolarHBondContact OG1-N 2.94Å
280	S	95.8	Very high	96.1	Very high	42 Å²	42	20.1 Å²	20.1	29%	0.294	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	35.9	-168.8	-63.6	0	0	0	0	113.3	D276 I297	D276-S280 VanDerWaalsContact O-CA 3.29Å; D276-S280 WeakPolarHBondContact O-CA 3.2Å; D276-S280 PolarHBondContact O-N 2.84Å; S280-I297 WeakPolarHBondContact CB-O 3.31Å; S280-I297 PolarHBondContact O-N 3.37Å
281	V	96.9	Very high	96.1	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.006	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	130.1	176.9	177.7	0	0	0	0	108.6	F12 D276 T279 Y283 F295 L307	F12-V281 HydrophobicContact CB-CG2 4.46Å; F12-V281 HydrophobicContact CD2-CG2 3.89Å; F12-V281 HydrophobicContact CE2-CG2 4.24Å; F12-V281 HydrophobicContact CG-CG2 4.08Å; D276-V281 WeakPolarHBondContact CB-O 3.48Å; D276-V281 PolarHBondContact N-O 2.93Å; D276-V281 PolarHBondContact O-N 2.92Å; T279-V281 PolarHBondContact O-N 3.27Å; T279-V281 WeakPolarHBondContact OG1-CB 3.48Å; T279-V281 WeakPolarHBondContact OG1-CG2 3.45Å; T279-V281 PolarHBondContact OG1-N 2.94Å; V281-Y283 HydrophobicContact CB-CE2 4.18Å; V281-Y283 HydrophobicContact CG1-CD2 4.16Å; V281-Y283 HydrophobicContact CG1-CE1 4.17Å; V281-Y283 HydrophobicContact CG1-CE2 3.61Å; V281-F295 CarbonylContact C-O 3.47Å; V281-F295 WeakPolarHBondContact CA-O 3.09Å; V281-L307 HydrophobicContact CG1-CD1 4.24Å; V281-L307 HydrophobicContact CG2-CD1 4.21Å
282	V	97.9	Very high	96.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	128.1	172.1	65.3	0	0	0	0	109.8	F235 P273 F274 Y275 V284 Y294 F295 I297	F235-V282 HydrophobicContact CD1-CG2 4.11Å; F235-V282 HydrophobicContact CE1-CG1 4.43Å; F235-V282 HydrophobicContact CE1-CG2 3.78Å; F235-V282 HydrophobicContact CE2-CG1 4.1Å; F235-V282 HydrophobicContact CZ-CG1 3.93Å; F235-V282 HydrophobicContact CZ-CG2 4.13Å; P273-V282 HydrophobicContact CB-CG2 4.14Å; F274-V282 WeakPolarHBondContact O-CA 3.18Å; Y275-V282 HydrophobicContact CD2-CB 4.34Å; V282-V284 HydrophobicContact CG2-CG1 4.29Å; V282-Y294 CarbonylContact O-C 3.55Å; V282-Y294 WeakPolarHBondContact O-CA 3.48Å; V282-F295 HydrophobicContact CG1-CB 3.85Å; V282-F295 HydrophobicContact CG1-CD2 4.48Å; V282-F295 PolarHBondContact N-O 2.77Å; V282-F295 PolarHBondContact O-N 3.5Å; V282-I297 HydrophobicContact CG1-CD1 3.93Å; V282-I297 HydrophobicContact CG1-CG1 4.11Å
283	Y	98.3	Very high	96.2	Very high	4 Å²	4	22 Å²	22	2%	0.016	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	133	173.4	-56.3	-97.5	0	0	0	108.4	P273 F274 V281 I292 R293 Y294 I334 A335 F337 M350	P273-Y283 CarbonylContact C-O 3.6Å; P273-Y283 WeakPolarHBondContact CA-O 3.37Å; F274-Y283 PolarHBondContact N-O 2.85Å; F274-Y283 PolarHBondContact O-N 2.86Å; V281-Y283 HydrophobicContact CB-CE2 4.18Å; V281-Y283 HydrophobicContact CG1-CD2 4.16Å; V281-Y283 HydrophobicContact CG1-CE1 4.17Å; V281-Y283 HydrophobicContact CG1-CE2 3.61Å; Y283-I292 HydrophobicContact CD1-CG2 4.29Å; Y283-R293 CarbonylContact C-O 3.56Å; Y283-R293 WeakPolarHBondContact CA-O 3.43Å; Y283-Y294 VanDerWaalsContact CD1-CB 3.43Å; Y283-Y294 AromaticContact CD1-CD1 3.92Å; Y283-Y294 HydrophobicContact CD1-CD1 3.92Å; Y283-Y294 AromaticContact CD1-CG 3.87Å; Y283-Y294 HydrophobicContact CD1-CG 3.87Å; Y283-Y294 HydrophobicContact CE1-CD1 4.1Å; Y283-Y294 HydrophobicContact CE1-CD2 4.47Å; Y283-Y294 AromaticContact CE1-CG 3.85Å; Y283-Y294 HydrophobicContact CE1-CG 3.85Å; Y283-I334 WeakPolarHBondContact OH-CD1 3.42Å; Y283-A335 HydrophobicContact CE2-CB 4.03Å; Y283-F337 VanDerWaalsContact CB-CZ 3.47Å; Y283-F337 AromaticContact CD1-CE2 3.5Å; Y283-F337 HydrophobicContact CD1-CE2 3.5Å; Y283-F337 AromaticContact CD1-CZ 3.78Å; Y283-F337 HydrophobicContact CD1-CZ 3.78Å; Y283-F337 HydrophobicContact CD2-CE2 4.11Å; Y283-F337 AromaticContact CD2-CZ 3.71Å; Y283-F337 HydrophobicContact CD2-CZ 3.71Å; Y283-F337 AromaticContact CE1-CE2 3.93Å; Y283-F337 HydrophobicContact CE1-CE2 3.93Å; Y283-F337 HydrophobicContact CE1-CZ 4.48Å; Y283-F337 HydrophobicContact CE2-CE2 4.44Å; Y283-F337 HydrophobicContact CE2-CZ 4.39Å; Y283-F337 AromaticContact CG-CE2 3.63Å; Y283-F337 HydrophobicContact CG-CE2 3.63Å; Y283-F337 AromaticContact CG-CZ 3.37Å; Y283-F337 HydrophobicContact CG-CZ 3.37Å; Y283-M350 HydrophobicContact CD1-CE 4.4Å; Y283-M350 HydrophobicContact CE1-CB 4.49Å; Y283-M350 HydrophobicContact CE1-CE 3.83Å; Y283-M350 HydrophobicContact CE1-CG 4.01Å
284	V	97.7	Very high	96.2	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.012	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	131.1	177.9	-59.8	0	0	0	0	110.1	F235 T237 L247 L271 L272 P273 V282 R293 F295	F235-V284 HydrophobicContact CE1-CG1 4.17Å; F235-V284 HydrophobicContact CZ-CG1 4.37Å; T237-V284 HydrophobicContact CG2-CG1 4.24Å; L247-V284 HydrophobicContact CD2-CG1 4.1Å; L271-V284 HydrophobicContact CD2-CB 4.31Å; L271-V284 HydrophobicContact CD2-CG2 4.49Å; L272-V284 WeakPolarHBondContact O-CA 3.46Å; P273-V284 HydrophobicContact CB-CG1 4.35Å; V282-V284 HydrophobicContact CG2-CG1 4.29Å; V284-R293 HydrophobicContact CG2-CB 3.84Å; V284-R293 PolarHBondContact N-O 3.02Å; V284-R293 PolarHBondContact O-N 3.35Å; V284-F295 HydrophobicContact CG2-CD2 4.35Å; V284-F295 HydrophobicContact CG2-CE2 3.72Å
285	C	95.9	Very high	96.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	142.2	175.6	64.3	0	0	0	0	110.3	L272 F274 I292 Q316	L272-C285 WeakPolarHBondContact CB-O 3.35Å; L272-C285 PolarHBondContact N-O 3.09Å; L272-C285 PolarHBondContact O-N 3.31Å; F274-C285 VanDerWaalsContact CE2-SG 3.6Å; C285-I292 HydrophobicContact CB-CG1 4.17Å; C285-I292 HydrophobicContact CB-CG2 4.45Å; C285-Q316 PolarHBondContact SG-NE2 2.83Å
286	G	94.3	Very high	96.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	154.4	177.8	0	0	0	0	0	112.4	A270 G288 D289 Q316	A270-G286 WeakPolarHBondContact O-CA 3.19Å; G286-G288 PolarHBondContact O-N 2.93Å; G286-D289 WeakPolarHBondContact CA-OD2 3.18Å; G286-D289 PolarHBondContact N-OD2 3.02Å; G286-D289 WeakPolarHBondContact O-CB 3.45Å; G286-D289 PolarHBondContact O-N 3.48Å; G286-Q316 WeakPolarHBondContact O-CG 3.48Å; G286-Q316 PolarHBondContact O-NE2 2.78Å
287	K	94.2	Very high	96	Very high	41 Å²	41	18.5 Å²	18.5	18%	0.178	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	132.1	169.1	-69.7	-172.3	178.3	179.5	0	109.6	W36 S38 F40 R317	W36-K287 PolarHBondContact O-NZ 2.84Å; S38-K287 WeakPolarHBondContact O-CE 3.25Å; S38-K287 PolarHBondContact O-NZ 2.91Å; F40-K287 VanDerWaalsContact CD1-NZ 3.35Å; F40-K287 VanDerWaalsContact CD2-NZ 3.35Å; F40-K287 VanDerWaalsContact CE1-NZ 3.33Å; F40-K287 VanDerWaalsContact CE2-NZ 3.32Å; F40-K287 VanDerWaalsContact CZ-NZ 3.31Å; K287-R317 VanDerWaalsContact CD-O 3.26Å; K287-R317 WeakPolarHBondContact CD-O 3.26Å; K287-R317 WeakPolarHBondContact CE-O 3.37Å; K287-R317 WeakPolarHBondContact CG-O 3.31Å
288	G	93.8	Very high	96	Very high	54 Å²	54	17.6 Å²	17.6	56%	0.557	11%	0.109	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.3	-15.2	-173.4	0	0	0	0	0	114.8	G286 P315 Q316	G286-G288 PolarHBondContact O-N 2.93Å; G288-P315 VanDerWaalsContact O-CB 3.31Å; G288-P315 WeakPolarHBondContact O-CB 3.44Å; G288-Q316 PolarHBondContact N-O 2.85Å
289	D	95.1	Very high	95.8	Very high	18 Å²	18	24.3 Å²	24.3	10%	0.096	14%	0.14	C	C	.	.			trans	-75.4	150.7	175.6	-68.5	-33.9	0	0	0	111.5	R245 G286 P315 Q316	R245-D289 IonicContact CZ-OD1 3.91Å; R245-D289 IonicContact CZ-OD2 3.04Å; R245-D289 IonicContact NH1-OD1 2.82Å; R245-D289 PolarHBondContact NH1-OD1 2.73Å; R245-D289 IonicContact NH1-OD2 3.54Å; R245-D289 PolarHBondContact NH1-OD2 2.96Å; R245-D289 IonicContact NH2-OD1 3.33Å; R245-D289 PolarHBondContact NH2-OD1 2.86Å; R245-D289 IonicContact NH2-OD2 3.52Å; G286-D289 WeakPolarHBondContact CA-OD2 3.18Å; G286-D289 PolarHBondContact N-OD2 3.02Å; G286-D289 WeakPolarHBondContact O-CB 3.45Å; G286-D289 PolarHBondContact O-N 3.48Å; D289-P315 CarbonylContact O-C 3.57Å; D289-P315 WeakPolarHBondContact O-CA 3.39Å; D289-Q316 WeakPolarHBondContact O-CG 3.32Å; D289-Q316 PolarHBondContact O-N 2.73Å
290	S	95.3	Very high	95.6	Very high	44 Å²	44	29.8 Å²	29.8	31%	0.308	17%	0.165	S	C	.	.	S	Bend	trans	-102.2	4.3	170.4	68.3	0	0	0	0	113.1	S312	S290-S312 VanDerWaalsContact CB-O 3.24Å; S290-S312 WeakPolarHBondContact CB-O 3.47Å; S290-S312 PolarHBondContact O-N 3.47Å; S290-S312 PolarHBondContact O-OG 2.95Å; S290-S312 PolarHBondContact OG-O 3.37Å
291	S	95.9	Very high	95.3	Very high	15 Å²	15	32.3 Å²	32.3	11%	0.105	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	148.2	-174.4	67.1	0	0	0	0	113.4	F310	S291-F310 CarbonylContact C-O 3.59Å; S291-F310 WeakPolarHBondContact CA-O 3.45Å; S291-F310 VanDerWaalsContact CB-O 3.31Å; S291-F310 WeakPolarHBondContact CB-O 3.42Å
292	I	97.6	Very high	95.1	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	118.1	168.8	-53	171.5	0	0	0	107	Y283 C285 T309 F310 M319 F337 I348	Y283-I292 HydrophobicContact CD1-CG2 4.29Å; C285-I292 HydrophobicContact CB-CG1 4.17Å; C285-I292 HydrophobicContact CB-CG2 4.45Å; I292-T309 WeakPolarHBondContact O-CA 3.43Å; I292-F310 HydrophobicContact CB-CB 4.32Å; I292-F310 HydrophobicContact CD1-CD1 4.15Å; I292-F310 HydrophobicContact CG1-CD1 4.27Å; I292-F310 PolarHBondContact N-O 3.16Å; I292-F310 PolarHBondContact O-N 3.36Å; I292-M319 HydrophobicContact CD1-CE 3.73Å; I292-M319 HydrophobicContact CD1-SD 4.36Å; I292-M319 HydrophobicContact CG1-CE 4.04Å; I292-F337 HydrophobicContact CD1-CB 4.28Å; I292-F337 HydrophobicContact CD1-CD2 4.24Å; I292-F337 HydrophobicContact CD1-CG 4.19Å; I292-I348 HydrophobicContact CD1-CD1 3.96Å
293	R	97.6	Very high	94.9	Very high	53 Å²	53	39.3 Å²	39.3	20%	0.2	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	145.7	175.9	-58.8	-176.5	-173.9	166.8	8.9	109	D265 Y283 V284 F295 T309	D265-R293 IonicContact OD2-CZ 3.72Å; D265-R293 IonicContact OD2-NH1 3.22Å; D265-R293 PolarHBondContact OD2-NH1 2.77Å; D265-R293 IonicContact OD2-NH2 2.71Å; D265-R293 PolarHBondContact OD2-NH2 2.81Å; Y283-R293 CarbonylContact C-O 3.56Å; Y283-R293 WeakPolarHBondContact CA-O 3.43Å; V284-R293 HydrophobicContact CG2-CB 3.84Å; V284-R293 PolarHBondContact N-O 3.02Å; V284-R293 PolarHBondContact O-N 3.35Å; R293-F295 HydrophobicContact CB-CE2 3.77Å; R293-F295 HydrophobicContact CB-CZ 4.25Å; R293-T309 HydrophobicContact CG-CG2 3.9Å
294	Y	97.4	Very high	94.8	Very high	1 Å²	1	39.4 Å²	39.4	0%	0.004	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	144.3	178.5	40.6	-82.8	0	0	0	112.4	V15 V282 Y283 L307 N308 F310 M350	V15-Y294 HydrophobicContact CB-CE2 4.06Å; V15-Y294 HydrophobicContact CG1-CD2 4.41Å; V15-Y294 HydrophobicContact CG1-CE2 3.88Å; V15-Y294 PolarHBondContact O-OH 3.15Å; V15-Y294 VanDerWaalsContact O-OH 3.14Å; V282-Y294 CarbonylContact O-C 3.55Å; V282-Y294 WeakPolarHBondContact O-CA 3.48Å; Y283-Y294 VanDerWaalsContact CD1-CB 3.43Å; Y283-Y294 AromaticContact CD1-CD1 3.92Å; Y283-Y294 HydrophobicContact CD1-CD1 3.92Å; Y283-Y294 AromaticContact CD1-CG 3.87Å; Y283-Y294 HydrophobicContact CD1-CG 3.87Å; Y283-Y294 HydrophobicContact CE1-CD1 4.1Å; Y283-Y294 HydrophobicContact CE1-CD2 4.47Å; Y283-Y294 AromaticContact CE1-CG 3.85Å; Y283-Y294 HydrophobicContact CE1-CG 3.85Å; Y294-L307 HydrophobicContact CD2-CB 3.72Å; Y294-L307 HydrophobicContact CD2-CD1 4.05Å; Y294-L307 HydrophobicContact CE2-CB 4.06Å; Y294-L307 WeakPolarHBondContact O-CB 3.47Å; Y294-L307 PolarHBondContact O-N 3.46Å; Y294-N308 WeakPolarHBondContact CD1-O 3.41Å; Y294-N308 WeakPolarHBondContact CE1-O 3.43Å; Y294-N308 HydrophobicContact CE2-CB 3.63Å; Y294-N308 PolarHBondContact N-O 3.06Å; Y294-N308 VanDerWaalsContact N-O 3.17Å; Y294-N308 WeakPolarHBondContact OH-CB 3.45Å; Y294-F310 HydrophobicContact CE1-CB 4.35Å; Y294-M350 HydrophobicContact CD1-CE 3.75Å; Y294-M350 HydrophobicContact CE1-CE 3.32Å; Y294-M350 HydrophobicContact CE2-CE 4.33Å; Y294-M350 HydrophobicContact CG-CE 4.43Å
295	F	97.5	Very high	94.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	146.4	-171.7	-54.8	-102.1	0	0	0	108.6	L247 L264 V281 V282 V284 R293 I304 H305 F306	L247-F295 HydrophobicContact CD1-CD1 4.33Å; L247-F295 HydrophobicContact CD1-CD2 3.96Å; L247-F295 HydrophobicContact CD1-CE1 3.93Å; L247-F295 HydrophobicContact CD1-CE2 3.56Å; L247-F295 HydrophobicContact CD1-CG 4.36Å; L247-F295 HydrophobicContact CD1-CZ 3.56Å; L264-F295 HydrophobicContact CD2-CE1 4.36Å; L264-F295 HydrophobicContact CD2-CZ 3.75Å; V281-F295 CarbonylContact C-O 3.47Å; V281-F295 WeakPolarHBondContact CA-O 3.09Å; V282-F295 HydrophobicContact CG1-CB 3.85Å; V282-F295 HydrophobicContact CG1-CD2 4.48Å; V282-F295 PolarHBondContact N-O 2.77Å; V282-F295 PolarHBondContact O-N 3.5Å; V284-F295 HydrophobicContact CG2-CD2 4.35Å; V284-F295 HydrophobicContact CG2-CE2 3.72Å; R293-F295 HydrophobicContact CB-CE2 3.77Å; R293-F295 HydrophobicContact CB-CZ 4.25Å; F295-I304 HydrophobicContact CB-CG2 3.89Å; F295-I304 HydrophobicContact CD1-CG2 3.69Å; F295-I304 HydrophobicContact CG-CG2 3.98Å; F295-H305 CarbonylContact C-O 3.59Å; F295-H305 WeakPolarHBondContact CA-O 3.26Å; F295-F306 VanDerWaalsContact CD1-CA 3.5Å; F295-F306 HydrophobicContact CD1-CB 3.87Å; F295-F306 HydrophobicContact CD1-CD2 4.08Å; F295-F306 HydrophobicContact CD1-CG 4.5Å; F295-F306 HydrophobicContact CE1-CB 3.82Å; F295-F306 AromaticContact CE1-CD2 3.57Å; F295-F306 HydrophobicContact CE1-CD2 3.57Å; F295-F306 HydrophobicContact CE1-CG 4.17Å; F295-F306 AromaticContact CZ-CD2 3.81Å; F295-F306 HydrophobicContact CZ-CD2 3.81Å
296	E	96.7	Very high	94.8	Very high	16 Å²	16	45.4 Å²	45.4	8%	0.075	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	129.3	171.1	-169.1	-178.1	-179.7	0	0	108.5	R8 S10 F12 T298 H305 L307	R8-E296 IonicContact CZ-OE2 3.27Å; R8-E296 VanDerWaalsContact CZ-OE2 3.24Å; R8-E296 IonicContact NH1-OE2 3.02Å; R8-E296 PolarHBondContact NH1-OE2 2.88Å; R8-E296 IonicContact NH2-OE1 2.77Å; R8-E296 PolarHBondContact NH2-OE1 2.9Å; R8-E296 IonicContact NH2-OE2 3.75Å; R8-E296 PolarHBondContact NH2-OE2 2.92Å; S10-E296 WeakPolarHBondContact CB-OE2 3.43Å; S10-E296 PolarHBondContact OG-OE2 3.49Å; F12-E296 HydrophobicContact CD2-CG 4.36Å; E296-T298 HydrophobicContact CG-CG2 4.11Å; E296-H305 HydrophobicContact CB-CB 4.48Å; E296-H305 PolarHBondContact N-O 3.43Å; E296-H305 PolarHBondContact O-N 3.13Å; E296-L307 HydrophobicContact CB-CD1 4.07Å; E296-L307 HydrophobicContact CB-CD2 4.03Å; E296-L307 HydrophobicContact CB-CG 4.07Å
297	I	95.8	Very high	94.8	Very high	13 Å²	13	45.6 Å²	45.6	7%	0.067	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	125.8	176	-50.9	-58.5	0	0	0	108.5	L229 F235 L249 S280 V282 Y303 I304	L229-I297 HydrophobicContact CD1-CG1 4.38Å; L229-I297 HydrophobicContact CD1-CG2 3.88Å; F235-I297 HydrophobicContact CD2-CD1 4.33Å; F235-I297 HydrophobicContact CE2-CD1 4.23Å; L249-I297 HydrophobicContact CD2-CG2 4.18Å; S280-I297 WeakPolarHBondContact CB-O 3.31Å; S280-I297 PolarHBondContact O-N 3.37Å; V282-I297 HydrophobicContact CG1-CD1 3.93Å; V282-I297 HydrophobicContact CG1-CG1 4.11Å; I297-Y303 WeakPolarHBondContact CA-O 3.4Å; I297-I304 HydrophobicContact CD1-CB 4.26Å; I297-I304 HydrophobicContact CD1-CG1 3.88Å; I297-I304 HydrophobicContact CD1-CG2 4.16Å
298	T	94.2	Very high	94.9	Very high	34 Å²	34	46.7 Å²	46.7	21%	0.209	26%	0.255	C	S	.	.			trans	-138.4	165.2	177.6	65.6	0	0	0	0	111.2	E296 E300 Y303 H305	E296-T298 HydrophobicContact CG-CG2 4.11Å; T298-E300 PolarHBondContact O-N 3.48Å; T298-E300 PolarHBondContact OG1-N 2.84Å; T298-E300 PolarHBondContact OG1-O 2.94Å; T298-Y303 PolarHBondContact N-O 3.25Å; T298-Y303 WeakPolarHBondContact O-CA 3.4Å; T298-H305 PolarHBondContact OG1-CD2 3.23Å; T298-H305 PolarHBondContact OG1-NE2 2.79Å
299	E	90.4	Very high	95	Very high	164 Å²	164	45.9 Å²	45.9	77%	0.766	24%	0.239	S	C	*	.	S	Bend	trans	-72.7	-12.8	172.6	-60.6	179.2	-177.3	0	0	113.3	Y303	E299-Y303 WeakPolarHBondContact O-CD1 3.41Å; E299-Y303 WeakPolarHBondContact O-CE1 3.45Å
300	E	90.2	Very high	95.1	Very high	122 Å²	122	46 Å²	46	57%	0.57	24%	0.239	S	C	*	.	S	Bend	trans	-83.1	128.6	178.1	-65.5	-172.4	169.3	0	0	111.9	T298 Y303 H305	T298-E300 PolarHBondContact O-N 3.48Å; T298-E300 PolarHBondContact OG1-N 2.84Å; T298-E300 PolarHBondContact OG1-O 2.94Å; E300-Y303 VanDerWaalsContact O-CA 3.27Å; E300-Y303 WeakPolarHBondContact O-CA 3.37Å; E300-Y303 PolarHBondContact O-N 3.49Å; E300-H305 PolarHBondContact O-NE2 3.19Å
301	P	89.3	Confident	95.2	Very high	95 Å²	95	48.5 Å²	48.5	62%	0.617	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	137.9	173	-26.5	33.8	0	0	0	112.5	Y303	P301-Y303 VanDerWaalsContact C-N 3.33Å; P301-Y303 VanDerWaalsContact CA-N 3.31Å; P301-Y303 HydrophobicContact CB-CE2 4.41Å; P301-Y303 HydrophobicContact CG-CE1 4.19Å; P301-Y303 HydrophobicContact CG-CE2 4.3Å
302	P	92.4	Very high	95.1	Very high	85 Å²	85	49.1 Å²	49.1	55%	0.552	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	cis	-84.7	22.3	9.9	35.9	-40.4	0	0	0	115.7	A260 I304	A260-P302 VanDerWaalsContact CB-O 3.27Å; A260-P302 WeakPolarHBondContact CB-O 3.32Å; P302-I304 PolarHBondContact O-N 3.11Å
303	Y	94.1	Very high	94.8	Very high	63 Å²	63	59.1 Å²	59.1	25%	0.247	30%	0.299	C	S	.	.	S	Bend	trans	67.9	-49.7	179.2	-46.6	-78.6	0	0	0	115	L249 M259 A260 I297 T298 E299 E300 P301 H305	L249-Y303 HydrophobicContact CD2-CG 4.44Å; M259-Y303 HydrophobicContact CB-CD2 4.23Å; M259-Y303 HydrophobicContact CB-CE2 4.3Å; M259-Y303 HydrophobicContact CE-CD1 4.03Å; M259-Y303 HydrophobicContact CE-CE1 3.82Å; M259-Y303 HydrophobicContact CE-CE2 4.45Å; M259-Y303 HydrophobicContact CE-CG 4.44Å; M259-Y303 WeakPolarHBondContact O-CD2 3.31Å; M259-Y303 WeakPolarHBondContact O-CE2 3.4Å; A260-Y303 HydrophobicContact CB-CD2 4.2Å; I297-Y303 WeakPolarHBondContact CA-O 3.4Å; T298-Y303 PolarHBondContact N-O 3.25Å; T298-Y303 WeakPolarHBondContact O-CA 3.4Å; E299-Y303 WeakPolarHBondContact O-CD1 3.41Å; E299-Y303 WeakPolarHBondContact O-CE1 3.45Å; E300-Y303 VanDerWaalsContact O-CA 3.27Å; E300-Y303 WeakPolarHBondContact O-CA 3.37Å; E300-Y303 PolarHBondContact O-N 3.49Å; P301-Y303 VanDerWaalsContact C-N 3.33Å; P301-Y303 VanDerWaalsContact CA-N 3.31Å; P301-Y303 HydrophobicContact CB-CE2 4.41Å; P301-Y303 HydrophobicContact CG-CE1 4.19Å; P301-Y303 HydrophobicContact CG-CE2 4.3Å; Y303-H305 PolarHBondContact O-CD2 3.38Å
304	I	96.1	Very high	94.6	Very high	6 Å²	6	60.9 Å²	60.9	3%	0.031	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	108.4	174.6	-53.8	172.6	0	0	0	108.5	F235 L247 L249 A260 F295 I297 P302	F235-I304 HydrophobicContact CE2-CD1 4.08Å; L247-I304 HydrophobicContact CB-CD1 4.43Å; L249-I304 HydrophobicContact CB-CD1 4.07Å; L249-I304 HydrophobicContact CB-CG1 4.27Å; A260-I304 HydrophobicContact CB-CD1 3.74Å; A260-I304 HydrophobicContact CB-CG1 3.89Å; F295-I304 HydrophobicContact CB-CG2 3.89Å; F295-I304 HydrophobicContact CD1-CG2 3.69Å; F295-I304 HydrophobicContact CG-CG2 3.98Å; I297-I304 HydrophobicContact CD1-CB 4.26Å; I297-I304 HydrophobicContact CD1-CG1 3.88Å; I297-I304 HydrophobicContact CD1-CG2 4.16Å; P302-I304 PolarHBondContact O-N 3.11Å
305	H	95.8	Very high	94.5	Very high	26 Å²	26	64.4 Å²	64.4	12%	0.12	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	114.8	-178.7	-62.2	-91.8	0	0	0	111.1	F295 E296 T298 E300 Y303 L307	F295-H305 CarbonylContact C-O 3.59Å; F295-H305 WeakPolarHBondContact CA-O 3.26Å; E296-H305 HydrophobicContact CB-CB 4.48Å; E296-H305 PolarHBondContact N-O 3.43Å; E296-H305 PolarHBondContact O-N 3.13Å; T298-H305 PolarHBondContact OG1-CD2 3.23Å; T298-H305 PolarHBondContact OG1-NE2 2.79Å; E300-H305 PolarHBondContact O-NE2 3.19Å; Y303-H305 PolarHBondContact O-CD2 3.38Å; H305-L307 PolarHBondContact O-N 2.81Å
306	F	96.1	Very high	94.4	Very high	101 Å²	101	64.6 Å²	64.6	44%	0.443	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	126.4	174.2	177.3	-105.1	0	0	0	111.3	F295 T309	F295-F306 VanDerWaalsContact CD1-CA 3.5Å; F295-F306 HydrophobicContact CD1-CB 3.87Å; F295-F306 HydrophobicContact CD1-CD2 4.08Å; F295-F306 HydrophobicContact CD1-CG 4.5Å; F295-F306 HydrophobicContact CE1-CB 3.82Å; F295-F306 AromaticContact CE1-CD2 3.57Å; F295-F306 HydrophobicContact CE1-CD2 3.57Å; F295-F306 HydrophobicContact CE1-CG 4.17Å; F295-F306 AromaticContact CZ-CD2 3.81Å; F295-F306 HydrophobicContact CZ-CD2 3.81Å; F306-T309 WeakPolarHBondContact CE2-OG1 3.38Å; F306-T309 WeakPolarHBondContact CZ-OG1 3.37Å
307	L	95.1	Very high	94.3	Very high	5 Å²	5	67.1 Å²	67.1	3%	0.026	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-69.8	176.3	-66.6	177.3	0	0	0	110.4	F12 V281 Y294 E296 H305	F12-L307 HydrophobicContact CB-CD1 3.74Å; F12-L307 HydrophobicContact CB-CD2 4.28Å; V281-L307 HydrophobicContact CG1-CD1 4.24Å; V281-L307 HydrophobicContact CG2-CD1 4.21Å; Y294-L307 HydrophobicContact CD2-CB 3.72Å; Y294-L307 HydrophobicContact CD2-CD1 4.05Å; Y294-L307 HydrophobicContact CE2-CB 4.06Å; Y294-L307 WeakPolarHBondContact O-CB 3.47Å; Y294-L307 PolarHBondContact O-N 3.46Å; E296-L307 HydrophobicContact CB-CD1 4.07Å; E296-L307 HydrophobicContact CB-CD2 4.03Å; E296-L307 HydrophobicContact CB-CG 4.07Å; H305-L307 PolarHBondContact O-N 2.81Å
308	N	96.1	Very high	94.3	Very high	64 Å²	64	66.5 Å²	66.5	34%	0.342	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	176.2	-176.6	-164.7	7.8	0	0	0	110.3	Y294	Y294-N308 WeakPolarHBondContact CD1-O 3.41Å; Y294-N308 WeakPolarHBondContact CE1-O 3.43Å; Y294-N308 HydrophobicContact CE2-CB 3.63Å; Y294-N308 PolarHBondContact N-O 3.06Å; Y294-N308 VanDerWaalsContact N-O 3.17Å; Y294-N308 WeakPolarHBondContact OH-CB 3.45Å
309	T	96.6	Very high	94.5	Very high	37 Å²	37	64.9 Å²	64.9	23%	0.227	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	130.2	178.1	-59.8	0	0	0	0	109.4	I292 R293 F306	I292-T309 WeakPolarHBondContact O-CA 3.43Å; R293-T309 HydrophobicContact CG-CG2 3.9Å; F306-T309 WeakPolarHBondContact CE2-OG1 3.38Å; F306-T309 WeakPolarHBondContact CZ-OG1 3.37Å
310	F	97.3	Very high	94.8	Very high	21 Å²	21	57 Å²	57	9%	0.092	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	128.6	162.7	172.6	-99.8	0	0	0	108.7	G17 S291 I292 Y294 I348	G17-F310 WeakPolarHBondContact O-CD2 3.31Å; G17-F310 WeakPolarHBondContact O-CE2 3.44Å; S291-F310 CarbonylContact C-O 3.59Å; S291-F310 WeakPolarHBondContact CA-O 3.45Å; S291-F310 VanDerWaalsContact CB-O 3.31Å; S291-F310 WeakPolarHBondContact CB-O 3.42Å; I292-F310 HydrophobicContact CB-CB 4.32Å; I292-F310 HydrophobicContact CD1-CD1 4.15Å; I292-F310 HydrophobicContact CG1-CD1 4.27Å; I292-F310 PolarHBondContact N-O 3.16Å; I292-F310 PolarHBondContact O-N 3.36Å; Y294-F310 HydrophobicContact CE1-CB 4.35Å; F310-I348 HydrophobicContact CD1-CD1 4.19Å; F310-I348 HydrophobicContact CD1-CG2 4.33Å; F310-I348 HydrophobicContact CD2-CG2 4.37Å; F310-I348 HydrophobicContact CE1-CD1 3.54Å; F310-I348 HydrophobicContact CE1-CG1 4.21Å; F310-I348 HydrophobicContact CE1-CG2 4.13Å; F310-I348 HydrophobicContact CE2-CG2 4.17Å; F310-I348 HydrophobicContact CG-CG2 4.45Å; F310-I348 HydrophobicContact CZ-CD1 4.1Å; F310-I348 HydrophobicContact CZ-CG1 4.29Å; F310-I348 HydrophobicContact CZ-CG2 4.03Å
311	T	96.2	Very high	95.1	Very high	96 Å²	96	53.8 Å²	53.8	59%	0.589	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	138.1	-179.4	-54.7	0	0	0	0	109.9
312	S	94.5	Very high	95.5	Very high	27 Å²	27	49.9 Å²	49.9	19%	0.189	26%	0.257	C	S	.	.			trans	-133	173.9	174.6	67	0	0	0	0	110.4	S290 E314 K339	S290-S312 VanDerWaalsContact CB-O 3.24Å; S290-S312 WeakPolarHBondContact CB-O 3.47Å; S290-S312 PolarHBondContact O-N 3.47Å; S290-S312 PolarHBondContact O-OG 2.95Å; S290-S312 PolarHBondContact OG-O 3.37Å; S312-E314 PolarHBondContact OG-O 3.13Å; S312-K339 PolarHBondContact OG-NZ 2.74Å
313	K	92	Very high	95.7	Very high	212 Å²	212	48.1 Å²	48.1	92%	0.922	25%	0.246	S	C	*	.	S	Bend	trans	-86.4	-28.4	-178.3	-63.9	-177.3	-178.2	178.4	0	113.3
314	E	92.2	Very high	95.7	Very high	90 Å²	90	46.3 Å²	46.3	42%	0.421	24%	0.239	S	C	.	.	S	Bend	trans	-100.7	139.1	-171.6	-66.6	175.3	146.4	0	0	110.7	S312 K339 H341 K344	S312-E314 PolarHBondContact OG-O 3.13Å; E314-K339 PolarHBondContact O-NZ 2.95Å; E314-H341 WeakPolarHBondContact CB-ND1 3.49Å; E314-H341 IonicContact OE2-CE1 3.54Å; E314-H341 PolarHBondContact OE2-CE1 2.74Å; E314-H341 IonicContact OE2-ND1 2.82Å; E314-H341 PolarHBondContact OE2-ND1 3.02Å; E314-K344 WeakPolarHBondContact OE2-CE 3.33Å; E314-K344 IonicContact OE2-NZ 3.47Å; E314-K344 PolarHBondContact OE2-NZ 3.49Å
315	P	95.1	Very high	95.6	Very high	76 Å²	76	48.7 Å²	48.7	49%	0.494	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-73.7	143.9	176.7	30.6	-34.5	0	0	0	111.4	G288 D289	G288-P315 VanDerWaalsContact O-CB 3.31Å; G288-P315 WeakPolarHBondContact O-CB 3.44Å; D289-P315 CarbonylContact O-C 3.57Å; D289-P315 WeakPolarHBondContact O-CA 3.39Å
316	Q	95.3	Very high	95.5	Very high	3 Å²	3	48.2 Å²	48.2	1%	0.014	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-79.9	138.7	175.2	70.5	-170.5	57.7	0	0	111.6	C285 G286 G288 D289 M319 K339 L340	C285-Q316 PolarHBondContact SG-NE2 2.83Å; G286-Q316 WeakPolarHBondContact O-CG 3.48Å; G286-Q316 PolarHBondContact O-NE2 2.78Å; G288-Q316 PolarHBondContact N-O 2.85Å; D289-Q316 WeakPolarHBondContact O-CG 3.32Å; D289-Q316 PolarHBondContact O-N 2.73Å; Q316-M319 HydrophobicContact CB-CE 4.37Å; Q316-K339 HydrophobicContact CB-CD 4.39Å; Q316-K339 HydrophobicContact CB-CG 4.05Å; Q316-L340 CarbonylContact C-O 3.59Å; Q316-L340 WeakPolarHBondContact CA-O 3.46Å
317	R	95.8	Very high	95.5	Very high	69 Å²	69	44.1 Å²	44.1	26%	0.26	23%	0.233	S	C	.	.	S	Bend	trans	-94.8	-17.6	168.3	-71.8	-159.9	175.6	-168.5	-0.1	113.5	V31 R33 K287 L340 E342	V31-R317 HydrophobicContact CG1-CB 4.3Å; R33-R317 VanDerWaalsContact CG-NH1 3.29Å; K287-R317 VanDerWaalsContact CD-O 3.26Å; K287-R317 WeakPolarHBondContact CD-O 3.26Å; K287-R317 WeakPolarHBondContact CE-O 3.37Å; K287-R317 WeakPolarHBondContact CG-O 3.31Å; R317-L340 PolarHBondContact N-O 2.8Å; R317-E342 IonicContact CZ-OE1 3.76Å; R317-E342 IonicContact NH1-OE1 3.9Å; R317-E342 IonicContact NH2-OE1 2.98Å; R317-E342 PolarHBondContact NH2-OE1 3.43Å; R317-E342 IonicContact NH2-OE2 3.45Å; R317-E342 PolarHBondContact NH2-OE2 2.83Å
318	G	95.9	Very high	95.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.2	170.1	-177.4	0	0	0	0	0	109.4	T39 L340	T39-G318 CarbonylContact O-C 3.56Å; T39-G318 WeakPolarHBondContact O-CA 3.18Å; G318-L340 PolarHBondContact O-N 3.46Å
319	M	97.4	Very high	95.2	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	120.5	-174.1	-170.4	67.1	70.4	0	0	109.9	T39 F274 I292 Q316 F337 K339	T39-M319 WeakPolarHBondContact CB-O 3.3Å; T39-M319 PolarHBondContact O-N 2.92Å; F274-M319 HydrophobicContact CE2-CB 4.3Å; F274-M319 HydrophobicContact CE2-CG 4.11Å; F274-M319 HydrophobicContact CZ-CB 4.1Å; F274-M319 HydrophobicContact CZ-CG 4.1Å; I292-M319 HydrophobicContact CD1-CE 3.73Å; I292-M319 HydrophobicContact CD1-SD 4.36Å; I292-M319 HydrophobicContact CG1-CE 4.04Å; Q316-M319 HydrophobicContact CB-CE 4.37Å; M319-F337 HydrophobicContact CG-CD1 3.78Å; M319-F337 HydrophobicContact SD-CB 3.69Å; M319-F337 HydrophobicContact SD-CD1 3.97Å; M319-F337 HydrophobicContact SD-CG 4.17Å; M319-K339 HydrophobicContact CE-CB 3.93Å; M319-K339 HydrophobicContact CE-CD 4.4Å; M319-K339 HydrophobicContact CE-CG 3.94Å; M319-K339 HydrophobicContact SD-CB 3.9Å
320	G	97.3	Very high	94.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	154.8	168.7	0	0	0	0	0	110.8	C41 F337 Y338	C41-G320 WeakPolarHBondContact O-CA 3.5Å; G320-F337 CarbonylContact O-C 3.53Å; G320-F337 WeakPolarHBondContact O-CA 3.13Å; G320-Y338 PolarHBondContact N-O 3.39Å; G320-Y338 PolarHBondContact O-N 2.9Å
321	S	97.1	Very high	94.5	Very high	53 Å²	53	50.4 Å²	50.4	37%	0.371	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	128.7	174.2	55.9	0	0	0	0	110.4	V43 F274	V43-S321 WeakPolarHBondContact CG1-O 3.47Å; F274-S321 WeakPolarHBondContact CD1-OG 3.25Å
322	M	97.8	Very high	94.4	Very high	13 Å²	13	46.1 Å²	46.1	6%	0.064	24%	0.235	C	C	.	.			trans	-72.3	128.8	177.1	-177.3	57.1	76.3	0	0	111.3	V43 L65 L327 R336 Y338	V43-M322 HydrophobicContact CG1-CB 4.44Å; V43-M322 HydrophobicContact CG2-CE 3.39Å; V43-M322 HydrophobicContact CG2-SD 4.19Å; L65-M322 HydrophobicContact CD1-CE 3.68Å; L65-M322 HydrophobicContact CD2-CE 4.2Å; M322-L327 HydrophobicContact CB-CD2 4.03Å; M322-L327 HydrophobicContact CG-CD2 3.86Å; M322-R336 HydrophobicContact CB-CB 3.7Å; M322-R336 WeakPolarHBondContact CB-O 3.5Å; M322-R336 HydrophobicContact CG-CB 4.38Å; M322-R336 PolarHBondContact N-O 3.11Å; M322-Y338 HydrophobicContact CB-CE2 4.22Å; M322-Y338 HydrophobicContact CE-CE2 3.66Å; M322-Y338 VanDerWaalsContact CE-OH 3.24Å; M322-Y338 WeakPolarHBondContact CE-OH 3.42Å
323	P	96.3	Very high	94.4	Very high	48 Å²	48	44.9 Å²	44.9	31%	0.312	23%	0.226	S	C	.	.			trans	-59.5	155.5	168.9	-24.7	34.4	0	0	0	112.1	V43 R325 G326	V43-P323 WeakPolarHBondContact O-CD 3.18Å; P323-R325 PolarHBondContact O-N 3.08Å; P323-R325 VanDerWaalsContact O-N 3.08Å; P323-G326 PolarHBondContact O-N 3.42Å
324	K	94.3	Very high	94.6	Very high	25 Å²	25	34.8 Å²	34.8	11%	0.109	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-52.5	-36.2	-177.5	-71.8	-67.2	-168.3	179.6	0	114.5	D276 D278 G326 L327 I334 T367 L392	D276-K324 WeakPolarHBondContact OD1-CE 3.48Å; D276-K324 IonicContact OD1-NZ 3.59Å; D276-K324 PolarHBondContact OD1-NZ 2.83Å; D276-K324 VanDerWaalsContact OD1-NZ 3.16Å; D276-K324 VanDerWaalsContact OD2-CE 3.23Å; D276-K324 WeakPolarHBondContact OD2-CE 3.4Å; D276-K324 IonicContact OD2-NZ 2.81Å; D276-K324 PolarHBondContact OD2-NZ 2.73Å; D278-K324 VanDerWaalsContact OD2-CE 3.3Å; D278-K324 WeakPolarHBondContact OD2-CE 3.36Å; D278-K324 WeakPolarHBondContact OD2-CG 3.33Å; K324-G326 PolarHBondContact O-N 2.87Å; K324-L327 HydrophobicContact CD-CD1 3.69Å; K324-L327 PolarHBondContact O-N 2.85Å; K324-I334 PolarHBondContact NZ-O 2.98Å; K324-T367 HydrophobicContact CB-CG2 3.93Å; K324-L392 HydrophobicContact CB-CD1 4.32Å
325	R	94	Very high	94.9	Very high	57 Å²	57	31.1 Å²	31.1	22%	0.215	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-60.6	-24	177.7	-63.7	-172.4	-71.6	107.6	-4.4	114.2	P45 P92 D95 P323 I390	P45-R325 HydrophobicContact CG-CB 3.75Å; P92-R325 PolarHBondContact O-NH2 2.94Å; D95-R325 IonicContact OD1-CZ 3.87Å; D95-R325 IonicContact OD1-NH1 2.58Å; D95-R325 PolarHBondContact OD1-NH1 3.03Å; D95-R325 VanDerWaalsContact OD1-NH1 3.08Å; D95-R325 IonicContact OD1-NH2 3.19Å; D95-R325 PolarHBondContact OD1-NH2 3.01Å; D95-R325 IonicContact OD2-CZ 3.24Å; D95-R325 IonicContact OD2-NH1 3.16Å; D95-R325 PolarHBondContact OD2-NH1 2.72Å; D95-R325 IonicContact OD2-NH2 3.02Å; P323-R325 PolarHBondContact O-N 3.08Å; P323-R325 VanDerWaalsContact O-N 3.08Å; R325-I390 HydrophobicContact CG-CD1 4.05Å
326	G	93.8	Very high	95	Very high	16 Å²	16	28.9 Å²	28.9	17%	0.165	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-99.6	6.1	-177.5	0	0	0	0	0	115.1	P323 K324 R336	P323-G326 PolarHBondContact O-N 3.42Å; K324-G326 PolarHBondContact O-N 2.87Å; G326-R336 PolarHBondContact O-NH1 2.99Å; G326-R336 PolarHBondContact O-NH2 3.37Å
327	L	94.9	Very high	95.2	Very high	15 Å²	15	28.9 Å²	28.9	8%	0.079	15%	0.149	C	C	.	.	S	Bend	trans	-85.3	148.4	-178.9	-57.6	-178.7	0	0	0	112.3	M322 K324 V329 E333 I334 R336	M322-L327 HydrophobicContact CB-CD2 4.03Å; M322-L327 HydrophobicContact CG-CD2 3.86Å; K324-L327 HydrophobicContact CD-CD1 3.69Å; K324-L327 PolarHBondContact O-N 2.85Å; L327-V329 PolarHBondContact O-N 3.07Å; L327-V329 VanDerWaalsContact O-N 3.12Å; L327-E333 HydrophobicContact CB-CG 4.47Å; L327-E333 HydrophobicContact CD2-CG 4.19Å; L327-I334 VanDerWaalsContact CD1-C 3.49Å; L327-I334 WeakPolarHBondContact CD1-O 3.45Å; L327-R336 HydrophobicContact CD2-CB 3.98Å
328	E	92.8	Very high	95.3	Very high	78 Å²	78	25.9 Å²	25.9	36%	0.364	14%	0.138	S	C	.	.			trans	-83.5	83.6	173.6	-73.5	-179.3	167.4	0	0	110.9	S330 K331 E333	E328-S330 PolarHBondContact O-N 3.01Å; E328-S330 VanDerWaalsContact O-N 3.16Å; E328-K331 PolarHBondContact O-N 2.88Å; E328-K331 IonicContact OE1-NZ 3.26Å; E328-K331 VanDerWaalsContact OE2-CD 3.22Å; E328-K331 WeakPolarHBondContact OE2-CD 3.42Å; E328-K331 WeakPolarHBondContact OE2-CE 3.39Å; E328-K331 IonicContact OE2-NZ 2.73Å; E328-K331 PolarHBondContact OE2-NZ 3.05Å; E328-E333 HydrophobicContact CB-CB 4.49Å; E328-E333 WeakPolarHBondContact CB-OE2 3.24Å; E328-E333 PolarHBondContact N-OE2 2.7Å; E328-E333 PolarHBondContact O-N 2.79Å
329	V	91.7	Very high	95.4	Very high	10 Å²	10	26 Å²	26	6%	0.061	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-58.6	-29.9	-179.5	-177.1	0	0	0	0	112.5	L327 K331 C332 F359 Y364 L392 Y396	L327-V329 PolarHBondContact O-N 3.07Å; L327-V329 VanDerWaalsContact O-N 3.12Å; V329-K331 PolarHBondContact O-N 2.86Å; V329-C332 PolarHBondContact O-N 2.86Å; V329-F359 HydrophobicContact CG1-CD2 3.69Å; V329-F359 HydrophobicContact CG1-CE2 3.3Å; V329-F359 HydrophobicContact CG1-CZ 4.22Å; V329-Y364 HydrophobicContact CB-CE1 4.5Å; V329-Y364 HydrophobicContact CB-CE2 4.35Å; V329-Y364 HydrophobicContact CG1-CD1 4.26Å; V329-Y364 HydrophobicContact CG1-CD2 3.46Å; V329-Y364 VanDerWaalsContact CG1-CD2 3.46Å; V329-Y364 HydrophobicContact CG1-CE1 4.23Å; V329-Y364 HydrophobicContact CG1-CE2 3.45Å; V329-Y364 VanDerWaalsContact CG1-CE2 3.45Å; V329-Y364 HydrophobicContact CG1-CG 3.89Å; V329-Y364 HydrophobicContact CG2-CD1 4.25Å; V329-Y364 HydrophobicContact CG2-CE1 4.11Å; V329-L392 HydrophobicContact CG2-CB 4.12Å; V329-L392 HydrophobicContact CG2-CD1 4.21Å; V329-Y396 HydrophobicContact CG1-CD2 4.15Å
330	S	89.3	Confident	95.4	Very high	41 Å²	41	26 Å²	26	29%	0.287	14%	0.138	S	C	.	.	G	3₁₀ helix	trans	-64.6	-22.9	177	63.8	0	0	0	0	114.4	E328 V397	E328-S330 PolarHBondContact O-N 3.01Å; E328-S330 VanDerWaalsContact O-N 3.16Å; S330-V397 WeakPolarHBondContact CB-O 3.5Å
331	K	90.8	Very high	95.3	Very high	129 Å²	129	26.4 Å²	26.4	56%	0.561	14%	0.14	S	C	*	.	G	3₁₀ helix	trans	-103.5	10	178.8	-61.9	-173.8	-165	152.1	0	113.2	E328 V329 E333 T351	E328-K331 PolarHBondContact O-N 2.88Å; E328-K331 IonicContact OE1-NZ 3.26Å; E328-K331 VanDerWaalsContact OE2-CD 3.22Å; E328-K331 WeakPolarHBondContact OE2-CD 3.42Å; E328-K331 WeakPolarHBondContact OE2-CE 3.39Å; E328-K331 IonicContact OE2-NZ 2.73Å; E328-K331 PolarHBondContact OE2-NZ 3.05Å; V329-K331 PolarHBondContact O-N 2.86Å; K331-E333 PolarHBondContact O-N 2.8Å; K331-T351 WeakPolarHBondContact O-CG2 3.43Å
332	C	93.9	Very high	95.1	Very high	7 Å²	7	27.8 Å²	27.8	5%	0.047	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	34.6	-174.9	-58.8	0	0	0	0	113	V329 V352 L363 Y364	V329-C332 PolarHBondContact O-N 2.86Å; C332-V352 WeakPolarHBondContact CB-O 3.38Å; C332-V352 PolarHBondContact O-N 3.22Å; C332-L363 HydrophobicContact CB-CD1 4.28Å; C332-Y364 WeakPolarHBondContact CA-OH 3.38Å
333	E	95.5	Very high	95	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	122.4	171	179.8	179.5	-147.9	0	0	110.6	L327 E328 K331 R336 V349 M350 Y364	L327-E333 HydrophobicContact CB-CG 4.47Å; L327-E333 HydrophobicContact CD2-CG 4.19Å; E328-E333 HydrophobicContact CB-CB 4.49Å; E328-E333 WeakPolarHBondContact CB-OE2 3.24Å; E328-E333 PolarHBondContact N-OE2 2.7Å; E328-E333 PolarHBondContact O-N 2.79Å; K331-E333 PolarHBondContact O-N 2.8Å; E333-R336 WeakPolarHBondContact OE1-CB 3.43Å; E333-R336 WeakPolarHBondContact OE1-CG 3.39Å; E333-R336 IonicContact OE1-CZ 2.74Å; E333-R336 IonicContact OE1-NE 3.9Å; E333-R336 PolarHBondContact OE1-NE 2.9Å; E333-R336 IonicContact OE1-NH2 2.73Å; E333-R336 PolarHBondContact OE1-NH2 2.93Å; E333-R336 IonicContact OE2-CZ 2.8Å; E333-R336 IonicContact OE2-NE 3.74Å; E333-R336 IonicContact OE2-NH2 3.12Å; E333-R336 PolarHBondContact OE2-NH2 3.02Å; E333-V349 HydrophobicContact CB-CG1 4.19Å; E333-V349 HydrophobicContact CG-CG1 3.76Å; E333-V349 WeakPolarHBondContact OE1-CG1 3.28Å; E333-M350 WeakPolarHBondContact CA-O 3.38Å; E333-Y364 PolarHBondContact N-OH 2.8Å; E333-Y364 WeakPolarHBondContact O-CE1 3.47Å; E333-Y364 PolarHBondContact O-OH 2.97Å
334	I	96.3	Very high	94.9	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-22.9	-179.3	56.7	165	0	0	0	113.4	F12 V15 Y283 K324 L327 M350 V352	F12-I334 HydrophobicContact CD1-CD1 4.17Å; F12-I334 HydrophobicContact CE1-CD1 4.45Å; V15-I334 HydrophobicContact CG1-CD1 4.09Å; V15-I334 HydrophobicContact CG2-CD1 3.64Å; Y283-I334 WeakPolarHBondContact OH-CD1 3.42Å; K324-I334 PolarHBondContact NZ-O 2.98Å; L327-I334 VanDerWaalsContact CD1-C 3.49Å; L327-I334 WeakPolarHBondContact CD1-O 3.45Å; I334-M350 HydrophobicContact CG1-CB 4.3Å; I334-M350 WeakPolarHBondContact CG1-O 3.45Å; I334-M350 PolarHBondContact N-O 2.63Å; I334-V352 HydrophobicContact CB-CG2 4.5Å; I334-V352 HydrophobicContact CD1-CG2 3.83Å; I334-V352 HydrophobicContact CG1-CG2 4.15Å; I334-V352 HydrophobicContact CG2-CG2 3.58Å
335	A	97.6	Very high	95.1	Very high	12 Å²	12	32.4 Å²	32.4	10%	0.099	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	148.7	174.6	0	0	0	0	0	110.3	Y283 F337 M350	Y283-A335 HydrophobicContact CE2-CB 4.03Å; A335-F337 HydrophobicContact CB-CE2 4.14Å; A335-M350 HydrophobicContact CB-CB 4.05Å; A335-M350 HydrophobicContact CB-CG 4.1Å; A335-M350 WeakPolarHBondContact O-CA 3.36Å; A335-M350 VanDerWaalsContact O-CB 3.29Å; A335-M350 WeakPolarHBondContact O-CB 3.33Å; A335-M350 PolarHBondContact O-N 3.36Å
336	R	98.1	Very high	95.2	Very high	30 Å²	30	30.7 Å²	30.7	11%	0.113	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	124.5	170.3	-160.9	-178.4	-65.5	151.3	1.8	109.7	M322 G326 L327 E333 Y338 I348 V349	M322-R336 HydrophobicContact CB-CB 3.7Å; M322-R336 WeakPolarHBondContact CB-O 3.5Å; M322-R336 HydrophobicContact CG-CB 4.38Å; M322-R336 PolarHBondContact N-O 3.11Å; G326-R336 PolarHBondContact O-NH1 2.99Å; G326-R336 PolarHBondContact O-NH2 3.37Å; L327-R336 HydrophobicContact CD2-CB 3.98Å; E333-R336 WeakPolarHBondContact OE1-CB 3.43Å; E333-R336 WeakPolarHBondContact OE1-CG 3.39Å; E333-R336 IonicContact OE1-CZ 2.74Å; E333-R336 IonicContact OE1-NE 3.9Å; E333-R336 PolarHBondContact OE1-NE 2.9Å; E333-R336 IonicContact OE1-NH2 2.73Å; E333-R336 PolarHBondContact OE1-NH2 2.93Å; E333-R336 IonicContact OE2-CZ 2.8Å; E333-R336 IonicContact OE2-NE 3.74Å; E333-R336 IonicContact OE2-NH2 3.12Å; E333-R336 PolarHBondContact OE2-NH2 3.02Å; R336-Y338 HydrophobicContact CB-CE2 4.38Å; R336-Y338 HydrophobicContact CG-CE2 3.93Å; R336-I348 WeakPolarHBondContact CA-O 3.33Å; R336-V349 HydrophobicContact CG-CG2 4.41Å
337	F	98.3	Very high	95.4	Very high	3 Å²	3	30.2 Å²	30.2	1%	0.013	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	138.5	176.6	-74.1	-74	0	0	0	110.7	F274 Y283 I292 M319 G320 A335 P347 I348 M350	F274-F337 HydrophobicContact CB-CE1 4.1Å; F274-F337 HydrophobicContact CB-CZ 4.35Å; F274-F337 HydrophobicContact CD1-CE1 4.43Å; F274-F337 HydrophobicContact CD2-CE1 4.03Å; F274-F337 AromaticContact CG-CE1 3.94Å; F274-F337 HydrophobicContact CG-CE1 3.94Å; Y283-F337 VanDerWaalsContact CB-CZ 3.47Å; Y283-F337 AromaticContact CD1-CE2 3.5Å; Y283-F337 HydrophobicContact CD1-CE2 3.5Å; Y283-F337 AromaticContact CD1-CZ 3.78Å; Y283-F337 HydrophobicContact CD1-CZ 3.78Å; Y283-F337 HydrophobicContact CD2-CE2 4.11Å; Y283-F337 AromaticContact CD2-CZ 3.71Å; Y283-F337 HydrophobicContact CD2-CZ 3.71Å; Y283-F337 AromaticContact CE1-CE2 3.93Å; Y283-F337 HydrophobicContact CE1-CE2 3.93Å; Y283-F337 HydrophobicContact CE1-CZ 4.48Å; Y283-F337 HydrophobicContact CE2-CE2 4.44Å; Y283-F337 HydrophobicContact CE2-CZ 4.39Å; Y283-F337 AromaticContact CG-CE2 3.63Å; Y283-F337 HydrophobicContact CG-CE2 3.63Å; Y283-F337 AromaticContact CG-CZ 3.37Å; Y283-F337 HydrophobicContact CG-CZ 3.37Å; I292-F337 HydrophobicContact CD1-CB 4.28Å; I292-F337 HydrophobicContact CD1-CD2 4.24Å; I292-F337 HydrophobicContact CD1-CG 4.19Å; M319-F337 HydrophobicContact CG-CD1 3.78Å; M319-F337 HydrophobicContact SD-CB 3.69Å; M319-F337 HydrophobicContact SD-CD1 3.97Å; M319-F337 HydrophobicContact SD-CG 4.17Å; G320-F337 CarbonylContact O-C 3.53Å; G320-F337 WeakPolarHBondContact O-CA 3.13Å; A335-F337 HydrophobicContact CB-CE2 4.14Å; F337-P347 CarbonylContact O-C 3.43Å; F337-P347 VanDerWaalsContact O-CA 3.25Å; F337-P347 WeakPolarHBondContact O-CA 3.39Å; F337-I348 HydrophobicContact CB-CB 4.3Å; F337-I348 PolarHBondContact N-O 2.85Å; F337-I348 PolarHBondContact O-N 3.06Å; F337-M350 HydrophobicContact CD2-CG 3.82Å; F337-M350 HydrophobicContact CD2-SD 4.35Å; F337-M350 HydrophobicContact CE2-CG 3.87Å
338	Y	98.1	Very high	95.5	Very high	6 Å²	6	29.5 Å²	29.5	2%	0.024	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	86.6	175.9	-77.5	-105.9	0	0	0	107.9	Y26 V43 L48 L65 G320 M322 R336 L340 P347	Y26-Y338 HydrophobicContact CE2-CD1 4.21Å; Y26-Y338 AromaticContact CE2-CE1 3.87Å; Y26-Y338 HydrophobicContact CE2-CE1 3.87Å; V43-Y338 HydrophobicContact CB-CD2 4.26Å; V43-Y338 HydrophobicContact CB-CE2 4.46Å; V43-Y338 HydrophobicContact CG1-CD2 3.77Å; V43-Y338 HydrophobicContact CG1-CE2 4.14Å; V43-Y338 HydrophobicContact CG1-CG 4.35Å; V43-Y338 HydrophobicContact CG2-CD2 4.08Å; V43-Y338 HydrophobicContact CG2-CE1 4.25Å; V43-Y338 HydrophobicContact CG2-CE2 3.81Å; V43-Y338 HydrophobicContact CG2-CG 4.44Å; L48-Y338 HydrophobicContact CD1-CD1 3.72Å; L48-Y338 HydrophobicContact CD1-CE1 4.38Å; L48-Y338 HydrophobicContact CD1-CG 4.18Å; L48-Y338 HydrophobicContact CD2-CD1 4.1Å; L48-Y338 HydrophobicContact CD2-CE1 4.47Å; L48-Y338 HydrophobicContact CG-CD1 4.43Å; L65-Y338 HydrophobicContact CD2-CE1 4.2Å; G320-Y338 PolarHBondContact N-O 3.39Å; G320-Y338 PolarHBondContact O-N 2.9Å; M322-Y338 HydrophobicContact CB-CE2 4.22Å; M322-Y338 HydrophobicContact CE-CE2 3.66Å; M322-Y338 VanDerWaalsContact CE-OH 3.24Å; M322-Y338 WeakPolarHBondContact CE-OH 3.42Å; R336-Y338 HydrophobicContact CB-CE2 4.38Å; R336-Y338 HydrophobicContact CG-CE2 3.93Å; Y338-L340 PolarHBondContact O-N 2.76Å; Y338-P347 HydrophobicContact CD1-CG 4.1Å; Y338-P347 HydrophobicContact CE1-CB 4.43Å; Y338-P347 HydrophobicContact CE1-CG 3.91Å
339	K	98	Very high	95.8	Very high	2 Å²	2	27 Å²	27	1%	0.009	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	120	-174.8	178.2	176.6	172.2	165.4	0	110.1	S312 E314 Q316 M319 H341 C345 E346 I348	S312-K339 PolarHBondContact OG-NZ 2.74Å; E314-K339 PolarHBondContact O-NZ 2.95Å; Q316-K339 HydrophobicContact CB-CD 4.39Å; Q316-K339 HydrophobicContact CB-CG 4.05Å; M319-K339 HydrophobicContact CE-CB 3.93Å; M319-K339 HydrophobicContact CE-CD 4.4Å; M319-K339 HydrophobicContact CE-CG 3.94Å; M319-K339 HydrophobicContact SD-CB 3.9Å; K339-H341 VanDerWaalsContact CE-CE1 3.4Å; K339-H341 WeakPolarHBondContact CE-CE1 3.08Å; K339-H341 PolarHBondContact O-CD2 3.41Å; K339-C345 CarbonylContact O-C 3.58Å; K339-C345 WeakPolarHBondContact O-CA 2.85Å; K339-E346 WeakPolarHBondContact CB-O 3.28Å; K339-E346 PolarHBondContact N-O 3.26Å; K339-E346 PolarHBondContact O-N 3.44Å; K339-I348 HydrophobicContact CB-CD1 3.71Å; K339-I348 HydrophobicContact CB-CG1 4.48Å; K339-I348 HydrophobicContact CD-CD1 3.81Å; K339-I348 HydrophobicContact CG-CD1 4.39Å
340	L	97.6	Very high	96.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	131	173.1	-58.8	-173.3	0	0	0	110.4	V31 F40 C41 V50 Q316 R317 G318 Y338 C345	V31-L340 HydrophobicContact CG1-CB 4.35Å; V31-L340 HydrophobicContact CG1-CD1 3.89Å; V31-L340 HydrophobicContact CG2-CB 4.31Å; V31-L340 HydrophobicContact CG2-CD1 4.38Å; V31-L340 HydrophobicContact CG2-CD2 4.44Å; F40-L340 HydrophobicContact CB-CD1 3.92Å; C41-L340 HydrophobicContact CB-CD1 3.7Å; C41-L340 HydrophobicContact CB-CD2 4.29Å; C41-L340 HydrophobicContact CB-CG 3.89Å; V50-L340 HydrophobicContact CG1-CD1 3.82Å; V50-L340 HydrophobicContact CG1-CD2 3.96Å; V50-L340 HydrophobicContact CG2-CD2 3.94Å; Q316-L340 CarbonylContact C-O 3.59Å; Q316-L340 WeakPolarHBondContact CA-O 3.46Å; R317-L340 PolarHBondContact N-O 2.8Å; G318-L340 PolarHBondContact O-N 3.46Å; Y338-L340 PolarHBondContact O-N 2.76Å; L340-C345 HydrophobicContact CD2-CB 3.72Å
341	H	95.7	Very high	96.4	Very high	8 Å²	8	25.5 Å²	25.5	4%	0.037	12%	0.115	C	C	.	.			trans	-107.5	-165.3	167.9	-60.3	-102.9	0	0	0	108.6	V31 E314 K339 K344 E346	V31-H341 WeakPolarHBondContact CG2-O 3.42Å; E314-H341 WeakPolarHBondContact CB-ND1 3.49Å; E314-H341 IonicContact OE2-CE1 3.54Å; E314-H341 PolarHBondContact OE2-CE1 2.74Å; E314-H341 IonicContact OE2-ND1 2.82Å; E314-H341 PolarHBondContact OE2-ND1 3.02Å; K339-H341 VanDerWaalsContact CE-CE1 3.4Å; K339-H341 WeakPolarHBondContact CE-CE1 3.08Å; K339-H341 PolarHBondContact O-CD2 3.41Å; H341-K344 HydrophobicContact CB-CD 4.46Å; H341-K344 HydrophobicContact CB-CG 3.57Å; H341-K344 WeakPolarHBondContact CD2-CE 3.11Å; H341-K344 VanDerWaalsContact CE1-CE 3.49Å; H341-K344 WeakPolarHBondContact CE1-CE 3.31Å; H341-K344 PolarHBondContact N-O 2.8Å; H341-K344 WeakPolarHBondContact NE2-CE 3.33Å; H341-E346 IonicContact CE1-OE2 3.22Å; H341-E346 PolarHBondContact CE1-OE2 3.21Å; H341-E346 IonicContact NE2-OE2 3.16Å; H341-E346 PolarHBondContact NE2-OE2 3.36Å
342	E	92.8	Very high	96.7	Very high	82 Å²	82	19.5 Å²	19.5	38%	0.383	9%	0.089	S	C	.	.	S	Bend	trans	-68.2	-40.6	177.4	-179.4	162.9	-154.4	0	0	113.4	R33 R317	R33-E342 IonicContact CZ-OE1 3.66Å; R33-E342 IonicContact NE-OE1 3.91Å; R33-E342 IonicContact NH2-OE1 2.8Å; R33-E342 PolarHBondContact NH2-OE1 2.72Å; R317-E342 IonicContact CZ-OE1 3.76Å; R317-E342 IonicContact NH1-OE1 3.9Å; R317-E342 IonicContact NH2-OE1 2.98Å; R317-E342 PolarHBondContact NH2-OE1 3.43Å; R317-E342 IonicContact NH2-OE2 3.45Å; R317-E342 PolarHBondContact NH2-OE2 2.83Å
343	R	94.4	Very high	96.6	Very high	141 Å²	141	22.4 Å²	22.4	53%	0.532	11%	0.108	S	C	.	.	S	Bend	trans	-129.2	9.6	-176.2	-60.4	-163.8	-170.2	-120.3	0.7	115.3	D28 I29	D28-R343 PolarHBondContact N-O 3.1Å; I29-R343 PolarHBondContact N-O 3.11Å; I29-R343 VanDerWaalsContact N-O 3.15Å; I29-R343 CarbonylContact O-C 3.6Å; I29-R343 WeakPolarHBondContact O-CA 3.4Å
344	K	95.1	Very high	96.3	Very high	43 Å²	43	26.8 Å²	26.8	19%	0.187	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	150.7	-177.9	65.3	170.1	-178	168.6	0	111.7	Y26 E314 H341 E346	Y26-K344 CarbonylContact O-C 3.52Å; Y26-K344 WeakPolarHBondContact O-CA 3.36Å; E314-K344 WeakPolarHBondContact OE2-CE 3.33Å; E314-K344 IonicContact OE2-NZ 3.47Å; E314-K344 PolarHBondContact OE2-NZ 3.49Å; H341-K344 HydrophobicContact CB-CD 4.46Å; H341-K344 HydrophobicContact CB-CG 3.57Å; H341-K344 WeakPolarHBondContact CD2-CE 3.11Å; H341-K344 VanDerWaalsContact CE1-CE 3.49Å; H341-K344 WeakPolarHBondContact CE1-CE 3.31Å; H341-K344 PolarHBondContact N-O 2.8Å; H341-K344 WeakPolarHBondContact NE2-CE 3.33Å; K344-E346 IonicContact NZ-OE1 3.41Å; K344-E346 PolarHBondContact NZ-OE1 3.34Å
345	C	97.4	Very high	95.7	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123	162.1	-179.3	0	0	0	0	108.1	Y26 I29 L48 K339 L340	Y26-C345 HydrophobicContact CD2-CB 4.02Å; Y26-C345 HydrophobicContact CG-CB 4.49Å; Y26-C345 PolarHBondContact N-O 3.01Å; Y26-C345 PolarHBondContact O-N 3.04Å; I29-C345 HydrophobicContact CD1-CB 4.24Å; L48-C345 HydrophobicContact CD2-CB 4.2Å; K339-C345 CarbonylContact O-C 3.58Å; K339-C345 WeakPolarHBondContact O-CA 2.85Å; L340-C345 HydrophobicContact CD2-CB 3.72Å
346	E	97.3	Very high	95	Very high	20 Å²	20	38.5 Å²	38.5	9%	0.093	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	109.1	-174.4	179.6	177.7	-103.3	0	0	109.5	P19 K339 H341 K344	P19-E346 HydrophobicContact CB-CG 4.4Å; K339-E346 WeakPolarHBondContact CB-O 3.28Å; K339-E346 PolarHBondContact N-O 3.26Å; K339-E346 PolarHBondContact O-N 3.44Å; H341-E346 IonicContact CE1-OE2 3.22Å; H341-E346 PolarHBondContact CE1-OE2 3.21Å; H341-E346 IonicContact NE2-OE2 3.16Å; H341-E346 PolarHBondContact NE2-OE2 3.36Å; K344-E346 IonicContact NZ-OE1 3.41Å; K344-E346 PolarHBondContact NZ-OE1 3.34Å
347	P	97.8	Very high	94.1	Very high	6 Å²	6	41.7 Å²	41.7	4%	0.039	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	135.8	172.1	-22.6	32.1	0	0	0	112.5	V20 Y26 F337 Y338	V20-P347 HydrophobicContact CB-CB 4.44Å; V20-P347 HydrophobicContact CG1-CB 3.86Å; V20-P347 HydrophobicContact CG2-CB 3.73Å; V20-P347 HydrophobicContact CG2-CG 3.82Å; V20-P347 WeakPolarHBondContact CG2-O 3.19Å; V20-P347 PolarHBondContact N-O 2.66Å; Y26-P347 HydrophobicContact CE2-CG 4.08Å; F337-P347 CarbonylContact O-C 3.43Å; F337-P347 VanDerWaalsContact O-CA 3.25Å; F337-P347 WeakPolarHBondContact O-CA 3.39Å; Y338-P347 HydrophobicContact CD1-CG 4.1Å; Y338-P347 HydrophobicContact CE1-CB 4.43Å; Y338-P347 HydrophobicContact CE1-CG 3.91Å
348	I	97.9	Very high	93.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	117.4	176.3	-57.4	162.1	0	0	0	107.7	I292 F310 R336 F337 K339 M350	I292-I348 HydrophobicContact CD1-CD1 3.96Å; F310-I348 HydrophobicContact CD1-CD1 4.19Å; F310-I348 HydrophobicContact CD1-CG2 4.33Å; F310-I348 HydrophobicContact CD2-CG2 4.37Å; F310-I348 HydrophobicContact CE1-CD1 3.54Å; F310-I348 HydrophobicContact CE1-CG1 4.21Å; F310-I348 HydrophobicContact CE1-CG2 4.13Å; F310-I348 HydrophobicContact CE2-CG2 4.17Å; F310-I348 HydrophobicContact CG-CG2 4.45Å; F310-I348 HydrophobicContact CZ-CD1 4.1Å; F310-I348 HydrophobicContact CZ-CG1 4.29Å; F310-I348 HydrophobicContact CZ-CG2 4.03Å; R336-I348 WeakPolarHBondContact CA-O 3.33Å; F337-I348 HydrophobicContact CB-CB 4.3Å; F337-I348 PolarHBondContact N-O 2.85Å; F337-I348 PolarHBondContact O-N 3.06Å; K339-I348 HydrophobicContact CB-CD1 3.71Å; K339-I348 HydrophobicContact CB-CG1 4.48Å; K339-I348 HydrophobicContact CD-CD1 3.81Å; K339-I348 HydrophobicContact CG-CD1 4.39Å; I348-M350 HydrophobicContact CG2-SD 4.18Å
349	V	97.8	Very high	93.2	Very high	26 Å²	26	48.8 Å²	48.8	16%	0.158	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	122	-177.1	177.6	0	0	0	0	109	G17 Q18 V20 E333 R336 T351	G17-V349 CarbonylContact C-O 3.58Å; G17-V349 WeakPolarHBondContact CA-O 3.37Å; Q18-V349 PolarHBondContact N-O 3.21Å; Q18-V349 PolarHBondContact O-N 3.32Å; V20-V349 HydrophobicContact CG1-CG2 3.92Å; E333-V349 HydrophobicContact CB-CG1 4.19Å; E333-V349 HydrophobicContact CG-CG1 3.76Å; E333-V349 WeakPolarHBondContact OE1-CG1 3.28Å; R336-V349 HydrophobicContact CG-CG2 4.41Å; V349-T351 WeakPolarHBondContact CG1-OG1 3.34Å
350	M	97.8	Very high	92.8	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	113	174.2	-54.6	-56.2	-69.5	0	0	109.2	V15 G17 Y283 Y294 E333 I334 A335 F337 I348	V15-M350 HydrophobicContact CG1-CB 4.4Å; V15-M350 HydrophobicContact CG1-CE 4.03Å; G17-M350 WeakPolarHBondContact CA-SD 3.44Å; Y283-M350 HydrophobicContact CD1-CE 4.4Å; Y283-M350 HydrophobicContact CE1-CB 4.49Å; Y283-M350 HydrophobicContact CE1-CE 3.83Å; Y283-M350 HydrophobicContact CE1-CG 4.01Å; Y294-M350 HydrophobicContact CD1-CE 3.75Å; Y294-M350 HydrophobicContact CE1-CE 3.32Å; Y294-M350 HydrophobicContact CE2-CE 4.33Å; Y294-M350 HydrophobicContact CG-CE 4.43Å; E333-M350 WeakPolarHBondContact CA-O 3.38Å; I334-M350 HydrophobicContact CG1-CB 4.3Å; I334-M350 WeakPolarHBondContact CG1-O 3.45Å; I334-M350 PolarHBondContact N-O 2.63Å; A335-M350 HydrophobicContact CB-CB 4.05Å; A335-M350 HydrophobicContact CB-CG 4.1Å; A335-M350 WeakPolarHBondContact O-CA 3.36Å; A335-M350 VanDerWaalsContact O-CB 3.29Å; A335-M350 WeakPolarHBondContact O-CB 3.33Å; A335-M350 PolarHBondContact O-N 3.36Å; F337-M350 HydrophobicContact CD2-CG 3.82Å; F337-M350 HydrophobicContact CD2-SD 4.35Å; F337-M350 HydrophobicContact CE2-CG 3.87Å; I348-M350 HydrophobicContact CG2-SD 4.18Å
351	T	96.5	Very high	92.5	Very high	20 Å²	20	53.4 Å²	53.4	12%	0.123	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.7	-171.2	-54.8	0	0	0	0	111.7	V15 F16 K331 V349	V15-T351 WeakPolarHBondContact CA-O 3.29Å; F16-T351 HydrophobicContact CE1-CG2 4.37Å; F16-T351 HydrophobicContact CZ-CG2 4.3Å; F16-T351 PolarHBondContact N-O 3.4Å; F16-T351 PolarHBondContact O-N 3.04Å; K331-T351 WeakPolarHBondContact O-CG2 3.43Å; V349-T351 WeakPolarHBondContact CG1-OG1 3.34Å
352	V	96	Very high	92.2	Very high	2 Å²	2	56 Å²	56	1%	0.012	27%	0.273	C	S	.	.			trans	-90.1	116.7	164.3	-178.2	0	0	0	0	108.1	F12 V15 C332 I334 R354 L363	F12-V352 HydrophobicContact CD1-CG2 3.91Å; F12-V352 HydrophobicContact CE1-CG2 4.22Å; V15-V352 HydrophobicContact CG2-CG2 3.69Å; C332-V352 WeakPolarHBondContact CB-O 3.38Å; C332-V352 PolarHBondContact O-N 3.22Å; I334-V352 HydrophobicContact CB-CG2 4.5Å; I334-V352 HydrophobicContact CD1-CG2 3.83Å; I334-V352 HydrophobicContact CG1-CG2 4.15Å; I334-V352 HydrophobicContact CG2-CG2 3.58Å; V352-R354 HydrophobicContact CG1-CG 4.2Å; V352-R354 PolarHBondContact O-N 3.3Å; V352-L363 HydrophobicContact CB-CD1 3.95Å; V352-L363 HydrophobicContact CG1-CD1 4.1Å; V352-L363 HydrophobicContact CG1-CD2 4.25Å; V352-L363 HydrophobicContact CG2-CD1 4.29Å; V352-L363 HydrophobicContact CG2-CD2 4.21Å
353	P	93.4	Very high	92.2	Very high	69 Å²	69	52.1 Å²	52.1	45%	0.448	26%	0.255	S	S	.	.			trans	-71.2	93.3	-177.6	26.3	-31.9	0	0	0	111.3	H14 F16	H14-P353 HydrophobicContact CB-CG 3.78Å; H14-P353 WeakPolarHBondContact O-CD 2.98Å; H14-P353 WeakPolarHBondContact O-CG 3.18Å; F16-P353 HydrophobicContact CD1-CG 4.42Å; F16-P353 HydrophobicContact CE1-CB 4.04Å; F16-P353 HydrophobicContact CE1-CG 4.26Å
354	R	89.4	Confident	92.2	Very high	91 Å²	91	45.6 Å²	45.6	34%	0.343	23%	0.23	S	C	.	.			trans	-109.3	144.3	168.3	-65.1	-66.2	-177	95.1	-2.7	110.1	V352 Q360 D362 L363	V352-R354 HydrophobicContact CG1-CG 4.2Å; V352-R354 PolarHBondContact O-N 3.3Å; R354-Q360 HydrophobicContact CG-CG 4.49Å; R354-D362 IonicContact CZ-OD2 3.11Å; R354-D362 IonicContact NH1-OD1 3.39Å; R354-D362 PolarHBondContact NH1-OD1 2.84Å; R354-D362 IonicContact NH1-OD2 3.41Å; R354-D362 PolarHBondContact NH1-OD2 3Å; R354-D362 IonicContact NH2-OD2 3.46Å; R354-D362 PolarHBondContact NH2-OD2 3.14Å; R354-L363 HydrophobicContact CG-CD1 4.25Å
355	K	82.7	Confident	92.1	Very high	219 Å²	219	46 Å²	46	95%	0.952	24%	0.237	S	C	*	.			trans	-105.4	66.4	173.6	-65.1	-177.2	-179.1	179.2	0	108.8
356	S	83.1	Confident	92	Very high	40 Å²	40	50 Å²	50	28%	0.28	26%	0.259	S	S	.	.			trans	-144	134.6	-177.7	178.6	0	0	0	0	109.8	L358 Q360	S356-L358 VanDerWaalsContact C-N 3.28Å; S356-L358 WeakPolarHBondContact OG-CB 3.36Å; S356-L358 PolarHBondContact OG-N 2.87Å; S356-L358 VanDerWaalsContact OG-N 3.08Å; S356-Q360 PolarHBondContact OG-NE2 3.47Å; S356-Q360 VanDerWaalsContact OG-NE2 3.07Å
357	D	79.9	Confident	91.9	Very high	97 Å²	97	49.4 Å²	49.4	52%	0.519	26%	0.256	S	S	.	.	S	Bend	trans	-92.5	9.3	170.6	-58.9	-49.5	0	0	0	111.5	Y396	D357-Y396 PolarHBondContact O-OH 3.34Å
358	L	88.1	Confident	91.6	Very high	132 Å²	132	51.4 Å²	51.4	69%	0.691	27%	0.273	S	S	*	.	S	Bend	trans	-95.9	147.7	173.3	-59.2	175	0	0	0	110	S356 Q360	S356-L358 VanDerWaalsContact C-N 3.28Å; S356-L358 WeakPolarHBondContact OG-CB 3.36Å; S356-L358 PolarHBondContact OG-N 2.87Å; S356-L358 VanDerWaalsContact OG-N 3.08Å; L358-Q360 PolarHBondContact O-N 3.43Å; L358-Q360 PolarHBondContact O-NE2 3.11Å
359	F	89.1	Confident	91.3	Very high	27 Å²	27	51.8 Å²	51.8	12%	0.118	28%	0.277	C	S	.	.			trans	-55.1	133.1	169.5	-175	-90.9	0	0	0	110.6	V329 D361 Y364 L392 R393 Y396	V329-F359 HydrophobicContact CG1-CD2 3.69Å; V329-F359 HydrophobicContact CG1-CE2 3.3Å; V329-F359 HydrophobicContact CG1-CZ 4.22Å; F359-D361 WeakPolarHBondContact CD1-OD1 3.41Å; F359-D361 WeakPolarHBondContact CE1-OD1 3.38Å; F359-D361 PolarHBondContact O-N 3.36Å; F359-Y364 HydrophobicContact CE2-CD2 4.49Å; F359-Y364 HydrophobicContact CZ-CD2 4.35Å; F359-Y364 HydrophobicContact CZ-CG 4.34Å; F359-L392 HydrophobicContact CE2-CB 4.46Å; F359-L392 HydrophobicContact CZ-CB 4.41Å; F359-R393 HydrophobicContact CD1-CG 3.59Å; F359-R393 HydrophobicContact CD2-CG 4.09Å; F359-R393 HydrophobicContact CE1-CG 3.36Å; F359-R393 HydrophobicContact CE2-CB 4.29Å; F359-R393 HydrophobicContact CE2-CG 3.88Å; F359-R393 HydrophobicContact CG-CG 3.94Å; F359-R393 HydrophobicContact CZ-CB 4.3Å; F359-R393 HydrophobicContact CZ-CG 3.51Å; F359-Y396 HydrophobicContact CB-CD2 4.34Å; F359-Y396 HydrophobicContact CB-CE2 4.43Å; F359-Y396 HydrophobicContact CB-CG 4.41Å; F359-Y396 AromaticContact CD2-CD2 3.67Å; F359-Y396 HydrophobicContact CD2-CD2 3.67Å; F359-Y396 HydrophobicContact CD2-CE2 4.43Å; F359-Y396 AromaticContact CD2-CG 3.84Å; F359-Y396 HydrophobicContact CD2-CG 3.84Å; F359-Y396 HydrophobicContact CG-CD2 4.5Å
360	Q	90.1	Very high	91.1	Very high	22 Å²	22	52.9 Å²	52.9	10%	0.103	29%	0.285	C	S	.	.			trans	-98.5	87.1	-175.6	-60.8	-61.2	-78.2	0	0	110	R354 S356 L358 D362 L363 Y364	R354-Q360 HydrophobicContact CG-CG 4.49Å; S356-Q360 PolarHBondContact OG-NE2 3.47Å; S356-Q360 VanDerWaalsContact OG-NE2 3.07Å; L358-Q360 PolarHBondContact O-N 3.43Å; L358-Q360 PolarHBondContact O-NE2 3.11Å; Q360-D362 PolarHBondContact O-N 3.37Å; Q360-L363 HydrophobicContact CB-CB 4.11Å; Q360-L363 HydrophobicContact CB-CD1 3.86Å; Q360-L363 HydrophobicContact CB-CG 3.94Å; Q360-L363 HydrophobicContact CG-CD1 4.18Å; Q360-L363 PolarHBondContact O-N 3.05Å; Q360-Y364 HydrophobicContact CB-CD2 4.42Å; Q360-Y364 HydrophobicContact CB-CE2 4.46Å; Q360-Y364 VanDerWaalsContact O-CD2 3.32Å; Q360-Y364 WeakPolarHBondContact O-CD2 3.26Å; Q360-Y364 PolarHBondContact O-N 3.05Å
361	D	89.6	Confident	90.8	Very high	76 Å²	76	59.2 Å²	59.2	41%	0.406	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-31.4	-179	-69.7	-42.8	0	0	0	113.7	F359 L363 Y364 R393	F359-D361 WeakPolarHBondContact CD1-OD1 3.41Å; F359-D361 WeakPolarHBondContact CE1-OD1 3.38Å; F359-D361 PolarHBondContact O-N 3.36Å; D361-L363 VanDerWaalsContact C-N 3.26Å; D361-L363 PolarHBondContact O-N 3.35Å; D361-Y364 CarbonylContact O-C 3.45Å; D361-R393 IonicContact OD1-CZ 3.27Å; D361-R393 IonicContact OD1-NE 2.74Å; D361-R393 PolarHBondContact OD1-NE 2.8Å; D361-R393 VanDerWaalsContact OD1-NE 3.11Å; D361-R393 IonicContact OD1-NH1 3.26Å; D361-R393 PolarHBondContact OD1-NH1 2.94Å; D361-R393 IonicContact OD1-NH2 2.71Å; D361-R393 PolarHBondContact OD1-NH2 3.33Å; D361-R393 IonicContact OD2-CZ 2.75Å; D361-R393 VanDerWaalsContact OD2-CZ 3.26Å; D361-R393 IonicContact OD2-NH1 3.23Å; D361-R393 PolarHBondContact OD2-NH1 3.11Å; D361-R393 IonicContact OD2-NH2 2.73Å; D361-R393 PolarHBondContact OD2-NH2 2.88Å
362	D	91.1	Very high	90.7	Very high	64 Å²	64	59.2 Å²	59.2	34%	0.342	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-20.5	179	68.6	-57.5	0	0	0	113.4	K11 R354 Q360	K11-D362 PolarHBondContact NZ-O 2.8Å; R354-D362 IonicContact CZ-OD2 3.11Å; R354-D362 IonicContact NH1-OD1 3.39Å; R354-D362 PolarHBondContact NH1-OD1 2.84Å; R354-D362 IonicContact NH1-OD2 3.41Å; R354-D362 PolarHBondContact NH1-OD2 3Å; R354-D362 IonicContact NH2-OD2 3.46Å; R354-D362 PolarHBondContact NH2-OD2 3.14Å; Q360-D362 PolarHBondContact O-N 3.37Å
363	L	91.4	Very high	90.7	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-25.6	178	-61	-175.9	0	0	0	112.4	K11 F12 C332 V352 R354 Q360 D361	K11-L363 HydrophobicContact CD-CD2 4.28Å; F12-L363 HydrophobicContact CE1-CD2 3.84Å; F12-L363 HydrophobicContact CZ-CD2 4.48Å; C332-L363 HydrophobicContact CB-CD1 4.28Å; V352-L363 HydrophobicContact CB-CD1 3.95Å; V352-L363 HydrophobicContact CG1-CD1 4.1Å; V352-L363 HydrophobicContact CG1-CD2 4.25Å; V352-L363 HydrophobicContact CG2-CD1 4.29Å; V352-L363 HydrophobicContact CG2-CD2 4.21Å; R354-L363 HydrophobicContact CG-CD1 4.25Å; Q360-L363 HydrophobicContact CB-CB 4.11Å; Q360-L363 HydrophobicContact CB-CD1 3.86Å; Q360-L363 HydrophobicContact CB-CG 3.94Å; Q360-L363 HydrophobicContact CG-CD1 4.18Å; Q360-L363 PolarHBondContact O-N 3.05Å; D361-L363 VanDerWaalsContact C-N 3.26Å; D361-L363 PolarHBondContact O-N 3.35Å
364	Y	94.1	Very high	90.8	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.016	31%	0.305	C	S	.	.			trans	-128.9	73.2	-173	-55.1	-72.9	0	0	0	110.2	V329 C332 E333 F359 Q360 D361 L392	V329-Y364 HydrophobicContact CB-CE1 4.5Å; V329-Y364 HydrophobicContact CB-CE2 4.35Å; V329-Y364 HydrophobicContact CG1-CD1 4.26Å; V329-Y364 HydrophobicContact CG1-CD2 3.46Å; V329-Y364 VanDerWaalsContact CG1-CD2 3.46Å; V329-Y364 HydrophobicContact CG1-CE1 4.23Å; V329-Y364 HydrophobicContact CG1-CE2 3.45Å; V329-Y364 VanDerWaalsContact CG1-CE2 3.45Å; V329-Y364 HydrophobicContact CG1-CG 3.89Å; V329-Y364 HydrophobicContact CG2-CD1 4.25Å; V329-Y364 HydrophobicContact CG2-CE1 4.11Å; C332-Y364 WeakPolarHBondContact CA-OH 3.38Å; E333-Y364 PolarHBondContact N-OH 2.8Å; E333-Y364 WeakPolarHBondContact O-CE1 3.47Å; E333-Y364 PolarHBondContact O-OH 2.97Å; F359-Y364 HydrophobicContact CE2-CD2 4.49Å; F359-Y364 HydrophobicContact CZ-CD2 4.35Å; F359-Y364 HydrophobicContact CZ-CG 4.34Å; Q360-Y364 HydrophobicContact CB-CD2 4.42Å; Q360-Y364 HydrophobicContact CB-CE2 4.46Å; Q360-Y364 VanDerWaalsContact O-CD2 3.32Å; Q360-Y364 WeakPolarHBondContact O-CD2 3.26Å; Q360-Y364 PolarHBondContact O-N 3.05Å; D361-Y364 CarbonylContact O-C 3.45Å; Y364-L392 HydrophobicContact CD1-CD1 4.03Å
365	P	94.9	Very high	91.1	Very high	51 Å²	51	56.7 Å²	56.7	33%	0.331	31%	0.307	S	S	.	.			trans	-62.5	168.6	165.6	32	-36	0	0	0	110.2	D278 T367	D278-P365 HydrophobicContact CB-CG 3.7Å; P365-T367 PolarHBondContact O-N 2.93Å
366	D	94.6	Very high	91.7	Very high	85 Å²	85	46.4 Å²	46.4	46%	0.455	26%	0.262	S	S	.	.			trans	-61.8	129.7	176.1	-61	-27	0	0	0	109.8	L389 I390 S391	D366-L389 HydrophobicContact CB-CB 3.9Å; D366-L389 HydrophobicContact CB-CD1 4.35Å; D366-I390 WeakPolarHBondContact CA-O 3.18Å; D366-S391 WeakPolarHBondContact OD1-CA 3.5Å; D366-S391 VanDerWaalsContact OD1-CB 3.27Å; D366-S391 WeakPolarHBondContact OD1-CB 3.43Å; D366-S391 PolarHBondContact OD1-OG 3.36Å; D366-S391 VanDerWaalsContact OD1-OG 3.09Å
367	T	94.2	Very high	92.3	Very high	7 Å²	7	49.9 Å²	49.9	4%	0.043	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	163.7	-167.9	-163.8	0	0	0	0	110.6	D278 K324 P365 G369 L389 I390 L392	D278-T367 VanDerWaalsContact OD2-CB 3.24Å; D278-T367 WeakPolarHBondContact OD2-CB 3.34Å; D278-T367 PolarHBondContact OD2-OG1 2.76Å; K324-T367 HydrophobicContact CB-CG2 3.93Å; P365-T367 PolarHBondContact O-N 2.93Å; T367-G369 PolarHBondContact O-N 2.78Å; T367-L389 CarbonylContact O-C 3.59Å; T367-L389 VanDerWaalsContact O-CA 3.25Å; T367-L389 WeakPolarHBondContact O-CA 3.12Å; T367-I390 HydrophobicContact CG2-CG1 4.24Å; T367-I390 PolarHBondContact N-O 3.2Å; T367-I390 PolarHBondContact O-N 3.39Å; T367-L392 HydrophobicContact CG2-CD1 4.14Å; T367-L392 HydrophobicContact CG2-CD2 3.92Å; T367-L392 HydrophobicContact CG2-CG 3.91Å
368	A	93.1	Very high	93.1	Very high	47 Å²	47	48.4 Å²	48.4	39%	0.388	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	123.6	179.5	0	0	0	0	0	111.6	P387	A368-P387 HydrophobicContact CB-CB 3.77Å; A368-P387 HydrophobicContact CB-CG 4.39Å
369	G	91.3	Very high	93.6	Very high	9 Å²	9	42.1 Å²	42.1	9%	0.093	23%	0.231	C	C	.	.			trans	-82	178.5	178.6	0	0	0	0	0	113.8	T367 E371 I388	T367-G369 PolarHBondContact O-N 2.78Å; G369-E371 VanDerWaalsContact C-N 3.28Å; G369-I388 PolarHBondContact N-O 2.76Å
370	P	92.6	Very high	93.9	Very high	48 Å²	48	43.4 Å²	43.4	31%	0.312	24%	0.241	S	C	.	.	S	Bend	trans	-82.4	-2.2	175.3	36	-35.1	0	0	0	113	H93	H93-P370 CarbonylContact C-O 3.54Å; H93-P370 WeakPolarHBondContact CA-O 3.39Å; H93-P370 VanDerWaalsContact CB-O 3.3Å; H93-P370 WeakPolarHBondContact CB-O 3.49Å
371	E	92.8	Very high	94.2	Very high	134 Å²	134	46.5 Å²	46.5	63%	0.626	27%	0.265	S	S	*	.	S	Bend	trans	-89.3	130.7	178.2	-65.4	-172.8	170.5	0	0	110.1	G369 I388	G369-E371 VanDerWaalsContact C-N 3.28Å; E371-I388 HydrophobicContact CB-CD1 3.93Å
372	A	93	Very high	94.5	Very high	19 Å²	19	45 Å²	45	16%	0.157	27%	0.267	C	S	.	.			trans	-70.4	137.2	172.6	0	0	0	0	0	109.6	T143 R145 I388	T143-A372 CarbonylContact O-C 3.43Å; R145-A372 HydrophobicContact CB-CB 3.79Å; R145-A372 HydrophobicContact CG-CB 4.37Å; A372-I388 WeakPolarHBondContact O-CD1 3.34Å
373	A	95.4	Very high	94.7	Very high	26 Å²	26	47.9 Å²	47.9	22%	0.215	27%	0.273	C	S	.	.	S	Bend	trans	-77.6	-26.6	177.5	0	0	0	0	0	112.7	T143 A385 D386 I388	T143-A373 PolarHBondContact O-N 2.84Å; A373-A385 HydrophobicContact CB-CB 3.87Å; A373-D386 WeakPolarHBondContact CB-O 3.46Å; A373-I388 HydrophobicContact CB-CG1 4.03Å
374	L	96.6	Very high	95	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.016	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-134.6	151.6	-177.3	-63.4	172.6	0	0	0	110.5	T143 A144 R145 E378 W379 R383 A385	T143-L374 PolarHBondContact O-N 2.95Å; A144-L374 CarbonylContact C-O 3.51Å; A144-L374 WeakPolarHBondContact CA-O 3Å; A144-L374 HydrophobicContact CB-CB 4.45Å; R145-L374 PolarHBondContact N-O 3.39Å; L374-E378 HydrophobicContact CB-CB 4.46Å; L374-E378 HydrophobicContact CD2-CB 4.26Å; L374-W379 HydrophobicContact CD1-CB 4.35Å; L374-R383 HydrophobicContact CD1-CB 4.39Å; L374-R383 WeakPolarHBondContact CD1-O 3.4Å; L374-R383 HydrophobicContact CD2-CB 4.34Å; L374-A385 HydrophobicContact CD1-CB 3.86Å; L374-A385 HydrophobicContact CD2-CB 3.96Å; L374-A385 HydrophobicContact CG-CB 3.74Å
375	E	96.3	Very high	95.1	Very high	81 Å²	81	52.8 Å²	52.8	38%	0.379	30%	0.304	S	S	.	.			trans	-80.1	160.9	161.3	-63.2	-59.7	152.2	0	0	110.6	R145 E377 E378 W379	R145-E375 WeakPolarHBondContact CB-OE2 3.39Å; R145-E375 WeakPolarHBondContact CD-OE2 3.45Å; E375-E377 VanDerWaalsContact C-N 3.27Å; E375-E377 PolarHBondContact O-N 2.92Å; E375-E378 HydrophobicContact CB-CG 4.32Å; E375-E378 PolarHBondContact N-OE2 2.7Å; E375-E378 PolarHBondContact O-N 2.82Å; E375-W379 PolarHBondContact O-N 3.45Å; E375-W379 VanDerWaalsContact O-N 3.14Å
376	A	94.8	Very high	95.1	Very high	2 Å²	2	55.4 Å²	55.4	2%	0.017	32%	0.315	C	S	.	.	H	α-helix	trans	-57.5	-42.2	-177.4	0	0	0	0	0	111.8	V147 N161 E378 W379 V380	V147-A376 HydrophobicContact CG2-CB 3.79Å; N161-A376 WeakPolarHBondContact ND2-CB 3.43Å; A376-E378 VanDerWaalsContact C-N 3.35Å; A376-E378 PolarHBondContact O-N 3.42Å; A376-W379 PolarHBondContact O-N 2.88Å; A376-V380 WeakPolarHBondContact O-CB 3.44Å; A376-V380 VanDerWaalsContact O-CG2 3.23Å; A376-V380 WeakPolarHBondContact O-CG2 3.35Å; A376-V380 PolarHBondContact O-N 2.99Å
377	E	95.8	Very high	95.1	Very high	113 Å²	113	52.1 Å²	52.1	53%	0.528	30%	0.298	S	S	.	.	H	α-helix	trans	-67.1	-36.6	-177.7	-60.1	71.3	-154.9	0	0	111.5	N161 E375 V380 S381	N161-E377 PolarHBondContact ND2-OE1 3.4Å; E375-E377 VanDerWaalsContact C-N 3.27Å; E375-E377 PolarHBondContact O-N 2.92Å; E377-V380 PolarHBondContact O-N 2.84Å; E377-S381 WeakPolarHBondContact O-CB 3.4Å; E377-S381 PolarHBondContact O-N 3.07Å
378	E	96.9	Very high	95.1	Very high	67 Å²	67	54.9 Å²	54.9	31%	0.313	31%	0.312	S	S	.	.	H	α-helix	trans	-67.3	-42.5	176.5	-62.6	-174.5	133.7	0	0	111	L374 E375 A376 S381 R383	L374-E378 HydrophobicContact CB-CB 4.46Å; L374-E378 HydrophobicContact CD2-CB 4.26Å; E375-E378 HydrophobicContact CB-CG 4.32Å; E375-E378 PolarHBondContact N-OE2 2.7Å; E375-E378 PolarHBondContact O-N 2.82Å; A376-E378 VanDerWaalsContact C-N 3.35Å; A376-E378 PolarHBondContact O-N 3.42Å; E378-S381 PolarHBondContact O-N 2.72Å; E378-S381 PolarHBondContact O-OG 2.94Å; E378-R383 WeakPolarHBondContact O-CB 3.43Å; E378-R383 PolarHBondContact O-N 3.28Å; E378-R383 IonicContact OE1-CZ 3.14Å; E378-R383 IonicContact OE1-NH1 3.24Å; E378-R383 PolarHBondContact OE1-NH1 3.42Å; E378-R383 IonicContact OE2-NH1 2.8Å
379	W	97.4	Very high	95.2	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-65	-43	176.1	176.5	77.7	0	0	0	112	H141 A144 V147 I159 L168 Y169 W184 G188 P205 R206 L374 E375 A376 S381 G382	H141-W379 AromaticContact CD2-CE2 3.98Å; H141-W379 AromaticContact CE1-CD1 3.73Å; H141-W379 AromaticContact CE1-NE1 3.6Å; H141-W379 AromaticContact NE2-CD1 3.65Å; H141-W379 AromaticContact NE2-CE2 3.36Å; H141-W379 AromaticContact NE2-CZ2 3.78Å; H141-W379 AromaticContact NE2-NE1 3.05Å; H141-W379 PolarHBondContact NE2-NE1 2.79Å; A144-W379 HydrophobicContact CB-CB 3.87Å; A144-W379 HydrophobicContact CB-CG 4.06Å; V147-W379 HydrophobicContact CG1-CE3 4.22Å; V147-W379 HydrophobicContact CG1-CH2 4.38Å; V147-W379 HydrophobicContact CG1-CZ3 3.94Å; V147-W379 HydrophobicContact CG2-CE3 4.15Å; I159-W379 HydrophobicContact CD1-CH2 4.14Å; I159-W379 HydrophobicContact CG2-CH2 4Å; I159-W379 HydrophobicContact CG2-CZ3 3.98Å; L168-W379 HydrophobicContact CD1-CZ3 4.29Å; Y169-W379 HydrophobicContact CD2-CH2 4.1Å; Y169-W379 HydrophobicContact CD2-CZ3 4.01Å; Y169-W379 HydrophobicContact CE2-CE3 4.46Å; Y169-W379 AromaticContact CE2-CH2 3.91Å; Y169-W379 HydrophobicContact CE2-CH2 3.91Å; Y169-W379 AromaticContact CE2-CZ3 3.59Å; Y169-W379 HydrophobicContact CE2-CZ3 3.59Å; W184-W379 HydrophobicContact CH2-CH2 4.24Å; W184-W379 AromaticContact CH2-CZ2 3.96Å; W184-W379 HydrophobicContact CH2-CZ2 3.96Å; W184-W379 HydrophobicContact CZ3-CZ2 4.24Å; G188-W379 PolarHBondContact O-NE1 2.84Å; P205-W379 HydrophobicContact CG-CH2 4.22Å; P205-W379 HydrophobicContact CG-CZ2 3.89Å; R206-W379 WeakPolarHBondContact CD-O 3.34Å; R206-W379 HydrophobicContact CG-CH2 3.93Å; R206-W379 HydrophobicContact CG-CZ2 3.81Å; R206-W379 HydrophobicContact CG-CZ3 4.4Å; R206-W379 PolarHBondContact NH1-O 3.25Å; L374-W379 HydrophobicContact CD1-CB 4.35Å; E375-W379 PolarHBondContact O-N 3.45Å; E375-W379 VanDerWaalsContact O-N 3.14Å; A376-W379 PolarHBondContact O-N 2.88Å; W379-S381 VanDerWaalsContact C-N 3.25Å; W379-S381 PolarHBondContact O-N 2.92Å; W379-G382 PolarHBondContact O-N 2.72Å
380	V	96.3	Very high	95.3	Very high	53 Å²	53	59 Å²	59	32%	0.321	32%	0.324	S	S	.	.	H	α-helix	trans	-60.4	-34.7	174.4	169.2	0	0	0	0	111.6	L168 Y169 A376 E377 G382	L168-V380 HydrophobicContact CD1-CG2 3.81Å; L168-V380 HydrophobicContact CD2-CG2 3.93Å; L168-V380 HydrophobicContact CG-CG2 4.33Å; Y169-V380 HydrophobicContact CE2-CG2 4.2Å; Y169-V380 PolarHBondContact OH-O 3.21Å; A376-V380 WeakPolarHBondContact O-CB 3.44Å; A376-V380 VanDerWaalsContact O-CG2 3.23Å; A376-V380 WeakPolarHBondContact O-CG2 3.35Å; A376-V380 PolarHBondContact O-N 2.99Å; E377-V380 PolarHBondContact O-N 2.84Å; V380-G382 PolarHBondContact O-N 2.81Å; V380-G382 VanDerWaalsContact O-N 3.14Å
381	S	96.3	Very high	95.3	Very high	88 Å²	88	58.7 Å²	58.7	62%	0.615	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-6.1	174.7	80.1	0	0	0	0	114.2	E377 E378 W379	E377-S381 WeakPolarHBondContact O-CB 3.4Å; E377-S381 PolarHBondContact O-N 3.07Å; E378-S381 PolarHBondContact O-N 2.72Å; E378-S381 PolarHBondContact O-OG 2.94Å; W379-S381 VanDerWaalsContact C-N 3.25Å; W379-S381 PolarHBondContact O-N 2.92Å
382	G	95	Very high	95.2	Very high	43 Å²	43	52.6 Å²	52.6	44%	0.443	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.5	11.7	177.5	0	0	0	0	0	114.5	R206 W379 V380	R206-G382 VanDerWaalsContact NH1-C 3.34Å; W379-G382 PolarHBondContact O-N 2.72Å; V380-G382 PolarHBondContact O-N 2.81Å; V380-G382 VanDerWaalsContact O-N 3.14Å
383	R	96.9	Very high	94.8	Very high	126 Å²	126	58 Å²	58	48%	0.475	31%	0.311	S	S	.	.			trans	-78	139.5	174.1	-70.3	179	58	-160.3	-11.8	110.8	R206 L374 E378	R206-R383 PolarHBondContact NH1-O 2.92Å; R206-R383 VanDerWaalsContact NH1-O 3.15Å; L374-R383 HydrophobicContact CD1-CB 4.39Å; L374-R383 WeakPolarHBondContact CD1-O 3.4Å; L374-R383 HydrophobicContact CD2-CB 4.34Å; E378-R383 WeakPolarHBondContact O-CB 3.43Å; E378-R383 PolarHBondContact O-N 3.28Å; E378-R383 IonicContact OE1-CZ 3.14Å; E378-R383 IonicContact OE1-NH1 3.24Å; E378-R383 PolarHBondContact OE1-NH1 3.42Å; E378-R383 IonicContact OE2-NH1 2.8Å
384	D	96.4	Very high	93.8	Very high	80 Å²	80	65.6 Å²	65.6	43%	0.428	34%	0.342	S	S	.	.			trans	-117.2	137.9	172.5	-65.2	-28.7	0	0	0	109.1	S189 R206	S189-D384 WeakPolarHBondContact CB-OD1 3.11Å; R206-D384 IonicContact CZ-OD1 3.57Å; R206-D384 IonicContact NH1-OD1 2.79Å; R206-D384 PolarHBondContact NH1-OD1 2.85Å; R206-D384 IonicContact NH2-OD1 2.74Å; R206-D384 PolarHBondContact NH2-OD1 3.37Å; R206-D384 IonicContact NH2-OD2 3.96Å; R206-D384 PolarHBondContact NH2-OD2 2.93Å
385	A	95.8	Very high	92.3	Very high	27 Å²	27	68.7 Å²	68.7	22%	0.223	37%	0.368	C	S	.	.			trans	-144.7	142.5	174.7	0	0	0	0	0	109.8	T143 N187 A373 L374	T143-A385 WeakPolarHBondContact CG2-O 3.26Å; N187-A385 WeakPolarHBondContact CB-O 3.31Å; A373-A385 HydrophobicContact CB-CB 3.87Å; L374-A385 HydrophobicContact CD1-CB 3.86Å; L374-A385 HydrophobicContact CD2-CB 3.96Å; L374-A385 HydrophobicContact CG-CB 3.74Å
386	D	95.1	Very high	90.7	Very high	105 Å²	105	66.6 Å²	66.6	56%	0.561	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-70.7	155.6	171.4	-72.3	-37.8	0	0	0	111	A373	A373-D386 WeakPolarHBondContact CB-O 3.46Å
387	P	95.1	Very high	89.1	Confident	17 Å²	17	71.8 Å²	71.8	11%	0.11	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-56.5	140.4	176.4	-19.9	28.4	0	0	0	111.9	T143 R186 A368 L389	T143-P387 HydrophobicContact CG2-CB 4.13Å; T143-P387 HydrophobicContact CG2-CG 3.62Å; R186-P387 HydrophobicContact CG-CG 4.37Å; R186-P387 WeakPolarHBondContact O-CD 3.23Å; R186-P387 WeakPolarHBondContact O-CG 3.42Å; A368-P387 HydrophobicContact CB-CB 3.77Å; A368-P387 HydrophobicContact CB-CG 4.39Å; P387-L389 PolarHBondContact O-N 2.7Å
388	I	94	Very high	87	Confident	64 Å²	64	70.2 Å²	70.2	33%	0.328	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-65.2	119	172.5	-60.9	174.8	0	0	0	107.9	G369 E371 A372 A373	G369-I388 PolarHBondContact N-O 2.76Å; E371-I388 HydrophobicContact CB-CD1 3.93Å; A372-I388 WeakPolarHBondContact O-CD1 3.34Å; A373-I388 HydrophobicContact CB-CG1 4.03Å
389	L	94.6	Very high	84.7	Confident	83 Å²	83	70.2 Å²	70.2	44%	0.435	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	141.1	-176.1	-54.4	-178.8	0	0	0	111.2	D366 T367 P387	D366-L389 HydrophobicContact CB-CB 3.9Å; D366-L389 HydrophobicContact CB-CD1 4.35Å; T367-L389 CarbonylContact O-C 3.59Å; T367-L389 VanDerWaalsContact O-CA 3.25Å; T367-L389 WeakPolarHBondContact O-CA 3.12Å; P387-L389 PolarHBondContact O-N 2.7Å
390	I	93.4	Very high	82.3	Confident	60 Å²	60	80.1 Å²	80.1	31%	0.308	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	149.3	174.1	62.7	168.9	0	0	0	110.2	R325 D366 T367	R325-I390 HydrophobicContact CG-CD1 4.05Å; D366-I390 WeakPolarHBondContact CA-O 3.18Å; T367-I390 HydrophobicContact CG2-CG1 4.24Å; T367-I390 PolarHBondContact N-O 3.2Å; T367-I390 PolarHBondContact O-N 3.39Å
391	S	93.8	Very high	79.8	Confident	41 Å²	41	84.8 Å²	84.8	29%	0.287	46%	0.457	S	S	.	.			trans	-90	129.1	175.7	-158.5	0	0	0	0	111	D366 R393	D366-S391 WeakPolarHBondContact OD1-CA 3.5Å; D366-S391 VanDerWaalsContact OD1-CB 3.27Å; D366-S391 WeakPolarHBondContact OD1-CB 3.43Å; D366-S391 PolarHBondContact OD1-OG 3.36Å; D366-S391 VanDerWaalsContact OD1-OG 3.09Å; S391-R393 PolarHBondContact O-N 3.04Å
392	L	90.6	Very high	77.4	Confident	6 Å²	6	91.7 Å²	91.7	3%	0.031	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	0.4	176.8	-62.2	178.2	0	0	0	113.5	K324 V329 F359 Y364 T367 E394 A395 Y396	K324-L392 HydrophobicContact CB-CD1 4.32Å; V329-L392 HydrophobicContact CG2-CB 4.12Å; V329-L392 HydrophobicContact CG2-CD1 4.21Å; F359-L392 HydrophobicContact CE2-CB 4.46Å; F359-L392 HydrophobicContact CZ-CB 4.41Å; Y364-L392 HydrophobicContact CD1-CD1 4.03Å; T367-L392 HydrophobicContact CG2-CD1 4.14Å; T367-L392 HydrophobicContact CG2-CD2 3.92Å; T367-L392 HydrophobicContact CG2-CG 3.91Å; L392-E394 VanDerWaalsContact C-N 3.28Å; L392-E394 PolarHBondContact O-N 3.32Å; L392-A395 PolarHBondContact O-N 2.82Å; L392-Y396 PolarHBondContact O-N 2.89Å
393	R	84.6	Confident	74.5	Confident	133 Å²	133	96.4 Å²	96.4	50%	0.502	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-36.9	174.8	-72.8	-175.1	-168.5	-113.6	19.6	112.5	F359 D361 S391 A395 Y396	F359-R393 HydrophobicContact CD1-CG 3.59Å; F359-R393 HydrophobicContact CD2-CG 4.09Å; F359-R393 HydrophobicContact CE1-CG 3.36Å; F359-R393 HydrophobicContact CE2-CB 4.29Å; F359-R393 HydrophobicContact CE2-CG 3.88Å; F359-R393 HydrophobicContact CG-CG 3.94Å; F359-R393 HydrophobicContact CZ-CB 4.3Å; F359-R393 HydrophobicContact CZ-CG 3.51Å; D361-R393 IonicContact OD1-CZ 3.27Å; D361-R393 IonicContact OD1-NE 2.74Å; D361-R393 PolarHBondContact OD1-NE 2.8Å; D361-R393 VanDerWaalsContact OD1-NE 3.11Å; D361-R393 IonicContact OD1-NH1 3.26Å; D361-R393 PolarHBondContact OD1-NH1 2.94Å; D361-R393 IonicContact OD1-NH2 2.71Å; D361-R393 PolarHBondContact OD1-NH2 3.33Å; D361-R393 IonicContact OD2-CZ 2.75Å; D361-R393 VanDerWaalsContact OD2-CZ 3.26Å; D361-R393 IonicContact OD2-NH1 3.23Å; D361-R393 PolarHBondContact OD2-NH1 3.11Å; D361-R393 IonicContact OD2-NH2 2.73Å; D361-R393 PolarHBondContact OD2-NH2 2.88Å; S391-R393 PolarHBondContact O-N 3.04Å; R393-A395 VanDerWaalsContact C-N 3.28Å; R393-A395 PolarHBondContact O-N 3.35Å; R393-Y396 WeakPolarHBondContact O-CB 3.19Å; R393-Y396 PolarHBondContact O-N 3.23Å
394	E	75.1	Confident	71.7	Confident	185 Å²	185	98.4 Å²	98.4	86%	0.864	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-29.9	-177.2	-61.9	-176.4	178.9	0	0	112	L392 Y396	L392-E394 VanDerWaalsContact C-N 3.28Å; L392-E394 PolarHBondContact O-N 3.32Å; E394-Y396 VanDerWaalsContact C-N 3.25Å; E394-Y396 PolarHBondContact O-N 2.58Å
395	A	64.8	Low	69	Low	68 Å²	68	104 Å²	104	56%	0.562	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-6.9	172.6	0	0	0	0	0	113.1	L392 R393 V397	L392-A395 PolarHBondContact O-N 2.82Å; R393-A395 VanDerWaalsContact C-N 3.28Å; R393-A395 PolarHBondContact O-N 3.35Å; A395-V397 PolarHBondContact O-N 3.45Å; A395-V397 VanDerWaalsContact O-N 3.14Å
396	Y	61.9	Low	66.2	Low	38 Å²	38	109.5 Å²	109.5	15%	0.149	55%	0.548	C	S	.	.			trans	-74	105.5	-179.9	-176.5	-97	0	0	0	111.1	V329 D357 F359 L392 R393 E394 P398	V329-Y396 HydrophobicContact CG1-CD2 4.15Å; D357-Y396 PolarHBondContact O-OH 3.34Å; F359-Y396 HydrophobicContact CB-CD2 4.34Å; F359-Y396 HydrophobicContact CB-CE2 4.43Å; F359-Y396 HydrophobicContact CB-CG 4.41Å; F359-Y396 AromaticContact CD2-CD2 3.67Å; F359-Y396 HydrophobicContact CD2-CD2 3.67Å; F359-Y396 HydrophobicContact CD2-CE2 4.43Å; F359-Y396 AromaticContact CD2-CG 3.84Å; F359-Y396 HydrophobicContact CD2-CG 3.84Å; F359-Y396 HydrophobicContact CG-CD2 4.5Å; L392-Y396 PolarHBondContact O-N 2.89Å; R393-Y396 WeakPolarHBondContact O-CB 3.19Å; R393-Y396 PolarHBondContact O-N 3.23Å; E394-Y396 VanDerWaalsContact C-N 3.25Å; E394-Y396 PolarHBondContact O-N 2.58Å; Y396-P398 HydrophobicContact CD1-CG 4.18Å; Y396-P398 HydrophobicContact CE1-CB 4.04Å; Y396-P398 HydrophobicContact CE1-CG 3.8Å
397	V	60.9	Low	63.4	Low	110 Å²	110	109.4 Å²	109.4	67%	0.667	56%	0.556	S	S	*	*			trans	-95.6	115.2	166.1	-175.9	0	0	0	0	108.4	S330 A395 S399	S330-V397 WeakPolarHBondContact CB-O 3.5Å; A395-V397 PolarHBondContact O-N 3.45Å; A395-V397 VanDerWaalsContact O-N 3.14Å; V397-S399 PolarHBondContact O-N 2.89Å
398	P	52.5	Low	60.7	Low	80 Å²	80	119.5 Å²	119.5	52%	0.519	59%	0.592	S	S	.	*			trans	-56.8	136	176.1	-18.7	27	0	0	0	110.2	Y396 K400	Y396-P398 HydrophobicContact CD1-CG 4.18Å; Y396-P398 HydrophobicContact CE1-CB 4.04Å; Y396-P398 HydrophobicContact CE1-CG 3.8Å; P398-K400 PolarHBondContact O-N 3.21Å; P398-K400 VanDerWaalsContact O-N 3.07Å
399	S	48.9	Very low	57.8	Low	68 Å²	68	127.5 Å²	127.5	48%	0.476	62%	0.618	S	S	.	*			trans	-63.7	116.3	173.6	82.5	0	0	0	0	108.5	V397 Q401	V397-S399 PolarHBondContact O-N 2.89Å; S399-Q401 PolarHBondContact O-N 3.41Å
400	K	46.7	Very low	55.1	Low	207 Å²	207	131.1 Å²	131.1	90%	0.9	64%	0.638	S	S	*	*			trans	-63.2	103	174.3	-73.9	-176.7	180	178	0	107.9	P398 R402	P398-K400 PolarHBondContact O-N 3.21Å; P398-K400 VanDerWaalsContact O-N 3.07Å; K400-R402 PolarHBondContact O-N 2.81Å
401	Q	43.6	Very low	52.4	Low	151 Å²	151	135 Å²	135	71%	0.706	66%	0.664	S	S	*	*			trans	-72.1	127.4	168.7	-85.3	-169.1	2.8	0	0	110.4	S399	S399-Q401 PolarHBondContact O-N 3.41Å
402	R	44.8	Very low	49.7	Very low	234 Å²	234	140.8 Å²	140.8	88%	0.883	69%	0.69	S	S	*	*			trans	-60.4	129.9	163.7	-76.8	174.9	167.9	174.3	-4.4	110	K400	K400-R402 PolarHBondContact O-N 2.81Å
403	D	34.3	Very low	46.9	Very low	142 Å²	142	146.1 Å²	146.1	76%	0.759	73%	0.729	S	S	*	*			trans	46.8	100.4	159.4	-59.1	-26.9	0	0	0	118.9	K405	D403-K405 VanDerWaalsContact C-N 3.28Å; D403-K405 PolarHBondContact O-N 2.79Å
404	L	38.3	Very low	44.4	Very low	168 Å²	168	147 Å²	147	88%	0.88	74%	0.743	S	S	*	*			trans	-54	92.9	144.8	-87.4	152	0	0	0	109.1	I406	L404-I406 VanDerWaalsContact C-N 3.25Å; L404-I406 PolarHBondContact O-N 3.2Å
405	K	39.7	Very low	42.3	Very low	198 Å²	198	144.1 Å²	144.1	86%	0.861	74%	0.744	S	S	*	*			trans	-68.6	91.8	160.6	-84.5	-173.8	178.2	178.3	0	108.1	D403 S407	D403-K405 VanDerWaalsContact C-N 3.28Å; D403-K405 PolarHBondContact O-N 2.79Å; K405-S407 PolarHBondContact O-N 2.96Å
406	I	37	Very low	40.5	Very low	142 Å²	142	152.3 Å²	152.3	73%	0.728	76%	0.76	S	S	*	*			trans	-62.1	102.5	163.9	-62	169.3	0	0	0	106.8	L404 R408	L404-I406 VanDerWaalsContact C-N 3.25Å; L404-I406 PolarHBondContact O-N 3.2Å; I406-R408 PolarHBondContact O-N 3.06Å; I406-R408 VanDerWaalsContact O-N 3.07Å
407	S	37.8	Very low	40	Very low	103 Å²	103	156 Å²	156	72%	0.72	79%	0.788	S	S	*	*			trans	-65.6	101.3	164.5	172	0	0	0	0	107.9	K405 R409	K405-S407 PolarHBondContact O-N 2.96Å; S407-R409 PolarHBondContact O-N 2.75Å; S407-R409 VanDerWaalsContact O-N 3.15Å
408	R	37.4	Very low	38.4	Very low	229 Å²	229	155.3 Å²	155.3	86%	0.864	80%	0.795	S	S	*	*			trans	-69.7	106.7	166.9	-75.8	-172.9	179.3	173.1	0.4	107.7	I406 N410	I406-R408 PolarHBondContact O-N 3.06Å; I406-R408 VanDerWaalsContact O-N 3.07Å; R408-N410 PolarHBondContact O-N 2.94Å
409	R	33.3	Very low	37.3	Very low	232 Å²	232	156.1 Å²	156.1	88%	0.875	81%	0.808	S	S	*	*			trans	-63.6	126.3	164.9	-89.5	-179.1	172.9	164.5	-1.8	109	S407 V411	S407-R409 PolarHBondContact O-N 2.75Å; S407-R409 VanDerWaalsContact O-N 3.15Å; R409-V411 PolarHBondContact O-N 2.86Å
410	N	37.2	Very low	36.3	Very low	159 Å²	159	156.9 Å²	156.9	85%	0.85	82%	0.818	S	S	*	*			trans	-57.8	126.4	170	-73.5	-22.9	0	0	0	110.7	R408	R408-N410 PolarHBondContact O-N 2.94Å
411	V	36.6	Very low	35.4	Very low	141 Å²	141	155.6 Å²	155.6	86%	0.855	82%	0.82	S	S	*	*			trans	-106	113.8	157.7	-179.7	0	0	0	0	106.4	R409	R409-V411 PolarHBondContact O-N 2.86Å
412	L	37.3	Very low	34.6	Very low	162 Å²	162	151.9 Å²	151.9	85%	0.848	82%	0.823	S	S	*	*			trans	-66.8	139.2	173.6	-76.1	151.9	0	0	0	110.6
413	S	31.6	Very low	33.8	Very low	119 Å²	119	146.3 Å²	146.3	83%	0.832	82%	0.82	S	S	*	*			trans	-160.2	138.8	130	45.6	0	0	0	0	111.4
414	D	32.9	Very low	33.5	Very low	152 Å²	152	145.3 Å²	145.3	81%	0.813	82%	0.823	S	S	*	*			trans	-60.5	145	-175.5	-74.1	-59.6	0	0	0	115.3
415	S	30.3	Very low	33	Very low	124 Å²	124	147.9 Å²	147.9	87%	0.867	82%	0.822	S	S	*	*				163.4	135.9	108	49.2	0	0	0	0	112.5
416	R	27.8	Very low	32.5	Very low	239 Å²	239	146.4 Å²	146.4	90%	0.902	82%	0.822	S	S	*	*			trans	-84.5	-176.9	179.7	-102.3	-174.3	178.2	178.9	0.6	111.2
417	P	51.4	Low	32	Very low	115 Å²	115	143.4 Å²	143.4	75%	0.747	83%	0.827	S	S	*	*				-135.1	177.5	-57.9	37.8	-18.9	0	0	0	112
418	A	27.6	Very low	31.5	Very low	97 Å²	97	143 Å²	143	80%	0.802	83%	0.83	S	S	*	*			trans	155.5	143.7	131.3	0	0	0	0	0	116.1
419	A	27.9	Very low	32.1	Very low	97 Å²	97	138.1 Å²	138.1	80%	0.802	83%	0.828	S	S	*	*			trans	77.4	100.1	143.5	0	0	0	0	0	122.4
420	A	28	Very low	31.9	Very low	84 Å²	84	131.6 Å²	131.6	69%	0.694	82%	0.823	S	S	*	*				72.5	142.9	107.3	0	0	0	0	0	123.2
421	L	28.7	Very low	31.5	Very low	180 Å²	180	128.3 Å²	128.3	94%	0.942	82%	0.818	S	S	*	*			trans	81	135.1	161.5	-59.1	138.2	0	0	0	115.8
422	G	27.3	Very low	31	Very low	73 Å²	73	127.9 Å²	127.9	75%	0.753	82%	0.816	S	S	*	*			cis	176.5	156.2	3.6	0	0	0	0	0	110.4
423	S	27.4	Very low	30.5	Very low	117 Å²	117	125.2 Å²	125.2	82%	0.818	81%	0.806	S	S	*	*			trans	-25.1	141.5	166.7	178.3	0	0	0	0	118.1
424	S	28.1	Very low	30.4	Very low	120 Å²	120	127.1 Å²	127.1	84%	0.839	81%	0.806	S	S	*	*				171.3	160.1	103.6	55.5	0	0	0	0	114.8
425	R	27.3	Very low	30.2	Very low	223 Å²	223	123.6 Å²	123.6	84%	0.842	80%	0.797	S	S	*	*			trans	-92	158.9	-167.9	-92.2	175.4	170.5	-178.5	-2.9	113.1
426	L	29.2	Very low	30.1	Very low	166 Å²	166	122 Å²	122	87%	0.869	79%	0.792	S	S	*	*			trans	69.9	128.5	142.3	-69.2	159.7	0	0	0	119.8
427	G	26.7	Very low	30.1	Very low	80 Å²	80	118.1 Å²	118.1	83%	0.825	79%	0.789	S	S	*	*			trans	169.2	83.1	161.9	0	0	0	0	0	113.6
428	A	28.5	Very low	29	Very low	95 Å²	95	116.6 Å²	116.6	79%	0.785	79%	0.786	S	S	*	*			trans	-91.9	178.4	147.5	0	0	0	0	0	107.4
429	P	49.4	Very low	29.3	Very low	126 Å²	126	118.5 Å²	118.5	82%	0.818	79%	0.788	S	S	*	*			cis	-140	-174.6	0.7	36.9	-15.1	0	0	0	114.2
430	A	28.3	Very low	29.9	Very low	94 Å²	94	119.7 Å²	119.7	78%	0.777	79%	0.788	S	S	*	*			trans	145.1	105.2	145.1	0	0	0	0	0	109.1
431	A	28.3	Very low	30.1	Very low	90 Å²	90	121.3 Å²	121.3	74%	0.744	79%	0.794	S	S	*	*				81	103.6	58.1	0	0	0	0	0	114.1
432	T	26.3	Very low	30.1	Very low	133 Å²	133	116 Å²	116	82%	0.816	78%	0.783	S	S	*	*			trans	-179.3	94.7	134.9	10	0	0	0	0	107.3
433	T	27.2	Very low	30.3	Very low	105 Å²	105	117.9 Å²	117.9	64%	0.644	78%	0.784	S	S	*	*				77.5	112	78.4	58.3	0	0	0	0	114.8
434	I	30	Very low	31	Very low	160 Å²	160	120.7 Å²	120.7	82%	0.821	79%	0.789	S	S	*	*				89.8	138.7	96.2	-68.7	167.2	0	0	0	110.5
435	A	28.4	Very low	31.4	Very low	77 Å²	77	120.7 Å²	120.7	64%	0.636	78%	0.784	S	S	*	*			cis	-153.5	150.4	23.3	0	0	0	0	0	109.9
436	A	29.1	Very low	32.4	Very low	92 Å²	92	121 Å²	121	76%	0.76	79%	0.785	S	S	*	*				69	137.5	94.6	0	0	0	0	0	113.3
437	D	26.5	Very low	33.1	Very low	157 Å²	157	117 Å²	117	84%	0.84	78%	0.777	S	S	*	*			cis	-172	170.1	42.9	-150.9	-2.5	0	0	0	112.9
438	A	29.3	Very low	34.1	Very low	83 Å²	83	115.6 Å²	115.6	69%	0.686	76%	0.762	S	S	*	*			trans	82.4	110	148.6	0	0	0	0	0	122
439	T	34.1	Very low	35.2	Very low	136 Å²	136	118 Å²	118	83%	0.834	76%	0.757	S	S	*	*			trans	-62.2	158.6	141.4	34.9	0	0	0	0	111.2
440	P	39.9	Very low	35.5	Very low	123 Å²	123	114.6 Å²	114.6	80%	0.799	74%	0.739	S	S	*	*				-143.1	157.3	111.3	33.8	-17.4	0	0	0	114.9
441	S	33.1	Very low	37.5	Very low	118 Å²	118	112.2 Å²	112.2	83%	0.825	72%	0.724	S	S	*	*			trans	-51.8	149.6	157.9	51.4	0	0	0	0	114.1
442	G	28.8	Very low	39.8	Very low	69 Å²	69	115.3 Å²	115.3	71%	0.711	72%	0.721	S	S	*	*			trans	166.6	109.2	160.6	0	0	0	0	0	117.8
443	S	30.1	Very low	42.3	Very low	111 Å²	111	114.1 Å²	114.1	78%	0.776	71%	0.709	S	S	*	*			trans	54.9	123.3	135.5	65.6	0	0	0	0	123.1	T445	S443-T445 PolarHBondContact O-N 3.12Å
444	L	42.3	Very low	45	Very low	176 Å²	176	115.7 Å²	115.7	92%	0.921	71%	0.709	S	S	*	*			trans	-31.3	122.3	151.3	-68.6	143.4	0	0	0	114.5
445	T	37	Very low	47.8	Very low	120 Å²	120	114 Å²	114	74%	0.736	70%	0.697	S	S	*	*			trans	-99.8	101.8	165	52.1	0	0	0	0	110.3	S443 A447	S443-T445 PolarHBondContact O-N 3.12Å; T445-A447 PolarHBondContact O-N 3.44Å
446	R	47.5	Very low	50.5	Low	230 Å²	230	113.8 Å²	113.8	87%	0.868	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	5.6	177.3	-137.1	178.1	-169.2	179.9	2.1	115.4
447	A	43.9	Very low	53.1	Low	83 Å²	83	113.5 Å²	113.5	69%	0.686	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-22.1	-172.3	0	0	0	0	0	114	T445	T445-A447 PolarHBondContact O-N 3.44Å
448	G	48.1	Very low	56.2	Low	50 Å²	50	112.6 Å²	112.6	52%	0.515	66%	0.663	S	S	.	*	H	α-helix	trans	-83.6	-23.8	-179.5	0	0	0	0	0	114.7
449	E	51.3	Low	59.2	Low	145 Å²	145	114.3 Å²	114.3	68%	0.678	66%	0.657	S	S	*	*	H	α-helix	trans	-79.6	-30.4	178.8	-70.6	176.8	158	0	0	112.4	K452 L453	E449-K452 PolarHBondContact O-N 3.13Å; E449-L453 WeakPolarHBondContact O-CB 3.34Å; E449-L453 PolarHBondContact O-N 2.83Å
450	A	55.5	Low	61.7	Low	54 Å²	54	112.2 Å²	112.2	45%	0.446	64%	0.64	S	S	.	*	H	α-helix	trans	-64.8	-41.3	178.6	0	0	0	0	0	112.3	L453 E454	A450-L453 PolarHBondContact O-N 2.92Å; A450-E454 WeakPolarHBondContact O-CB 3.24Å; A450-E454 PolarHBondContact O-N 3.27Å
451	G	71.6	Confident	64.1	Low	45 Å²	45	114.2 Å²	114.2	46%	0.464	63%	0.632	S	S	.	*	H	α-helix	trans	-65.7	-39.7	178.7	0	0	0	0	0	113.3	E454 E455	G451-E454 PolarHBondContact O-N 2.89Å; G451-E455 PolarHBondContact O-N 2.93Å
452	K	75.1	Confident	66.9	Low	154 Å²	154	111.6 Å²	111.6	67%	0.67	62%	0.617	S	S	*	*	H	α-helix	trans	-69.1	-36.6	176	-71.2	-176.1	176.8	-177	0	112.3	E449 E454 V456	E449-K452 PolarHBondContact O-N 3.13Å; K452-E454 VanDerWaalsContact C-N 3.35Å; K452-V456 WeakPolarHBondContact O-CG2 3.45Å; K452-V456 PolarHBondContact O-N 3.41Å; K452-V456 VanDerWaalsContact O-N 3.16Å
453	L	78.8	Confident	69.8	Low	108 Å²	108	113.1 Å²	113.1	57%	0.565	61%	0.608	S	S	*	*	H	α-helix	trans	-66.9	-38.5	177	-175.3	62.9	0	0	0	111.6	E449 A450 V456 M457	E449-L453 WeakPolarHBondContact O-CB 3.34Å; E449-L453 PolarHBondContact O-N 2.83Å; A450-L453 PolarHBondContact O-N 2.92Å; L453-V456 PolarHBondContact O-N 2.83Å; L453-M457 WeakPolarHBondContact O-CB 3.48Å; L453-M457 VanDerWaalsContact O-CG 3.3Å; L453-M457 WeakPolarHBondContact O-CG 3.4Å; L453-M457 PolarHBondContact O-N 3.16Å
454	E	85.1	Confident	72.6	Confident	138 Å²	138	117 Å²	117	65%	0.645	61%	0.606	S	S	*	*	H	α-helix	trans	-69	-37	179.5	-162.4	136.5	-152.7	0	0	112.2	A450 G451 K452 M457 Q458	A450-E454 WeakPolarHBondContact O-CB 3.24Å; A450-E454 PolarHBondContact O-N 3.27Å; G451-E454 PolarHBondContact O-N 2.89Å; K452-E454 VanDerWaalsContact C-N 3.35Å; E454-M457 PolarHBondContact O-N 3.22Å; E454-Q458 WeakPolarHBondContact O-CB 3.29Å; E454-Q458 PolarHBondContact O-N 2.79Å
455	E	87.4	Confident	75	Confident	124 Å²	124	111.5 Å²	111.5	58%	0.579	59%	0.586	S	S	*	*	H	α-helix	trans	-63.1	-47	173.3	-164.4	168.9	-159.8	0	0	111.6	G451 M457 Q458 E459	G451-E455 PolarHBondContact O-N 2.93Å; E455-M457 VanDerWaalsContact C-N 3.34Å; E455-M457 PolarHBondContact O-N 2.88Å; E455-Q458 WeakPolarHBondContact O-CB 3.43Å; E455-Q458 PolarHBondContact O-N 2.87Å; E455-Q458 VanDerWaalsContact O-N 3.12Å; E455-E459 PolarHBondContact O-N 2.77Å
456	V	85.8	Confident	77.6	Confident	74 Å²	74	110.2 Å²	110.2	45%	0.448	57%	0.574	S	S	.	*	H	α-helix	trans	-63.4	-38.5	175.8	172.7	0	0	0	0	111.9	K452 L453 Q458 E459 L460	K452-V456 WeakPolarHBondContact O-CG2 3.45Å; K452-V456 PolarHBondContact O-N 3.41Å; K452-V456 VanDerWaalsContact O-N 3.16Å; L453-V456 PolarHBondContact O-N 2.83Å; V456-Q458 VanDerWaalsContact C-N 3.29Å; V456-Q458 PolarHBondContact O-N 2.99Å; V456-E459 PolarHBondContact O-N 2.79Å; V456-L460 HydrophobicContact CG1-CD1 4.19Å; V456-L460 WeakPolarHBondContact O-CB 3.42Å; V456-L460 WeakPolarHBondContact O-CG 3.19Å; V456-L460 PolarHBondContact O-N 2.69Å
457	M	84.8	Confident	79.8	Confident	86 Å²	86	104.1 Å²	104.1	42%	0.424	56%	0.562	S	S	.	*	H	α-helix	trans	-66	-33.5	175.5	-77.1	-173.3	67.9	0	0	112.4	L453 E454 E455 R461	L453-M457 WeakPolarHBondContact O-CB 3.48Å; L453-M457 VanDerWaalsContact O-CG 3.3Å; L453-M457 WeakPolarHBondContact O-CG 3.4Å; L453-M457 PolarHBondContact O-N 3.16Å; E454-M457 PolarHBondContact O-N 3.22Å; E455-M457 VanDerWaalsContact C-N 3.34Å; E455-M457 PolarHBondContact O-N 2.88Å; M457-R461 WeakPolarHBondContact O-CG 3.32Å; M457-R461 PolarHBondContact O-N 3.4Å; M457-R461 VanDerWaalsContact O-N 3.14Å
458	Q	90.6	Very high	82.1	Confident	137 Å²	137	106.9 Å²	106.9	64%	0.64	56%	0.559	S	S	*	*	H	α-helix	trans	-71.5	-40.9	176.9	-166.1	167.1	-2.6	0	0	111.4	E454 E455 V456 R461 A462	E454-Q458 WeakPolarHBondContact O-CB 3.29Å; E454-Q458 PolarHBondContact O-N 2.79Å; E455-Q458 WeakPolarHBondContact O-CB 3.43Å; E455-Q458 PolarHBondContact O-N 2.87Å; E455-Q458 VanDerWaalsContact O-N 3.12Å; V456-Q458 VanDerWaalsContact C-N 3.29Å; V456-Q458 PolarHBondContact O-N 2.99Å; Q458-R461 PolarHBondContact O-N 2.99Å; Q458-A462 PolarHBondContact O-N 3.34Å
459	E	92.3	Very high	84.2	Confident	120 Å²	120	110.4 Å²	110.4	56%	0.561	56%	0.562	S	S	*	*	H	α-helix	trans	-62.5	-43.5	172.7	-71.9	-172.9	162.7	0	0	112.3	E455 V456 R461 A462 L463	E455-E459 PolarHBondContact O-N 2.77Å; V456-E459 PolarHBondContact O-N 2.79Å; E459-R461 VanDerWaalsContact C-N 3.29Å; E459-R461 PolarHBondContact O-N 2.75Å; E459-A462 PolarHBondContact O-N 3.33Å; E459-A462 VanDerWaalsContact O-N 3.17Å; E459-L463 WeakPolarHBondContact O-CB 3.43Å; E459-L463 PolarHBondContact O-N 2.82Å
460	L	87.7	Confident	86.1	Confident	92 Å²	92	107.4 Å²	107.4	48%	0.482	55%	0.548	S	S	.	.	H	α-helix	trans	-61.9	-36.1	176.2	-80.5	169.8	0	0	0	112.7	V456 R464	V456-L460 HydrophobicContact CG1-CD1 4.19Å; V456-L460 WeakPolarHBondContact O-CB 3.42Å; V456-L460 WeakPolarHBondContact O-CG 3.19Å; V456-L460 PolarHBondContact O-N 2.69Å; L460-R464 WeakPolarHBondContact O-CB 3.2Å; L460-R464 WeakPolarHBondContact O-CG 3.39Å; L460-R464 PolarHBondContact O-N 3.37Å
461	R	89.6	Confident	87.8	Confident	165 Å²	165	106.7 Å²	106.7	62%	0.623	55%	0.546	S	S	*	.	H	α-helix	trans	-68.7	-40.8	174.4	-74.8	175.3	-173.3	156	3	111.6	M457 Q458 E459 R464 A465	M457-R461 WeakPolarHBondContact O-CG 3.32Å; M457-R461 PolarHBondContact O-N 3.4Å; M457-R461 VanDerWaalsContact O-N 3.14Å; Q458-R461 PolarHBondContact O-N 2.99Å; E459-R461 VanDerWaalsContact C-N 3.29Å; E459-R461 PolarHBondContact O-N 2.75Å; R461-R464 PolarHBondContact O-N 2.61Å; R461-A465 PolarHBondContact O-N 3.32Å
462	A	92.1	Very high	88.8	Confident	63 Å²	63	108.9 Å²	108.9	52%	0.521	54%	0.544	S	S	.	.	H	α-helix	trans	-64	-44	176.4	0	0	0	0	0	111.7	Q458 E459 R464 A465 L466	Q458-A462 PolarHBondContact O-N 3.34Å; E459-A462 PolarHBondContact O-N 3.33Å; E459-A462 VanDerWaalsContact O-N 3.17Å; A462-R464 PolarHBondContact O-N 3.33Å; A462-A465 PolarHBondContact O-N 2.98Å; A462-L466 PolarHBondContact O-N 3.16Å
463	L	88.8	Confident	89.7	Confident	100 Å²	100	108.7 Å²	108.7	52%	0.524	54%	0.539	S	S	.	.	H	α-helix	trans	-61.1	-43.2	175.1	-86	156.2	0	0	0	112.1	E459 A465 L466 V467	E459-L463 WeakPolarHBondContact O-CB 3.43Å; E459-L463 PolarHBondContact O-N 2.82Å; L463-A465 VanDerWaalsContact C-N 3.33Å; L463-A465 PolarHBondContact O-N 3.36Å; L463-L466 PolarHBondContact O-N 3.02Å; L463-V467 VanDerWaalsContact O-CG2 3.32Å; L463-V467 WeakPolarHBondContact O-CG2 3.2Å; L463-V467 PolarHBondContact O-N 2.91Å
464	R	90.4	Very high	90.4	Very high	193 Å²	193	107.7 Å²	107.7	73%	0.728	53%	0.533	S	S	*	.	H	α-helix	trans	-62.2	-38.7	175.4	-78.3	178.6	-179.8	-177.1	1.2	112.8	L460 R461 A462 K468	L460-R464 WeakPolarHBondContact O-CB 3.2Å; L460-R464 WeakPolarHBondContact O-CG 3.39Å; L460-R464 PolarHBondContact O-N 3.37Å; R461-R464 PolarHBondContact O-N 2.61Å; A462-R464 PolarHBondContact O-N 3.33Å; R464-K468 WeakPolarHBondContact O-CB 3.45Å; R464-K468 PolarHBondContact O-N 3.4Å; R464-K468 VanDerWaalsContact O-N 3.09Å
465	A	91.3	Very high	90.7	Very high	61 Å²	61	104.2 Å²	104.2	50%	0.504	52%	0.523	S	S	.	.	H	α-helix	trans	-65.6	-43	176	0	0	0	0	0	111.5	R461 A462 L463 K468 E469	R461-A465 PolarHBondContact O-N 3.32Å; A462-A465 PolarHBondContact O-N 2.98Å; L463-A465 VanDerWaalsContact C-N 3.33Å; L463-A465 PolarHBondContact O-N 3.36Å; A465-K468 PolarHBondContact O-N 3Å; A465-E469 PolarHBondContact O-N 3.19Å
466	L	92.9	Very high	90.9	Very high	92 Å²	92	105.9 Å²	105.9	48%	0.482	52%	0.524	S	S	.	.	H	α-helix	trans	-63.6	-43.9	177.4	-172	70.6	0	0	0	111.9	A462 L463 K468 E469 Q470	A462-L466 PolarHBondContact O-N 3.16Å; L463-L466 PolarHBondContact O-N 3.02Å; L466-K468 VanDerWaalsContact C-N 3.29Å; L466-K468 PolarHBondContact O-N 3.13Å; L466-E469 PolarHBondContact O-N 2.81Å; L466-Q470 WeakPolarHBondContact O-CG 3.5Å; L466-Q470 PolarHBondContact O-N 3.46Å
467	V	92.8	Very high	91	Very high	102 Å²	102	106.1 Å²	106.1	62%	0.618	52%	0.523	S	S	*	.	H	α-helix	trans	-61.3	-40.4	176.7	170.1	0	0	0	0	111	L463 Q470 G471	L463-V467 VanDerWaalsContact O-CG2 3.32Å; L463-V467 WeakPolarHBondContact O-CG2 3.2Å; L463-V467 PolarHBondContact O-N 2.91Å; V467-Q470 PolarHBondContact O-N 3.23Å; V467-G471 PolarHBondContact O-N 3.28Å
468	K	91.8	Very high	91.2	Very high	141 Å²	141	108 Å²	108	61%	0.613	53%	0.53	S	S	*	.	H	α-helix	trans	-63.2	-44.3	175.8	-171.6	-177	175	-171.3	0	111.8	R464 A465 L466 G471 E472	R464-K468 WeakPolarHBondContact O-CB 3.45Å; R464-K468 PolarHBondContact O-N 3.4Å; R464-K468 VanDerWaalsContact O-N 3.09Å; A465-K468 PolarHBondContact O-N 3Å; L466-K468 VanDerWaalsContact C-N 3.29Å; L466-K468 PolarHBondContact O-N 3.13Å; K468-G471 PolarHBondContact O-N 3.09Å; K468-E472 WeakPolarHBondContact CE-OE1 3.23Å; K468-E472 PolarHBondContact O-N 3.3Å
469	E	93.3	Very high	91.1	Very high	125 Å²	125	106.7 Å²	106.7	58%	0.584	52%	0.524	S	S	*	.	H	α-helix	trans	-63.7	-41.5	177.7	-172.2	-178.9	176.5	0	0	112.1	A465 L466 G471 E472 R473	A465-E469 PolarHBondContact O-N 3.19Å; L466-E469 PolarHBondContact O-N 2.81Å; E469-G471 VanDerWaalsContact C-N 3.35Å; E469-E472 PolarHBondContact O-N 3.32Å; E469-R473 WeakPolarHBondContact O-CB 3.16Å; E469-R473 PolarHBondContact O-N 2.73Å
470	Q	90.6	Very high	90.7	Very high	82 Å²	82	106.5 Å²	106.5	38%	0.383	52%	0.524	S	S	.	.	H	α-helix	trans	-64.4	-39.7	174.5	-66.6	-60.9	-34.9	0	0	111.6	L466 V467 R473 I474	L466-Q470 WeakPolarHBondContact O-CG 3.5Å; L466-Q470 PolarHBondContact O-N 3.46Å; V467-Q470 PolarHBondContact O-N 3.23Å; Q470-R473 PolarHBondContact O-N 3.5Å; Q470-I474 VanDerWaalsContact O-CG1 3.28Å; Q470-I474 WeakPolarHBondContact O-CG1 3.02Å; Q470-I474 PolarHBondContact O-N 2.86Å
471	G	92.1	Very high	90.5	Very high	39 Å²	39	106.6 Å²	106.6	40%	0.402	52%	0.524	S	S	.	.	H	α-helix	trans	-60.8	-44.4	174.5	0	0	0	0	0	112.8	V467 K468 E469 R473 I474 C475	V467-G471 PolarHBondContact O-N 3.28Å; K468-G471 PolarHBondContact O-N 3.09Å; E469-G471 VanDerWaalsContact C-N 3.35Å; G471-R473 VanDerWaalsContact C-N 3.31Å; G471-R473 PolarHBondContact O-N 3.4Å; G471-I474 PolarHBondContact O-N 2.93Å; G471-C475 WeakPolarHBondContact O-CB 3.36Å; G471-C475 PolarHBondContact O-N 3.37Å
472	E	91.8	Very high	90.1	Very high	90 Å²	90	99.9 Å²	99.9	42%	0.421	51%	0.506	S	S	.	.	H	α-helix	trans	-64.8	-35.7	175	-71.3	179	-166.4	0	0	112.3	K468 E469 R476	K468-E472 WeakPolarHBondContact CE-OE1 3.23Å; K468-E472 PolarHBondContact O-N 3.3Å; E469-E472 PolarHBondContact O-N 3.32Å; E472-R476 WeakPolarHBondContact O-CG 3.05Å; E472-R476 PolarHBondContact O-N 3.36Å; E472-R476 VanDerWaalsContact O-N 3.15Å; E472-R476 IonicContact OE2-NH2 2.71Å
473	R	93.8	Very high	89.4	Confident	151 Å²	151	104.6 Å²	104.6	57%	0.57	51%	0.51	S	S	*	.	H	α-helix	trans	-67.6	-43.6	175.8	-177	-179.7	176.7	-171.2	-0.4	111.9	E469 Q470 G471 C475 R476 L477	E469-R473 WeakPolarHBondContact O-CB 3.16Å; E469-R473 PolarHBondContact O-N 2.73Å; Q470-R473 PolarHBondContact O-N 3.5Å; G471-R473 VanDerWaalsContact C-N 3.31Å; G471-R473 PolarHBondContact O-N 3.4Å; R473-C475 VanDerWaalsContact C-N 3.35Å; R473-R476 PolarHBondContact O-N 2.94Å; R473-L477 HydrophobicContact CG-CD1 4.18Å; R473-L477 WeakPolarHBondContact O-CG 3.27Å; R473-L477 PolarHBondContact O-N 3.15Å
474	I	92.8	Very high	88.8	Confident	86 Å²	86	106.5 Å²	106.5	44%	0.441	52%	0.518	S	S	.	.	H	α-helix	trans	-61.5	-47	177.5	-70.6	165.5	0	0	0	109.6	Q470 G471 R476 L477 E478	Q470-I474 VanDerWaalsContact O-CG1 3.28Å; Q470-I474 WeakPolarHBondContact O-CG1 3.02Å; Q470-I474 PolarHBondContact O-N 2.86Å; G471-I474 PolarHBondContact O-N 2.93Å; I474-R476 VanDerWaalsContact C-N 3.31Å; I474-R476 PolarHBondContact O-N 2.99Å; I474-L477 WeakPolarHBondContact O-CB 3.28Å; I474-L477 PolarHBondContact O-N 2.79Å; I474-E478 HydrophobicContact CG2-CG 4.27Å; I474-E478 WeakPolarHBondContact O-CG 3.45Å; I474-E478 PolarHBondContact O-N 3.05Å
475	C	92.1	Very high	87.9	Confident	66 Å²	66	104.7 Å²	104.7	45%	0.446	52%	0.518	S	S	.	.	H	α-helix	trans	-58.7	-41.5	178.5	-160.3	0	0	0	0	112.2	G471 R473 L477 E478 E479	G471-C475 WeakPolarHBondContact O-CB 3.36Å; G471-C475 PolarHBondContact O-N 3.37Å; R473-C475 VanDerWaalsContact C-N 3.35Å; C475-L477 PolarHBondContact O-N 3.13Å; C475-E478 PolarHBondContact O-N 3Å; C475-E479 WeakPolarHBondContact O-CG 3.33Å; C475-E479 PolarHBondContact O-N 3.43Å
476	R	91	Very high	87.1	Confident	158 Å²	158	108.1 Å²	108.1	60%	0.596	53%	0.528	S	S	*	.	H	α-helix	trans	-65.4	-36.7	174	-71.1	-178.7	-138.5	175.6	5.2	113.3	E472 R473 I474 Q480	E472-R476 WeakPolarHBondContact O-CG 3.05Å; E472-R476 PolarHBondContact O-N 3.36Å; E472-R476 VanDerWaalsContact O-N 3.15Å; E472-R476 IonicContact OE2-NH2 2.71Å; R473-R476 PolarHBondContact O-N 2.94Å; I474-R476 VanDerWaalsContact C-N 3.31Å; I474-R476 PolarHBondContact O-N 2.99Å; R476-Q480 VanDerWaalsContact O-CG 3.32Å; R476-Q480 WeakPolarHBondContact O-CG 3.43Å; R476-Q480 PolarHBondContact O-N 3.08Å
477	L	88.8	Confident	85.6	Confident	79 Å²	79	106.7 Å²	106.7	41%	0.414	54%	0.536	S	S	.	.	H	α-helix	trans	-70.2	-38.3	177.6	-73	169.6	0	0	0	111.3	R473 I474 C475 Q480 L481	R473-L477 HydrophobicContact CG-CD1 4.18Å; R473-L477 WeakPolarHBondContact O-CG 3.27Å; R473-L477 PolarHBondContact O-N 3.15Å; I474-L477 WeakPolarHBondContact O-CB 3.28Å; I474-L477 PolarHBondContact O-N 2.79Å; C475-L477 PolarHBondContact O-N 3.13Å; L477-Q480 PolarHBondContact O-N 3.22Å; L477-L481 PolarHBondContact O-N 2.95Å
478	E	89.1	Confident	84	Confident	126 Å²	126	108.7 Å²	108.7	59%	0.589	54%	0.543	S	S	*	.	H	α-helix	trans	-64.2	-42.1	173.8	-71.4	173.5	167	0	0	111.4	I474 C475 Q480 L481 G482	I474-E478 HydrophobicContact CG2-CG 4.27Å; I474-E478 WeakPolarHBondContact O-CG 3.45Å; I474-E478 PolarHBondContact O-N 3.05Å; C475-E478 PolarHBondContact O-N 3Å; E478-Q480 VanDerWaalsContact C-N 3.33Å; E478-Q480 PolarHBondContact O-N 2.86Å; E478-L481 PolarHBondContact O-N 3.02Å; E478-G482 PolarHBondContact O-N 2.73Å
479	E	87.9	Confident	82.1	Confident	110 Å²	110	110.3 Å²	110.3	51%	0.514	58%	0.582	S	S	.	*	H	α-helix	trans	-62.4	-38.3	172.6	-75.7	-178.2	179.2	0	0	112.6	C475 R483	C475-E479 WeakPolarHBondContact O-CG 3.33Å; C475-E479 PolarHBondContact O-N 3.43Å; E479-R483 VanDerWaalsContact O-CG 3.31Å; E479-R483 WeakPolarHBondContact O-CG 3.43Å; E479-R483 PolarHBondContact O-N 3.23Å; E479-R483 VanDerWaalsContact O-N 3.11Å
480	Q	84.9	Confident	81.5	Confident	116 Å²	116	109.6 Å²	109.6	54%	0.542	58%	0.582	S	S	.	*	H	α-helix	trans	-68.5	-40.4	175.9	-76.6	179.4	-21.8	0	0	112.1	R476 L477 E478 R483 M484	R476-Q480 VanDerWaalsContact O-CG 3.32Å; R476-Q480 WeakPolarHBondContact O-CG 3.43Å; R476-Q480 PolarHBondContact O-N 3.08Å; L477-Q480 PolarHBondContact O-N 3.22Å; E478-Q480 VanDerWaalsContact C-N 3.33Å; E478-Q480 PolarHBondContact O-N 2.86Å; Q480-R483 PolarHBondContact O-N 3.39Å; Q480-M484 WeakPolarHBondContact O-CG 2.88Å; Q480-M484 PolarHBondContact O-N 2.8Å; Q480-M484 VanDerWaalsContact O-N 3.11Å
481	L	83.7	Confident	81.1	Confident	93 Å²	93	111 Å²	111	49%	0.487	59%	0.592	S	S	.	*	H	α-helix	trans	-62.8	-46.1	173.9	-110.8	118.8	0	0	0	111.4	L477 E478 R483 M484 E485	L477-L481 PolarHBondContact O-N 2.95Å; E478-L481 PolarHBondContact O-N 3.02Å; L481-R483 VanDerWaalsContact C-N 3.26Å; L481-R483 PolarHBondContact O-N 2.83Å; L481-M484 HydrophobicContact CG-CE 4.08Å; L481-M484 PolarHBondContact O-N 2.98Å; L481-M484 VanDerWaalsContact O-N 3.09Å; L481-E485 PolarHBondContact O-N 3.25Å
482	G	80.6	Confident	80.5	Confident	24 Å²	24	115 Å²	115	25%	0.247	60%	0.603	C	S	.	*	H	α-helix	trans	-63.1	-29.1	177.5	0	0	0	0	0	113.7	E478 N486	E478-G482 PolarHBondContact O-N 2.73Å; G482-N486 WeakPolarHBondContact O-CB 3.15Å; G482-N486 PolarHBondContact O-N 3.45Å; G482-N486 PolarHBondContact O-ND2 2.99Å
483	R	77.9	Confident	79.8	Confident	162 Å²	162	116.5 Å²	116.5	61%	0.611	61%	0.614	S	S	*	*	H	α-helix	trans	-73.4	-37.7	172.2	-72.2	175.9	-166.6	-167.1	6.3	112.5	E479 Q480 L481 N486 G487	E479-R483 VanDerWaalsContact O-CG 3.31Å; E479-R483 WeakPolarHBondContact O-CG 3.43Å; E479-R483 PolarHBondContact O-N 3.23Å; E479-R483 VanDerWaalsContact O-N 3.11Å; Q480-R483 PolarHBondContact O-N 3.39Å; L481-R483 VanDerWaalsContact C-N 3.26Å; L481-R483 PolarHBondContact O-N 2.83Å; R483-N486 PolarHBondContact O-N 3.48Å; R483-G487 PolarHBondContact O-N 2.84Å
484	M	74.4	Confident	78.9	Confident	141 Å²	141	114.3 Å²	114.3	70%	0.695	62%	0.617	S	S	*	*	H	α-helix	trans	-68.3	-36.3	175.2	-70.1	-172.6	-62.6	0	0	112.5	Q480 L481	Q480-M484 WeakPolarHBondContact O-CG 2.88Å; Q480-M484 PolarHBondContact O-N 2.8Å; Q480-M484 VanDerWaalsContact O-N 3.11Å; L481-M484 HydrophobicContact CG-CE 4.08Å; L481-M484 PolarHBondContact O-N 2.98Å; L481-M484 VanDerWaalsContact O-N 3.09Å
485	E	73.3	Confident	78	Confident	155 Å²	155	116.2 Å²	116.2	72%	0.724	63%	0.628	S	S	*	*	H	α-helix	trans	-71.9	-29.5	177.3	-73.5	-178	163.6	0	0	113	L481	L481-E485 PolarHBondContact O-N 3.25Å
486	N	73.8	Confident	77	Confident	133 Å²	133	119.8 Å²	119.8	71%	0.711	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	1	178.9	-72	-43.4	0	0	0	114.6	G482 R483	G482-N486 WeakPolarHBondContact O-CB 3.15Å; G482-N486 PolarHBondContact O-N 3.45Å; G482-N486 PolarHBondContact O-ND2 2.99Å; R483-N486 PolarHBondContact O-N 3.48Å
487	G	61	Low	75.9	Confident	62 Å²	62	116.8 Å²	116.8	64%	0.639	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	77.6	16.5	168.8	0	0	0	0	0	116.8	R483	R483-G487 PolarHBondContact O-N 2.84Å
488	D	59.6	Low	74.8	Confident	144 Å²	144	120 Å²	120	77%	0.77	66%	0.664	S	S	*	*			trans	-100.2	86.4	170.5	-78.4	-27.9	0	0	0	109.4
489	A	51.9	Low	73.5	Confident	174 Å²	174	119.5 Å²	119.5	100%	1.438	67%	0.671	S	S	*	*			trans	-93.5	0	166.7	0	0	0	0	0	111

Retrieved 489 of 489 residues in 141.7 ms (Link to these results)

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