A0A5K4F6N1_SCHMA Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F6N1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 772 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	46.5	Very low	61.2	Low	212 Å²	212	129.6 Å²	129.6	100%	1.044	64%	0.644	S	S	*	*				0	111.7	0	-86.4	-167.9	-179.6	0	0	107
2	D	55.4	Low	62.4	Low	130 Å²	130	127.4 Å²	127.4	70%	0.695	63%	0.63	S	S	*	*			trans	-69.6	138.3	-178.6	-89.7	-41.5	0	0	0	111.2	I4 Q5	D2-I4 PolarHBondContact O-N 3.08Å; D2-Q5 PolarHBondContact O-N 3.48Å
3	I	57.8	Low	63.7	Low	130 Å²	130	124.7 Å²	124.7	67%	0.667	62%	0.62	S	S	*	*	H	α-helix	trans	-50	-25.8	-177.7	-69.5	165.7	0	0	0	112.7	Q5 V6 N7	I3-Q5 PolarHBondContact O-N 3.5Å; I3-V6 PolarHBondContact O-N 2.92Å; I3-N7 PolarHBondContact O-N 2.77Å
4	I	57.7	Low	64.9	Low	126 Å²	126	125.7 Å²	125.7	65%	0.646	61%	0.614	S	S	*	*	H	α-helix	trans	-64.4	-38.1	177	-58.4	176.4	0	0	0	111.8	D2 L8	D2-I4 PolarHBondContact O-N 3.08Å; I4-L8 HydrophobicContact CG2-CD1 4.3Å; I4-L8 PolarHBondContact O-N 3.1Å
5	Q	51.9	Low	66	Low	120 Å²	120	126.5 Å²	126.5	56%	0.561	61%	0.613	S	S	*	*	H	α-helix	trans	-68.5	-37	177.9	-83.4	-175.8	-24.1	0	0	112.3	D2 I3 L8 I9	D2-Q5 PolarHBondContact O-N 3.48Å; I3-Q5 PolarHBondContact O-N 3.5Å; Q5-L8 PolarHBondContact O-N 3.24Å; Q5-I9 WeakPolarHBondContact O-CG1 3.32Å; Q5-I9 PolarHBondContact O-N 2.9Å; Q5-I9 VanDerWaalsContact O-N 3.15Å
6	V	61.9	Low	67.2	Low	77 Å²	77	126.5 Å²	126.5	47%	0.467	61%	0.609	S	S	.	*	H	α-helix	trans	-66.5	-42	179.6	179.7	0	0	0	0	110.8	I3 L8 I9 H10	I3-V6 PolarHBondContact O-N 2.92Å; V6-L8 PolarHBondContact O-N 3.17Å; V6-I9 PolarHBondContact O-N 2.88Å; V6-H10 PolarHBondContact O-N 3.43Å
7	N	64	Low	68.2	Low	108 Å²	108	126.6 Å²	126.6	58%	0.578	60%	0.602	S	S	*	*	H	α-helix	trans	-66.5	-35.9	177.8	-78.3	-18.5	0	0	0	112.8	I3 H10 Y11	I3-N7 PolarHBondContact O-N 2.77Å; N7-H10 PolarHBondContact O-N 3.42Å; N7-Y11 WeakPolarHBondContact O-CB 3.32Å; N7-Y11 PolarHBondContact O-N 3.02Å
8	L	62.5	Low	69	Low	115 Å²	115	122.4 Å²	122.4	60%	0.602	58%	0.583	S	S	*	*	H	α-helix	trans	-65.7	-42.4	176	-113.2	123.2	0	0	0	112.1	I4 Q5 V6 H10 Y11 E12	I4-L8 HydrophobicContact CG2-CD1 4.3Å; I4-L8 PolarHBondContact O-N 3.1Å; Q5-L8 PolarHBondContact O-N 3.24Å; V6-L8 PolarHBondContact O-N 3.17Å; L8-H10 VanDerWaalsContact C-N 3.35Å; L8-Y11 PolarHBondContact O-N 2.88Å; L8-E12 WeakPolarHBondContact O-CB 3.38Å; L8-E12 PolarHBondContact O-N 3.44Å
9	I	71.7	Confident	69.7	Low	107 Å²	107	122.4 Å²	122.4	55%	0.549	59%	0.586	S	S	.	*	H	α-helix	trans	-64.8	-41.5	176.4	-65.6	166.8	0	0	0	110.6	Q5 V6 Y11 E12 N13	Q5-I9 WeakPolarHBondContact O-CG1 3.32Å; Q5-I9 PolarHBondContact O-N 2.9Å; Q5-I9 VanDerWaalsContact O-N 3.15Å; V6-I9 PolarHBondContact O-N 2.88Å; I9-Y11 VanDerWaalsContact C-N 3.33Å; I9-Y11 PolarHBondContact O-N 2.92Å; I9-E12 PolarHBondContact O-N 3.39Å; I9-N13 WeakPolarHBondContact O-CB 3.36Å; I9-N13 PolarHBondContact O-N 3.44Å; I9-N13 PolarHBondContact O-ND2 3.49Å
10	H	67.6	Low	70.7	Confident	134 Å²	134	124.8 Å²	124.8	62%	0.62	59%	0.589	S	S	*	*	H	α-helix	trans	-66.5	-37.1	179.9	-137.8	-57.1	0	0	0	112.1	V6 N7 L8 Y14	V6-H10 PolarHBondContact O-N 3.43Å; N7-H10 PolarHBondContact O-N 3.42Å; L8-H10 VanDerWaalsContact C-N 3.35Å; H10-Y14 WeakPolarHBondContact O-CB 3.47Å; H10-Y14 PolarHBondContact O-N 3.27Å
11	Y	76.5	Confident	71.4	Confident	167 Å²	167	124.1 Å²	124.1	66%	0.655	58%	0.581	S	S	*	*	H	α-helix	trans	-70.1	-42.5	177.1	-170	-101.9	0	0	0	112.4	N7 L8 I9 Y14 K15	N7-Y11 WeakPolarHBondContact O-CB 3.32Å; N7-Y11 PolarHBondContact O-N 3.02Å; L8-Y11 PolarHBondContact O-N 2.88Å; I9-Y11 VanDerWaalsContact C-N 3.33Å; I9-Y11 PolarHBondContact O-N 2.92Å; Y11-Y14 PolarHBondContact O-N 3.47Å; Y11-K15 WeakPolarHBondContact O-CB 3.44Å; Y11-K15 PolarHBondContact O-N 3.22Å
12	E	75.8	Confident	73.3	Confident	103 Å²	103	117.8 Å²	117.8	48%	0.481	55%	0.551	S	S	.	*	H	α-helix	trans	-57.9	-46.8	172.4	-89.6	-96.2	143.4	0	0	111.9	L8 I9 K15 K16	L8-E12 WeakPolarHBondContact O-CB 3.38Å; L8-E12 PolarHBondContact O-N 3.44Å; I9-E12 PolarHBondContact O-N 3.39Å; E12-K15 PolarHBondContact O-N 3.4Å; E12-K16 WeakPolarHBondContact O-CG 3.29Å; E12-K16 PolarHBondContact O-N 3.42Å; E12-K16 IonicContact OE2-NZ 2.95Å; E12-K16 PolarHBondContact OE2-NZ 3.47Å
13	N	78.9	Confident	74.6	Confident	92 Å²	92	115.2 Å²	115.2	49%	0.492	54%	0.544	S	S	.	.	H	α-helix	trans	-66.4	-40	179.4	-76.4	-20.7	0	0	0	112.2	I9 K15 K16 W17	I9-N13 WeakPolarHBondContact O-CB 3.36Å; I9-N13 PolarHBondContact O-N 3.44Å; I9-N13 PolarHBondContact O-ND2 3.49Å; N13-K15 VanDerWaalsContact C-N 3.34Å; N13-K15 PolarHBondContact O-N 3.4Å; N13-K16 PolarHBondContact O-N 3.19Å; N13-W17 WeakPolarHBondContact O-CB 3.4Å; N13-W17 PolarHBondContact O-N 3.35Å
14	Y	81.1	Confident	75.8	Confident	139 Å²	139	111 Å²	111	55%	0.545	52%	0.524	S	S	.	.	H	α-helix	trans	-63.2	-41.5	176.3	-172.4	-106.5	0	0	0	111.8	H10 Y11 W17 I18	H10-Y14 WeakPolarHBondContact O-CB 3.47Å; H10-Y14 PolarHBondContact O-N 3.27Å; Y11-Y14 PolarHBondContact O-N 3.47Å; Y14-W17 PolarHBondContact O-N 3.01Å; Y14-I18 HydrophobicContact CD1-CD1 3.81Å; Y14-I18 HydrophobicContact CE1-CD1 3.3Å; Y14-I18 HydrophobicContact CE1-CG1 4.3Å; Y14-I18 PolarHBondContact O-N 3.38Å
15	K	80.1	Confident	77.1	Confident	138 Å²	138	109.6 Å²	109.6	60%	0.6	52%	0.517	S	S	*	.	H	α-helix	trans	-65.2	-41.4	176.8	-161.8	177.6	-178.2	-176.7	0	112	Y11 E12 N13 I18 L19	Y11-K15 WeakPolarHBondContact O-CB 3.44Å; Y11-K15 PolarHBondContact O-N 3.22Å; E12-K15 PolarHBondContact O-N 3.4Å; N13-K15 VanDerWaalsContact C-N 3.34Å; N13-K15 PolarHBondContact O-N 3.4Å; K15-I18 PolarHBondContact O-N 3.15Å; K15-L19 PolarHBondContact O-N 2.99Å; K15-L19 VanDerWaalsContact O-N 3.1Å
16	K	85.3	Confident	78.7	Confident	126 Å²	126	109 Å²	109	55%	0.548	52%	0.517	S	S	.	.	H	α-helix	trans	-63.5	-39.7	174.6	-73.9	175	-173.8	164.3	0	112.1	E12 N13 L19 W20	E12-K16 WeakPolarHBondContact O-CG 3.29Å; E12-K16 PolarHBondContact O-N 3.42Å; E12-K16 IonicContact OE2-NZ 2.95Å; E12-K16 PolarHBondContact OE2-NZ 3.47Å; N13-K16 PolarHBondContact O-N 3.19Å; K16-L19 PolarHBondContact O-N 3.01Å; K16-W20 WeakPolarHBondContact O-CB 3.35Å; K16-W20 PolarHBondContact O-N 3.1Å
17	W	84.2	Confident	79.9	Confident	128 Å²	128	110.6 Å²	110.6	49%	0.485	52%	0.523	S	S	.	.	H	α-helix	trans	-65.5	-43.5	177.7	-176.6	82.6	0	0	0	112.7	N13 Y14 L19 W20 R21	N13-W17 WeakPolarHBondContact O-CB 3.4Å; N13-W17 PolarHBondContact O-N 3.35Å; Y14-W17 PolarHBondContact O-N 3.01Å; W17-L19 VanDerWaalsContact C-N 3.32Å; W17-L19 PolarHBondContact O-N 3.45Å; W17-W20 PolarHBondContact O-N 2.65Å; W17-R21 WeakPolarHBondContact O-CB 3.26Å; W17-R21 PolarHBondContact O-N 2.72Å
18	I	82.4	Confident	80.8	Confident	51 Å²	51	112.1 Å²	112.1	26%	0.262	52%	0.524	S	S	.	.	H	α-helix	trans	-61.5	-43	175.4	-70.8	175.1	0	0	0	110.9	Y14 K15 R21 N22	Y14-I18 HydrophobicContact CD1-CD1 3.81Å; Y14-I18 HydrophobicContact CE1-CD1 3.3Å; Y14-I18 HydrophobicContact CE1-CG1 4.3Å; Y14-I18 PolarHBondContact O-N 3.38Å; K15-I18 PolarHBondContact O-N 3.15Å; I18-R21 PolarHBondContact O-N 2.75Å; I18-N22 WeakPolarHBondContact O-CB 3.23Å; I18-N22 VanDerWaalsContact O-CG 3.28Å; I18-N22 PolarHBondContact O-N 3.2Å
19	L	82.4	Confident	81.8	Confident	123 Å²	123	111 Å²	111	64%	0.644	52%	0.518	S	S	*	.	H	α-helix	trans	-62.1	-46.6	178.7	-147.4	94.1	0	0	0	111	K15 K16 W17 N22 S23	K15-L19 PolarHBondContact O-N 2.99Å; K15-L19 VanDerWaalsContact O-N 3.1Å; K16-L19 PolarHBondContact O-N 3.01Å; W17-L19 VanDerWaalsContact C-N 3.32Å; W17-L19 PolarHBondContact O-N 3.45Å; L19-N22 PolarHBondContact O-N 3.07Å; L19-S23 PolarHBondContact O-N 3.37Å
20	W	89.3	Confident	82.5	Confident	170 Å²	170	110 Å²	110	64%	0.644	51%	0.513	S	S	*	.	H	α-helix	trans	-60	-50.1	177.5	-177.8	79.7	0	0	0	111.6	K16 W17 N22 S23 T24	K16-W20 WeakPolarHBondContact O-CB 3.35Å; K16-W20 PolarHBondContact O-N 3.1Å; W17-W20 PolarHBondContact O-N 2.65Å; W20-N22 VanDerWaalsContact C-N 3.35Å; W20-N22 PolarHBondContact O-N 2.98Å; W20-S23 PolarHBondContact O-N 3.27Å; W20-T24 PolarHBondContact O-N 2.99Å; W20-T24 PolarHBondContact O-OG1 3Å
21	R	86.9	Confident	83.3	Confident	111 Å²	111	106.3 Å²	106.3	42%	0.419	50%	0.501	S	S	.	.	H	α-helix	trans	-57.4	-45.6	179.4	-172	-168.9	75.6	175.8	3.5	112.1	W17 I18 T24 L25	W17-R21 WeakPolarHBondContact O-CB 3.26Å; W17-R21 PolarHBondContact O-N 2.72Å; I18-R21 PolarHBondContact O-N 2.75Å; R21-T24 PolarHBondContact O-N 2.84Å; R21-L25 HydrophobicContact CG-CD1 4.39Å; R21-L25 PolarHBondContact O-N 3.47Å
22	N	86.2	Confident	83.5	Confident	78 Å²	78	101.8 Å²	101.8	42%	0.417	49%	0.492	S	S	.	.	H	α-helix	trans	-69.9	-36.9	-178.9	-69.7	-7.9	0	0	0	111.5	I18 L19 W20 L25 L26	I18-N22 WeakPolarHBondContact O-CB 3.23Å; I18-N22 VanDerWaalsContact O-CG 3.28Å; I18-N22 PolarHBondContact O-N 3.2Å; L19-N22 PolarHBondContact O-N 3.07Å; W20-N22 VanDerWaalsContact C-N 3.35Å; W20-N22 PolarHBondContact O-N 2.98Å; N22-L25 PolarHBondContact O-N 3.4Å; N22-L26 WeakPolarHBondContact O-CB 3.35Å; N22-L26 PolarHBondContact O-N 3.01Å
23	S	83	Confident	83.4	Confident	77 Å²	77	99.7 Å²	99.7	54%	0.538	49%	0.488	S	S	.	.	H	α-helix	trans	-63.9	-38.9	171.2	-83.7	0	0	0	0	112.6	L19 W20 L26 L27	L19-S23 PolarHBondContact O-N 3.37Å; W20-S23 PolarHBondContact O-N 3.27Å; S23-L26 PolarHBondContact O-N 3.19Å; S23-L27 WeakPolarHBondContact O-CB 3.12Å; S23-L27 PolarHBondContact O-N 3.07Å
24	T	83.1	Confident	83.6	Confident	42 Å²	42	99.7 Å²	99.7	26%	0.258	49%	0.487	S	S	.	.	H	α-helix	trans	-66.7	-43.6	177.7	-22.1	0	0	0	0	111.1	W20 R21 L27 F28	W20-T24 PolarHBondContact O-N 2.99Å; W20-T24 PolarHBondContact O-OG1 3Å; R21-T24 PolarHBondContact O-N 2.84Å; T24-L27 WeakPolarHBondContact O-CB 3.03Å; T24-L27 PolarHBondContact O-N 2.78Å; T24-F28 HydrophobicContact CG2-CD2 4.36Å; T24-F28 HydrophobicContact CG2-CE2 4.17Å; T24-F28 VanDerWaalsContact O-CD2 3.29Å; T24-F28 WeakPolarHBondContact O-CD2 3.49Å; T24-F28 PolarHBondContact O-N 3.46Å
25	L	84.1	Confident	83.3	Confident	96 Å²	96	99.4 Å²	99.4	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-60.8	-43.6	175.8	-102.1	150.5	0	0	0	112.2	R21 N22 L27 F28 I29	R21-L25 HydrophobicContact CG-CD1 4.39Å; R21-L25 PolarHBondContact O-N 3.47Å; N22-L25 PolarHBondContact O-N 3.4Å; L25-L27 VanDerWaalsContact C-N 3.34Å; L25-L27 PolarHBondContact O-N 3Å; L25-F28 PolarHBondContact O-N 3.45Å; L25-I29 WeakPolarHBondContact O-CG1 3.02Å; L25-I29 PolarHBondContact O-N 3.46Å
26	L	85.9	Confident	83.2	Confident	106 Å²	106	97.6 Å²	97.6	56%	0.555	49%	0.485	S	S	*	.	H	α-helix	trans	-61.8	-42.3	176.2	-172	71.5	0	0	0	111.5	N22 S23 F28 I29 I30	N22-L26 WeakPolarHBondContact O-CB 3.35Å; N22-L26 PolarHBondContact O-N 3.01Å; S23-L26 PolarHBondContact O-N 3.19Å; L26-F28 PolarHBondContact O-N 2.9Å; L26-I29 PolarHBondContact O-N 3.31Å; L26-I30 HydrophobicContact CG-CD1 4.06Å; L26-I30 VanDerWaalsContact O-CG1 3.3Å; L26-I30 WeakPolarHBondContact O-CG1 3.43Å; L26-I30 PolarHBondContact O-N 3.36Å
27	L	86.6	Confident	82.4	Confident	111 Å²	111	95.1 Å²	95.1	58%	0.581	48%	0.483	S	S	*	.	H	α-helix	trans	-61	-44	176.4	-163.8	84.6	0	0	0	111.6	S23 T24 L25 I29 I30 C31	S23-L27 WeakPolarHBondContact O-CB 3.12Å; S23-L27 PolarHBondContact O-N 3.07Å; T24-L27 WeakPolarHBondContact O-CB 3.03Å; T24-L27 PolarHBondContact O-N 2.78Å; L25-L27 VanDerWaalsContact C-N 3.34Å; L25-L27 PolarHBondContact O-N 3Å; L27-I29 PolarHBondContact O-N 3.36Å; L27-I30 PolarHBondContact O-N 2.92Å; L27-C31 PolarHBondContact O-N 3.02Å; L27-C31 PolarHBondContact O-SG 3.11Å; L27-C31 VanDerWaalsContact O-SG 3.36Å
28	F	82.7	Confident	81.8	Confident	140 Å²	140	92.9 Å²	92.9	61%	0.614	48%	0.48	S	S	*	.	H	α-helix	trans	-61.1	-43.5	176.1	-89.7	-70.8	0	0	0	112.2	T24 L25 L26 I30 C31 T32	T24-F28 HydrophobicContact CG2-CD2 4.36Å; T24-F28 HydrophobicContact CG2-CE2 4.17Å; T24-F28 VanDerWaalsContact O-CD2 3.29Å; T24-F28 WeakPolarHBondContact O-CD2 3.49Å; T24-F28 PolarHBondContact O-N 3.46Å; L25-F28 PolarHBondContact O-N 3.45Å; L26-F28 PolarHBondContact O-N 2.9Å; F28-I30 PolarHBondContact O-N 3.45Å; F28-C31 PolarHBondContact O-N 3.41Å; F28-T32 WeakPolarHBondContact O-CG2 3.3Å; F28-T32 PolarHBondContact O-N 3.39Å; F28-T32 PolarHBondContact O-OG1 3.06Å
29	I	84.7	Confident	80.9	Confident	93 Å²	93	94.9 Å²	94.9	48%	0.477	49%	0.491	S	S	.	.	H	α-helix	trans	-62.1	-45.4	177.4	-67.1	165.7	0	0	0	110.3	L25 L26 L27 C31 T32 S33	L25-I29 WeakPolarHBondContact O-CG1 3.02Å; L25-I29 PolarHBondContact O-N 3.46Å; L26-I29 PolarHBondContact O-N 3.31Å; L27-I29 PolarHBondContact O-N 3.36Å; I29-C31 PolarHBondContact O-N 2.83Å; I29-T32 PolarHBondContact O-N 2.96Å; I29-T32 PolarHBondContact O-OG1 3.33Å; I29-S33 WeakPolarHBondContact O-CB 3.45Å; I29-S33 PolarHBondContact O-N 3.02Å; I29-S33 PolarHBondContact O-OG 3.43Å
30	I	85.8	Confident	80.2	Confident	86 Å²	86	94.2 Å²	94.2	44%	0.441	49%	0.488	S	S	.	.	H	α-helix	trans	-60.6	-47	176.8	-67.2	166.3	0	0	0	110.8	L26 L27 F28 T32 S33 I34	L26-I30 HydrophobicContact CG-CD1 4.06Å; L26-I30 VanDerWaalsContact O-CG1 3.3Å; L26-I30 WeakPolarHBondContact O-CG1 3.43Å; L26-I30 PolarHBondContact O-N 3.36Å; L27-I30 PolarHBondContact O-N 2.92Å; F28-I30 PolarHBondContact O-N 3.45Å; I30-T32 PolarHBondContact O-N 3.36Å; I30-S33 WeakPolarHBondContact O-CB 3.42Å; I30-S33 PolarHBondContact O-N 3.1Å; I30-I34 HydrophobicContact CG2-CD1 3.84Å; I30-I34 VanDerWaalsContact O-CG1 3.32Å; I30-I34 WeakPolarHBondContact O-CG1 3.5Å; I30-I34 PolarHBondContact O-N 2.5Å
31	C	83.7	Confident	79.1	Confident	55 Å²	55	93.2 Å²	93.2	37%	0.372	49%	0.485	S	S	.	.	H	α-helix	trans	-60	-46.9	177.8	-72	0	0	0	0	112.4	L27 F28 I29 S33 I34 F35	L27-C31 PolarHBondContact O-N 3.02Å; L27-C31 PolarHBondContact O-SG 3.11Å; L27-C31 VanDerWaalsContact O-SG 3.36Å; F28-C31 PolarHBondContact O-N 3.41Å; I29-C31 PolarHBondContact O-N 2.83Å; C31-S33 VanDerWaalsContact C-N 3.29Å; C31-S33 PolarHBondContact O-N 3.36Å; C31-I34 PolarHBondContact O-N 3.16Å; C31-F35 WeakPolarHBondContact O-CD2 3.35Å; C31-F35 PolarHBondContact O-N 2.85Å
32	T	80.9	Confident	77.5	Confident	73 Å²	73	92.4 Å²	92.4	45%	0.448	49%	0.488	S	S	.	.	H	α-helix	trans	-62.8	-36.7	177.9	55.4	0	0	0	0	112.4	F28 I29 I30 I34 F35 I36	F28-T32 WeakPolarHBondContact O-CG2 3.3Å; F28-T32 PolarHBondContact O-N 3.39Å; F28-T32 PolarHBondContact O-OG1 3.06Å; I29-T32 PolarHBondContact O-N 2.96Å; I29-T32 PolarHBondContact O-OG1 3.33Å; I30-T32 PolarHBondContact O-N 3.36Å; T32-I34 VanDerWaalsContact C-N 3.35Å; T32-F35 PolarHBondContact O-N 3.49Å; T32-I36 VanDerWaalsContact O-CG1 3.28Å; T32-I36 WeakPolarHBondContact O-CG1 3.24Å; T32-I36 PolarHBondContact O-N 3.48Å
33	S	74.3	Confident	75.8	Confident	58 Å²	58	95.6 Å²	95.6	41%	0.406	50%	0.502	S	S	.	.	H	α-helix	trans	-65.6	-38.9	176.7	-52	0	0	0	0	111.6	I29 I30 C31 S37	I29-S33 WeakPolarHBondContact O-CB 3.45Å; I29-S33 PolarHBondContact O-N 3.02Å; I29-S33 PolarHBondContact O-OG 3.43Å; I30-S33 WeakPolarHBondContact O-CB 3.42Å; I30-S33 PolarHBondContact O-N 3.1Å; C31-S33 VanDerWaalsContact C-N 3.29Å; C31-S33 PolarHBondContact O-N 3.36Å; S33-S37 WeakPolarHBondContact O-CB 3.36Å; S33-S37 PolarHBondContact O-N 3.31Å; S33-S37 PolarHBondContact O-OG 3.21Å
34	I	82.9	Confident	74.3	Confident	92 Å²	92	96.7 Å²	96.7	47%	0.472	51%	0.51	S	S	.	.	H	α-helix	trans	-65.1	-46.1	175.1	-67.9	166.2	0	0	0	110.7	I30 C31 T32 S37 I38	I30-I34 HydrophobicContact CG2-CD1 3.84Å; I30-I34 VanDerWaalsContact O-CG1 3.32Å; I30-I34 WeakPolarHBondContact O-CG1 3.5Å; I30-I34 PolarHBondContact O-N 2.5Å; C31-I34 PolarHBondContact O-N 3.16Å; T32-I34 VanDerWaalsContact C-N 3.35Å; I34-S37 PolarHBondContact O-N 3.36Å; I34-I38 HydrophobicContact CG2-CD1 3.73Å; I34-I38 HydrophobicContact CG2-CG1 4.36Å; I34-I38 VanDerWaalsContact O-CG1 3.3Å; I34-I38 WeakPolarHBondContact O-CG1 3.5Å; I34-I38 PolarHBondContact O-N 3.17Å
35	F	74.9	Confident	72.5	Confident	133 Å²	133	99.7 Å²	99.7	58%	0.583	52%	0.524	S	S	*	.	H	α-helix	trans	-60.7	-47.2	177.8	-81.4	-70.4	0	0	0	112.3	C31 T32 S37 I38 D39	C31-F35 WeakPolarHBondContact O-CD2 3.35Å; C31-F35 PolarHBondContact O-N 2.85Å; T32-F35 PolarHBondContact O-N 3.49Å; F35-S37 VanDerWaalsContact C-N 3.25Å; F35-S37 PolarHBondContact O-N 3.02Å; F35-I38 PolarHBondContact O-N 3.3Å; F35-I38 VanDerWaalsContact O-N 3.17Å; F35-D39 PolarHBondContact O-N 3.39Å
36	I	76.9	Confident	70.2	Confident	100 Å²	100	96.5 Å²	96.5	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-60.7	-38.6	177.1	-66.3	165.9	0	0	0	110.8	T32 D39 L40	T32-I36 VanDerWaalsContact O-CG1 3.28Å; T32-I36 WeakPolarHBondContact O-CG1 3.24Å; T32-I36 PolarHBondContact O-N 3.48Å; I36-D39 PolarHBondContact O-N 3.27Å; I36-L40 HydrophobicContact CG2-CD1 3.93Å; I36-L40 HydrophobicContact CG2-CG 4.48Å; I36-L40 WeakPolarHBondContact O-CB 3.44Å; I36-L40 VanDerWaalsContact O-CG 3.29Å; I36-L40 WeakPolarHBondContact O-CG 3.34Å; I36-L40 PolarHBondContact O-N 3.14Å
37	S	69.6	Low	67.7	Low	74 Å²	74	99.4 Å²	99.4	52%	0.517	53%	0.531	S	S	.	.	H	α-helix	trans	-68.8	-37.6	177.7	-58.1	0	0	0	0	112.4	S33 I34 F35 Y41	S33-S37 WeakPolarHBondContact O-CB 3.36Å; S33-S37 PolarHBondContact O-N 3.31Å; S33-S37 PolarHBondContact O-OG 3.21Å; I34-S37 PolarHBondContact O-N 3.36Å; F35-S37 VanDerWaalsContact C-N 3.25Å; F35-S37 PolarHBondContact O-N 3.02Å; S37-Y41 VanDerWaalsContact O-CB 3.28Å; S37-Y41 WeakPolarHBondContact O-CB 3.46Å; S37-Y41 PolarHBondContact O-N 3.2Å
38	I	71.5	Confident	65.2	Low	81 Å²	81	102.9 Å²	102.9	42%	0.415	54%	0.537	S	S	.	.	H	α-helix	trans	-65	-46.3	174.5	-70.5	167.2	0	0	0	110.2	I34 F35 L40 Y41 I42	I34-I38 HydrophobicContact CG2-CD1 3.73Å; I34-I38 HydrophobicContact CG2-CG1 4.36Å; I34-I38 VanDerWaalsContact O-CG1 3.3Å; I34-I38 WeakPolarHBondContact O-CG1 3.5Å; I34-I38 PolarHBondContact O-N 3.17Å; F35-I38 PolarHBondContact O-N 3.3Å; F35-I38 VanDerWaalsContact O-N 3.17Å; I38-L40 PolarHBondContact O-N 2.73Å; I38-Y41 PolarHBondContact O-N 2.94Å; I38-I42 HydrophobicContact CG2-CD1 3.68Å; I38-I42 HydrophobicContact CG2-CG1 4.34Å; I38-I42 VanDerWaalsContact O-CG1 3.27Å; I38-I42 WeakPolarHBondContact O-CG1 3.33Å; I38-I42 PolarHBondContact O-N 3.05Å
39	D	63.9	Low	62.5	Low	93 Å²	93	104 Å²	104	50%	0.497	55%	0.55	S	S	.	.	H	α-helix	trans	-62.5	-43.8	178.8	-70.7	-23.2	0	0	0	111.3	F35 I36 Y41 I42 M43	F35-D39 PolarHBondContact O-N 3.39Å; I36-D39 PolarHBondContact O-N 3.27Å; D39-Y41 PolarHBondContact O-N 3.22Å; D39-I42 PolarHBondContact O-N 3.12Å; D39-M43 WeakPolarHBondContact O-CB 3.26Å; D39-M43 WeakPolarHBondContact O-CG 3.29Å; D39-M43 PolarHBondContact O-N 2.9Å
40	L	66.8	Low	59.9	Low	110 Å²	110	106.1 Å²	106.1	58%	0.576	56%	0.561	S	S	*	*	H	α-helix	trans	-64	-38.1	174.6	-74.6	170.2	0	0	0	112.4	I36 I38 M43 S44	I36-L40 HydrophobicContact CG2-CD1 3.93Å; I36-L40 HydrophobicContact CG2-CG 4.48Å; I36-L40 WeakPolarHBondContact O-CB 3.44Å; I36-L40 VanDerWaalsContact O-CG 3.29Å; I36-L40 WeakPolarHBondContact O-CG 3.34Å; I36-L40 PolarHBondContact O-N 3.14Å; I38-L40 PolarHBondContact O-N 2.73Å; L40-M43 PolarHBondContact O-N 3.43Å; L40-S44 VanDerWaalsContact O-CB 3.23Å; L40-S44 WeakPolarHBondContact O-CB 3.38Å; L40-S44 PolarHBondContact O-N 2.85Å
41	Y	65.9	Low	57.1	Low	148 Å²	148	108.4 Å²	108.4	58%	0.58	58%	0.575	S	S	*	*	H	α-helix	trans	-67.4	-41.8	175.7	-177.2	-98.8	0	0	0	111.8	S37 I38 D39 M43 S44 N45	S37-Y41 VanDerWaalsContact O-CB 3.28Å; S37-Y41 WeakPolarHBondContact O-CB 3.46Å; S37-Y41 PolarHBondContact O-N 3.2Å; I38-Y41 PolarHBondContact O-N 2.94Å; D39-Y41 PolarHBondContact O-N 3.22Å; Y41-M43 VanDerWaalsContact C-N 3.33Å; Y41-M43 PolarHBondContact O-N 2.86Å; Y41-S44 PolarHBondContact O-N 3.07Å; Y41-N45 WeakPolarHBondContact O-CB 3.5Å; Y41-N45 PolarHBondContact O-N 3.39Å; Y41-N45 PolarHBondContact OH-ND2 3.5Å
42	I	55.1	Low	54.5	Low	95 Å²	95	116.3 Å²	116.3	49%	0.487	60%	0.597	S	S	.	*	H	α-helix	trans	-62.7	-42.5	175.1	-69.1	167.9	0	0	0	110.3	I38 D39 G46	I38-I42 HydrophobicContact CG2-CD1 3.68Å; I38-I42 HydrophobicContact CG2-CG1 4.34Å; I38-I42 VanDerWaalsContact O-CG1 3.27Å; I38-I42 WeakPolarHBondContact O-CG1 3.33Å; I38-I42 PolarHBondContact O-N 3.05Å; D39-I42 PolarHBondContact O-N 3.12Å; I42-G46 PolarHBondContact O-N 3.33Å
43	M	50.5	Low	51.8	Low	145 Å²	145	119 Å²	119	71%	0.714	61%	0.608	S	S	*	*	H	α-helix	trans	-66.9	-36	175.7	-73.7	-171.7	71.6	0	0	112.7	D39 L40 Y41	D39-M43 WeakPolarHBondContact O-CB 3.26Å; D39-M43 WeakPolarHBondContact O-CG 3.29Å; D39-M43 PolarHBondContact O-N 2.9Å; L40-M43 PolarHBondContact O-N 3.43Å; Y41-M43 VanDerWaalsContact C-N 3.33Å; Y41-M43 PolarHBondContact O-N 2.86Å
44	S	51	Low	49.5	Very low	100 Å²	100	123.8 Å²	123.8	70%	0.699	63%	0.629	S	S	*	*	H	α-helix	trans	-75.4	-33.7	-179.9	174	0	0	0	0	113.5	L40 Y41	L40-S44 VanDerWaalsContact O-CB 3.23Å; L40-S44 WeakPolarHBondContact O-CB 3.38Å; L40-S44 PolarHBondContact O-N 2.85Å; Y41-S44 PolarHBondContact O-N 3.07Å
45	N	45.7	Very low	46.8	Very low	105 Å²	105	128.3 Å²	128.3	56%	0.561	65%	0.648	S	S	*	*	H	α-helix	trans	-99.2	-15	-174.4	-139	10.9	0	0	0	112.5	Y41 N47	Y41-N45 WeakPolarHBondContact O-CB 3.5Å; Y41-N45 PolarHBondContact O-N 3.39Å; Y41-N45 PolarHBondContact OH-ND2 3.5Å; N45-N47 PolarHBondContact O-N 3.38Å
46	G	35.5	Very low	44.5	Very low	29 Å²	29	128 Å²	128	30%	0.299	66%	0.663	S	S	.	*	S	Bend	trans	-75	113.2	172.2	0	0	0	0	0	110.4	I42 Y48	I42-G46 PolarHBondContact O-N 3.33Å; G46-Y48 WeakPolarHBondContact O-CD2 3.32Å; G46-Y48 PolarHBondContact O-N 3.05Å
47	N	32.4	Very low	42.2	Very low	167 Å²	167	127.8 Å²	127.8	89%	0.893	67%	0.67	S	S	*	*			trans	-56.4	59.3	167.7	-81.1	-33.6	0	0	0	113.1	N45 N49	N45-N47 PolarHBondContact O-N 3.38Å; N47-N49 VanDerWaalsContact C-N 3.33Å; N47-N49 PolarHBondContact O-N 3.31Å; N47-N49 VanDerWaalsContact O-N 3.11Å
48	Y	34.6	Very low	40.1	Very low	183 Å²	183	131.8 Å²	131.8	72%	0.718	68%	0.684	S	S	*	*			trans	-84.5	82.4	171.5	-69.4	-75.5	0	0	0	108.3	G46 L50	G46-Y48 WeakPolarHBondContact O-CD2 3.32Å; G46-Y48 PolarHBondContact O-N 3.05Å; Y48-L50 PolarHBondContact O-N 3.45Å
49	N	26.8	Very low	38	Very low	163 Å²	163	136 Å²	136	87%	0.872	71%	0.706	S	S	*	*			trans	-64	87.8	162.9	-101	-20.1	0	0	0	108.4	N47 N51	N47-N49 VanDerWaalsContact C-N 3.33Å; N47-N49 PolarHBondContact O-N 3.31Å; N47-N49 VanDerWaalsContact O-N 3.11Å; N49-N51 PolarHBondContact O-N 3.02Å
50	L	29.2	Very low	36.2	Very low	138 Å²	138	138 Å²	138	72%	0.723	72%	0.716	S	S	*	*			trans	-67.9	86.6	166.8	-95.9	134.9	0	0	0	108.3	Y48 W52	Y48-L50 PolarHBondContact O-N 3.45Å; L50-W52 VanDerWaalsContact C-N 3.3Å; L50-W52 PolarHBondContact O-N 3.12Å
51	N	26.8	Very low	34.3	Very low	135 Å²	135	142.8 Å²	142.8	72%	0.722	73%	0.733	S	S	*	*			trans	-71.4	82.9	178.1	-163.3	7.4	0	0	0	110.2	N49 N53	N49-N51 PolarHBondContact O-N 3.02Å; N51-N53 PolarHBondContact O-N 3.5Å
52	W	28.6	Very low	32.4	Very low	221 Å²	221	146.8 Å²	146.8	84%	0.837	75%	0.747	S	S	*	*			trans	-77.1	70.3	168	-82.8	86.3	0	0	0	109.9	L50	L50-W52 VanDerWaalsContact C-N 3.3Å; L50-W52 PolarHBondContact O-N 3.12Å
53	N	25.5	Very low	31.1	Very low	128 Å²	128	146 Å²	146	68%	0.684	75%	0.746	S	S	*	*			trans	-149.7	90.1	170.5	-86.5	-34.9	0	0	0	109.8	N51	N51-N53 PolarHBondContact O-N 3.5Å
54	N	25.2	Very low	30.1	Very low	159 Å²	159	145.6 Å²	145.6	85%	0.85	75%	0.746	S	S	*	*			trans	-172.7	100.5	143.2	-96.3	-14.8	0	0	0	108.7
55	E	27.5	Very low	29.2	Very low	187 Å²	187	149.2 Å²	149.2	87%	0.874	75%	0.749	S	S	*	*				162.4	84.7	124.2	-86.7	-178.1	179.6	0	0	109.5	S57	E55-S57 PolarHBondContact O-N 3.4Å
56	S	25.3	Very low	28.5	Very low	126 Å²	126	149.1 Å²	149.1	88%	0.881	75%	0.748	S	S	*	*			trans	-75.7	100.9	161.9	40.8	0	0	0	0	109.4
57	S	28.5	Very low	28.4	Very low	97 Å²	97	152.4 Å²	152.4	68%	0.678	76%	0.758	S	S	*	*			trans	-145.7	87.4	154.3	60.1	0	0	0	0	111.5	E55 I59	E55-S57 PolarHBondContact O-N 3.4Å; S57-I59 PolarHBondContact O-N 2.88Å
58	I	25.2	Very low	28.3	Very low	158 Å²	158	149.9 Å²	149.9	81%	0.81	74%	0.744	S	S	*	*			trans	17.1	91.8	138.7	-49.9	172.5	0	0	0	114.7
59	I	27.3	Very low	28.2	Very low	169 Å²	169	148.6 Å²	148.6	87%	0.867	74%	0.744	S	S	*	*			trans	-116.9	111.2	151.7	-64.4	-178.9	0	0	0	107.8	S57	S57-I59 PolarHBondContact O-N 2.88Å
60	N	26.1	Very low	28.4	Very low	134 Å²	134	149.1 Å²	149.1	72%	0.717	74%	0.738	S	S	*	*			trans	-49.6	140.2	-173.8	-95	-45.8	0	0	0	114.5	R62	N60-R62 VanDerWaalsContact C-N 3.35Å; N60-R62 PolarHBondContact O-N 3.01Å
61	K	28.2	Very low	28.6	Very low	211 Å²	211	148.9 Å²	148.9	92%	0.917	73%	0.734	S	S	*	*	S	Bend	trans	-48.9	89.4	160.5	-78.6	174.2	170.4	174	0	111.8
62	R	24.9	Very low	28.8	Very low	232 Å²	232	150.9 Å²	150.9	88%	0.875	74%	0.736	S	S	*	*			trans	-168.9	96.1	154.8	-99.7	171.5	-167.3	173.5	3.6	102.1	N60	N60-R62 VanDerWaalsContact C-N 3.35Å; N60-R62 PolarHBondContact O-N 3.01Å
63	T	28.6	Very low	28.9	Very low	78 Å²	78	147.4 Å²	147.4	48%	0.479	73%	0.734	S	S	.	*				-176.9	68.8	88.3	-47	0	0	0	0	108.6	K65 N66	T63-K65 PolarHBondContact O-N 3.02Å; T63-N66 HydrophobicContact CG2-CB 3.59Å; T63-N66 PolarHBondContact O-N 3.16Å
64	I	29.9	Very low	29	Very low	137 Å²	137	150.1 Å²	150.1	70%	0.703	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-17.1	173	-69.2	177.1	0	0	0	111.1	N66	I64-N66 PolarHBondContact O-N 3.11Å
65	K	30.6	Very low	29.1	Very low	177 Å²	177	150.5 Å²	150.5	77%	0.77	74%	0.736	S	S	*	*	H	α-helix	trans	-73.8	-20.1	175.5	-147.9	173.1	-178.1	-178.3	0	114.5	T63	T63-K65 PolarHBondContact O-N 3.02Å
66	N	32.5	Very low	29	Very low	102 Å²	102	148.7 Å²	148.7	55%	0.545	73%	0.733	S	S	.	*	H	α-helix	trans	-93.8	-7.7	178.6	-74.3	9.6	0	0	0	113.8	T63 I64	T63-N66 HydrophobicContact CG2-CB 3.59Å; T63-N66 PolarHBondContact O-N 3.16Å; I64-N66 PolarHBondContact O-N 3.11Å
67	I	32.8	Very low	28.9	Very low	99 Å²	99	148.3 Å²	148.3	51%	0.508	73%	0.73	S	S	.	*	H	α-helix	trans	-84.1	-36.6	173.4	-62	177.2	0	0	0	109.7	E69 K70 E71	I67-E69 VanDerWaalsContact C-N 3.34Å; I67-E69 PolarHBondContact O-N 2.82Å; I67-K70 PolarHBondContact O-N 3.23Å; I67-K70 VanDerWaalsContact O-N 3.13Å; I67-E71 PolarHBondContact O-N 3.07Å
68	I	31	Very low	28.6	Very low	114 Å²	114	148.5 Å²	148.5	59%	0.585	73%	0.726	S	S	*	*	H	α-helix	trans	-70.2	-28.5	-179.1	-60	176.1	0	0	0	112.5
69	E	31.2	Very low	28.4	Very low	156 Å²	156	146.4 Å²	146.4	73%	0.729	72%	0.721	S	S	*	*	H	α-helix	trans	-84.4	-15.6	171.8	-89.4	-179.2	171	0	0	114.2	I67	I67-E69 VanDerWaalsContact C-N 3.34Å; I67-E69 PolarHBondContact O-N 2.82Å
70	K	32.7	Very low	28.3	Very low	173 Å²	173	145.3 Å²	145.3	75%	0.752	72%	0.717	S	S	*	*	H	α-helix	trans	-91.2	-16.2	172.9	-94.9	-174.9	174.6	179.9	0	114.3	I67	I67-K70 PolarHBondContact O-N 3.23Å; I67-K70 VanDerWaalsContact O-N 3.13Å
71	E	32.2	Very low	28.1	Very low	133 Å²	133	144.4 Å²	144.4	62%	0.621	71%	0.711	S	S	*	*	H	α-helix	trans	-87.7	-16.1	175.4	-79.2	-174.9	152.6	0	0	114.4	I67 N73 K74	I67-E71 PolarHBondContact O-N 3.07Å; E71-N73 PolarHBondContact O-N 3.01Å; E71-K74 PolarHBondContact O-N 2.92Å
72	K	30.8	Very low	27.8	Very low	178 Å²	178	142.4 Å²	142.4	77%	0.774	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-9	170.7	-87.3	-171.4	174	-177.2	0	115.1
73	N	31.6	Very low	27.8	Very low	147 Å²	147	137.1 Å²	137.1	79%	0.786	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	20.7	174.7	-76.9	-12.8	0	0	0	113.5	E71	E71-N73 PolarHBondContact O-N 3.01Å
74	K	27.5	Very low	27.6	Very low	185 Å²	185	138.2 Å²	138.2	80%	0.804	70%	0.699	S	S	*	*	S	Bend	trans	-124.8	17.1	176.3	-103.2	-173.2	178.3	-176.1	0	115.5	E71	E71-K74 PolarHBondContact O-N 2.92Å
75	E	26.7	Very low	27.4	Very low	168 Å²	168	137.6 Å²	137.6	79%	0.785	69%	0.693	S	S	*	*	S	Bend	trans	-102.6	129.1	156.8	-71.4	-177.2	168.9	0	0	107.5
76	N	24.8	Very low	27.1	Very low	149 Å²	149	137.5 Å²	137.5	80%	0.797	70%	0.7	S	S	*	*			trans	96	47.6	-171	-50.7	-19.6	0	0	0	115.5	V78	N76-V78 HydrophobicContact CB-CG2 4.25Å; N76-V78 PolarHBondContact O-N 3.11Å
77	S	23.1	Very low	26.9	Very low	117 Å²	117	139.7 Å²	139.7	82%	0.818	71%	0.71	S	S	*	*			trans	-72.8	70.8	139.8	67.6	0	0	0	0	108.3	V79	S77-V79 PolarHBondContact O-N 3.41Å
78	V	22.7	Very low	26.4	Very low	101 Å²	101	143.2 Å²	143.2	61%	0.612	72%	0.724	S	S	*	*			trans	-55.2	120.1	153.4	174	0	0	0	0	104.5	N76 D80	N76-V78 HydrophobicContact CB-CG2 4.25Å; N76-V78 PolarHBondContact O-N 3.11Å; V78-D80 VanDerWaalsContact C-N 3.3Å; V78-D80 PolarHBondContact O-N 3.22Å
79	V	22.3	Very low	26	Very low	115 Å²	115	147.4 Å²	147.4	70%	0.697	73%	0.732	S	S	*	*			trans	-57.6	99.9	173.2	172.5	0	0	0	0	106.3	S77 I81	S77-V79 PolarHBondContact O-N 3.41Å; V79-I81 PolarHBondContact O-N 3.48Å
80	D	23.2	Very low	25.6	Very low	145 Å²	145	146.7 Å²	146.7	78%	0.775	73%	0.734	S	S	*	*			trans	-62.7	105.7	175.6	-91.5	-32.4	0	0	0	108.2	V78 M82	V78-D80 VanDerWaalsContact C-N 3.3Å; V78-D80 PolarHBondContact O-N 3.22Å; D80-M82 PolarHBondContact O-N 3.37Å; D80-M82 VanDerWaalsContact O-N 3.11Å
81	I	22.7	Very low	25.3	Very low	116 Å²	116	144.8 Å²	144.8	60%	0.595	73%	0.73	S	S	*	*			trans	-54.2	107.7	176.3	-67.3	162.1	0	0	0	108.2	V79 H112	V79-I81 PolarHBondContact O-N 3.48Å; I81-H112 VanDerWaalsContact CG2-CE1 3.47Å; I81-H112 WeakPolarHBondContact CG2-CE1 3.02Å
82	M	23.1	Very low	24.9	Very low	168 Å²	168	146.2 Å²	146.2	83%	0.828	74%	0.737	S	S	*	*			trans	-80.4	124.7	178.5	-75.9	-168.9	121.4	0	0	111.3	D80	D80-M82 PolarHBondContact O-N 3.37Å; D80-M82 VanDerWaalsContact O-N 3.11Å
83	N	23.8	Very low	24.8	Very low	122 Å²	122	144.5 Å²	144.5	65%	0.652	74%	0.736	S	S	*	*			trans	-57.8	119.2	-177.1	-72.5	-23	0	0	0	116.1
84	D	25.4	Very low	24.5	Very low	100 Å²	100	145.8 Å²	145.8	54%	0.535	74%	0.737	S	S	.	*				16.8	112.9	129.1	-56.6	-23.4	0	0	0	119
85	Q	24.9	Very low	24.5	Very low	125 Å²	125	145.7 Å²	145.7	58%	0.584	74%	0.739	S	S	*	*			trans	-139.7	136.2	162	-69.7	-171.6	-15.8	0	0	112.8
86	L	24.8	Very low	24.5	Very low	174 Å²	174	145.4 Å²	145.4	91%	0.911	74%	0.737	S	S	*	*			trans	-78.2	151.2	-165.3	-87.2	77.6	0	0	0	115.2
87	I	27.9	Very low	24.6	Very low	148 Å²	148	146.1 Å²	146.1	76%	0.759	74%	0.736	S	S	*	*			trans	-118.5	137.1	173.6	-61.6	171.7	0	0	0	109.4
88	H	21.6	Very low	24.8	Very low	173 Å²	173	147.6 Å²	147.6	80%	0.801	73%	0.734	S	S	*	*			trans	-117.5	133.1	178.6	-155.6	-68.8	0	0	0	110.3
89	W	24	Very low	25.1	Very low	202 Å²	202	149.4 Å²	149.4	77%	0.765	74%	0.741	S	S	*	*			trans	-94.8	140	174.6	-67.5	77.5	0	0	0	109.7
90	N	22.7	Very low	25.3	Very low	142 Å²	142	151 Å²	151	76%	0.759	75%	0.745	S	S	*	*			trans	-116.9	103.3	169.2	-108.5	-4.3	0	0	0	107.6
91	I	26.3	Very low	25.5	Very low	132 Å²	132	151.4 Å²	151.4	68%	0.677	75%	0.747	S	S	*	*			trans	-90.3	111.4	164.6	-62.2	173.5	0	0	0	105.5	D93	I91-D93 VanDerWaalsContact C-N 3.29Å; I91-D93 PolarHBondContact O-N 3.31Å; I91-D93 VanDerWaalsContact O-N 3.12Å
92	H	23.8	Very low	25.7	Very low	164 Å²	164	154.3 Å²	154.3	76%	0.759	76%	0.758	S	S	*	*			trans	-78.7	83.5	168.5	-94.6	13.5	0	0	0	108.4	H94	H92-H94 PolarHBondContact O-N 3.19Å
93	D	27.9	Very low	25.7	Very low	141 Å²	141	156.3 Å²	156.3	75%	0.754	76%	0.762	S	S	*	*			trans	-82	102.3	160	-82	-27.4	0	0	0	108.1	I91 H95	I91-D93 VanDerWaalsContact C-N 3.29Å; I91-D93 PolarHBondContact O-N 3.31Å; I91-D93 VanDerWaalsContact O-N 3.12Å; D93-H95 VanDerWaalsContact C-N 3.26Å; D93-H95 PolarHBondContact O-N 3.02Å
94	H	25.4	Very low	25.7	Very low	175 Å²	175	159.3 Å²	159.3	81%	0.81	77%	0.774	S	S	*	*			trans	-67.4	88.5	160.8	-90.6	-35.3	0	0	0	108.2	H92	H92-H94 PolarHBondContact O-N 3.19Å
95	H	28.1	Very low	25.6	Very low	183 Å²	183	162.1 Å²	162.1	85%	0.847	79%	0.789	S	S	*	*			trans	-155.7	139.2	148.3	-96.7	-58.3	0	0	0	112.2	D93	D93-H95 VanDerWaalsContact C-N 3.26Å; D93-H95 PolarHBondContact O-N 3.02Å
96	H	25.8	Very low	25.5	Very low	161 Å²	161	159.6 Å²	159.6	75%	0.745	80%	0.797	S	S	*	*			trans	-57.5	153.7	-171.4	-90.7	-90.8	0	0	0	116.1
97	H	26.8	Very low	25.4	Very low	165 Å²	165	157.5 Å²	157.5	76%	0.764	79%	0.792	S	S	*	*			trans	51	109.6	151.8	-73.8	-65.7	0	0	0	117.6
98	N	27.1	Very low	25.3	Very low	148 Å²	148	158.6 Å²	158.6	79%	0.791	80%	0.798	S	S	*	*				176.7	148.9	85.4	-126.2	-23	0	0	0	110.6	N100	N98-N100 PolarHBondContact O-N 2.89Å
99	N	28.7	Very low	25.5	Very low	139 Å²	139	157.4 Å²	157.4	74%	0.743	80%	0.796	S	S	*	*			trans	-48.4	130.1	168.4	-77.5	-36.7	0	0	0	111.5
100	N	27.4	Very low	25.6	Very low	148 Å²	148	156.9 Å²	156.9	79%	0.791	79%	0.794	S	S	*	*				-177.3	139.4	116.9	-89.5	-25.5	0	0	0	112.6	N98 H102	N98-N100 PolarHBondContact O-N 2.89Å; N100-H102 PolarHBondContact O-N 3.32Å; N100-H102 VanDerWaalsContact O-N 3.17Å
101	N	28.1	Very low	25.7	Very low	153 Å²	153	154.5 Å²	154.5	82%	0.818	79%	0.788	S	S	*	*			trans	-59.3	104.5	-178.5	-68.2	-49.5	0	0	0	112.6
102	H	26.3	Very low	25.9	Very low	178 Å²	178	153.6 Å²	153.6	82%	0.824	78%	0.781	S	S	*	*			trans	-129.8	84.7	154.8	-78.5	-62.1	0	0	0	109.8	N100 M104	N100-H102 PolarHBondContact O-N 3.32Å; N100-H102 VanDerWaalsContact O-N 3.17Å; H102-M104 PolarHBondContact O-N 3.2Å
103	K	23.4	Very low	26	Very low	209 Å²	209	155.8 Å²	155.8	91%	0.909	78%	0.784	S	S	*	*			trans	-59.9	95.2	159.5	-88.8	176.7	169.6	175.2	0	108
104	M	23	Very low	25.8	Very low	185 Å²	185	154.1 Å²	154.1	91%	0.911	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-78.9	126.6	166.2	-101.2	-170.1	168.3	0	0	109.7	H102 G106	H102-M104 PolarHBondContact O-N 3.2Å; M104-G106 PolarHBondContact O-N 3.38Å
105	N	23	Very low	25.7	Very low	159 Å²	159	152.7 Å²	152.7	85%	0.85	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-57	116.8	-177.2	-74.7	-36.1	0	0	0	111.7	T107	N105-T107 PolarHBondContact O-N 3.01Å
106	G	23	Very low	25.5	Very low	72 Å²	72	149.3 Å²	149.3	74%	0.742	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-69.3	116.5	177.2	0	0	0	0	0	111.9	M104	M104-G106 PolarHBondContact O-N 3.38Å
107	T	24.1	Very low	25.4	Very low	131 Å²	131	151.4 Å²	151.4	80%	0.804	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-86.7	120.7	170.3	27.1	0	0	0	0	110.7	N105	N105-T107 PolarHBondContact O-N 3.01Å
108	L	25.1	Very low	25.2	Very low	170 Å²	170	154.5 Å²	154.5	89%	0.89	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-65.5	133.4	-177.3	-65.2	98	0	0	0	112.7
109	I	26.5	Very low	25.1	Very low	148 Å²	148	155.2 Å²	155.2	76%	0.759	79%	0.787	S	S	*	*			trans	-126.8	126.6	165	-59.4	-179.9	0	0	0	108.7	M123	I109-M123 HydrophobicContact CD1-CE 3.88Å; I109-M123 HydrophobicContact CG1-CE 4.44Å
110	R	24.6	Very low	25	Very low	191 Å²	191	157.2 Å²	157.2	72%	0.721	79%	0.789	S	S	*	*			trans	-103.4	129.7	-163.9	-149.4	178.7	-167.2	177.7	1	109.2
111	S	26.1	Very low	24.9	Very low	92 Å²	92	156.7 Å²	156.7	64%	0.643	79%	0.786	S	S	*	*			trans	-96.4	121.3	176.4	59	0	0	0	0	110.7
112	H	28.7	Very low	24.7	Very low	114 Å²	114	160.2 Å²	160.2	53%	0.528	79%	0.79	S	S	.	*			trans	-124	124.6	171.7	-94.3	-67.8	0	0	0	111.2	I81	I81-H112 VanDerWaalsContact CG2-CE1 3.47Å; I81-H112 WeakPolarHBondContact CG2-CE1 3.02Å
113	Y	27.1	Very low	24.6	Very low	209 Å²	209	158.1 Å²	158.1	82%	0.82	78%	0.782	S	S	*	*			trans	-80.4	151.9	163	-74.9	-92.7	0	0	0	110.3
114	S	24.2	Very low	24.8	Very low	106 Å²	106	155.7 Å²	155.7	74%	0.741	78%	0.779	S	S	*	*	S	Bend	trans	61.7	121.6	168.6	52.1	0	0	0	0	119.3
115	N	23.2	Very low	25	Very low	145 Å²	145	151.8 Å²	151.8	78%	0.775	77%	0.77	S	S	*	*			trans	91.9	112.7	161.2	-123.5	-6.4	0	0	0	117.3	Y117	N115-Y117 PolarHBondContact O-N 3.44Å
116	P	24.4	Very low	25.1	Very low	112 Å²	112	151.4 Å²	151.4	73%	0.727	77%	0.766	S	S	*	*			trans	-89.9	90.4	-166.4	36.1	-30.4	0	0	0	110.5
117	Y	22.4	Very low	25.2	Very low	205 Å²	205	153.6 Å²	153.6	80%	0.804	77%	0.765	S	S	*	*			trans	-135.1	120.4	160.5	-82.4	-78.2	0	0	0	110.6	N115	N115-Y117 PolarHBondContact O-N 3.44Å
118	R	23.8	Very low	25.2	Very low	230 Å²	230	157.2 Å²	157.2	87%	0.868	77%	0.77	S	S	*	*			trans	55.2	109.4	156.3	-68.4	178.5	168.7	176.3	-3.1	116.5
119	L	24.7	Very low	25.3	Very low	164 Å²	164	154.3 Å²	154.3	86%	0.859	76%	0.759	S	S	*	*				-166.5	118.9	103.1	-134.5	75.5	0	0	0	110.8
120	K	25.9	Very low	25.2	Very low	180 Å²	180	151.4 Å²	151.4	78%	0.783	75%	0.751	S	S	*	*			trans	-78.6	148.1	161.3	-157.1	179.2	-178.9	174.7	0	106.9
121	N	25.4	Very low	25.3	Very low	138 Å²	138	149.2 Å²	149.2	74%	0.738	75%	0.753	S	S	*	*			trans	89.1	90.6	167.6	-50.1	-22.7	0	0	0	117.2
122	Y	24.2	Very low	25.3	Very low	227 Å²	227	149.4 Å²	149.4	89%	0.89	75%	0.747	S	S	*	*				178.5	125.8	119	-133.2	-107.7	0	0	0	108.3
123	M	24.5	Very low	25	Very low	134 Å²	134	152.7 Å²	152.7	66%	0.66	76%	0.764	S	S	*	*			trans	171.8	63.5	153.3	-91.1	-75.7	176.5	0	0	108.8	I109	I109-M123 HydrophobicContact CD1-CE 3.88Å; I109-M123 HydrophobicContact CG1-CE 4.44Å
124	N	26.5	Very low	25.1	Very low	158 Å²	158	147.1 Å²	147.1	85%	0.845	75%	0.746	S	S	*	*			trans	-104.5	39.4	-177.2	-146.3	18.4	0	0	0	112.5
125	S	27	Very low	25.1	Very low	102 Å²	102	148 Å²	148	71%	0.713	75%	0.752	S	S	*	*	S	Bend	trans	-138.6	-6.1	-179.7	68.9	0	0	0	0	119.4
126	I	26	Very low	25.3	Very low	151 Å²	151	146.3 Å²	146.3	77%	0.774	74%	0.742	S	S	*	*	S	Bend	trans	-141.3	36.4	177	-38.3	178.2	0	0	0	112.8
127	T	24	Very low	25.3	Very low	119 Å²	119	148 Å²	148	73%	0.73	75%	0.745	S	S	*	*			trans	-98.6	14.7	176.1	33.2	0	0	0	0	114
128	K	25.7	Very low	25.4	Very low	207 Å²	207	147.8 Å²	147.8	90%	0.9	74%	0.743	S	S	*	*	S	Bend	trans	-89.3	2.4	-179.4	-112.9	-177.3	-179.3	-177.2	0	116.1
129	T	26.1	Very low	25.3	Very low	109 Å²	109	144 Å²	144	67%	0.669	74%	0.74	S	S	*	*	S	Bend	trans	-141.5	82.2	177.4	47.3	0	0	0	0	112.1	L131	T129-L131 PolarHBondContact O-N 3.47Å
130	C	25.8	Very low	25.2	Very low	86 Å²	86	144.8 Å²	144.8	58%	0.581	74%	0.741	S	S	*	*			trans	70	13.9	136.8	-62.1	0	0	0	0	123.4
131	L	25.6	Very low	25	Very low	145 Å²	145	144 Å²	144	76%	0.759	74%	0.744	S	S	*	*			trans	-136.1	109	-175.3	-68.7	168.1	0	0	0	115.4	T129	T129-L131 PolarHBondContact O-N 3.47Å
132	N	26.3	Very low	24.7	Very low	97 Å²	97	144.8 Å²	144.8	52%	0.519	75%	0.747	S	S	.	*			trans	-86.2	118.6	156.4	-91.5	-6.3	0	0	0	108.6
133	M	22.8	Very low	24.5	Very low	182 Å²	182	145.4 Å²	145.4	90%	0.897	75%	0.748	S	S	*	*			trans	-116	93.3	153.7	-82	-162.8	-178	0	0	106.5
134	E	27.8	Very low	24.4	Very low	92 Å²	92	149.5 Å²	149.5	43%	0.43	76%	0.756	S	S	.	*			trans	-95	110.8	175.8	-68.6	-172.3	178.1	0	0	109.3	I136	E134-I136 HydrophobicContact CB-CD1 4.37Å; E134-I136 HydrophobicContact CB-CG1 3.96Å; E134-I136 PolarHBondContact O-N 2.93Å
135	S	25.3	Very low	24.2	Very low	125 Å²	125	149.5 Å²	149.5	87%	0.874	76%	0.757	S	S	*	*			trans	-79.4	96.3	164.9	61.4	0	0	0	0	108.3
136	I	27	Very low	24	Very low	110 Å²	110	153.9 Å²	153.9	56%	0.564	76%	0.763	S	S	*	*			trans	-84.1	119.2	-173.3	-61.9	173.1	0	0	0	110.5	E134	E134-I136 HydrophobicContact CB-CD1 4.37Å; E134-I136 HydrophobicContact CB-CG1 3.96Å; E134-I136 PolarHBondContact O-N 2.93Å
137	N	25.2	Very low	23.9	Very low	148 Å²	148	149.2 Å²	149.2	79%	0.791	75%	0.752	S	S	*	*			trans	-79.3	133	170.2	-168.4	-0.6	0	0	0	109.8	N139	N137-N139 PolarHBondContact O-N 3.36Å
138	W	24.9	Very low	23.9	Very low	200 Å²	200	149.5 Å²	149.5	76%	0.758	75%	0.749	S	S	*	*	S	Bend	trans	-72.5	102.7	-178.7	-67	80.3	0	0	0	110.1	I564	W138-I564 HydrophobicContact CH2-CD1 4.33Å; W138-I564 HydrophobicContact CZ2-CD1 4.14Å
139	N	20.8	Very low	23.9	Very low	151 Å²	151	149 Å²	149	81%	0.807	75%	0.747	S	S	*	*	S	Bend	trans	170	118.3	134.9	-83.2	-28	0	0	0	110.4	N137	N137-N139 PolarHBondContact O-N 3.36Å
140	M	21.6	Very low	24	Very low	179 Å²	179	152.4 Å²	152.4	88%	0.882	75%	0.749	S	S	*	*			trans	72.6	95.6	163.7	-59.3	-168.8	-176.6	0	0	118.9
141	I	22.3	Very low	24.1	Very low	163 Å²	163	151.5 Å²	151.5	84%	0.836	74%	0.739	S	S	*	*				6	110.1	129.8	-55.1	168.4	0	0	0	114.3
142	L	19.8	Very low	24.3	Very low	156 Å²	156	148.7 Å²	148.7	82%	0.817	72%	0.721	S	S	*	*			trans	-140.4	106.7	160.8	-99.7	156.8	0	0	0	110
143	W	20.2	Very low	24.7	Very low	240 Å²	240	148.1 Å²	148.1	91%	0.909	72%	0.716	S	S	*	*			trans	4.8	119.4	153.1	-61.7	82	0	0	0	116.9
144	R	21.9	Very low	25.2	Very low	219 Å²	219	141.2 Å²	141.2	83%	0.826	68%	0.681	S	S	*	*			trans	-105.4	129.8	163.6	-145.2	177.4	-162.2	160.7	7.2	109.6
145	D	21.7	Very low	25.5	Very low	159 Å²	159	137.9 Å²	137.9	85%	0.85	67%	0.666	S	S	*	*			trans	-45.1	139.3	-178.8	-87.1	-47.5	0	0	0	113.4	G147	D145-G147 PolarHBondContact O-N 2.96Å
146	K	23.5	Very low	26.1	Very low	193 Å²	193	135.5 Å²	135.5	84%	0.839	64%	0.638	S	S	*	*			trans	-59.4	81	161.5	-71.5	179	172.9	-177.2	0	109.2
147	G	23.5	Very low	26.6	Very low	54 Å²	54	130.9 Å²	130.9	56%	0.557	61%	0.614	S	S	*	*			trans	-99.7	106.6	157.3	0	0	0	0	0	106.6	D145 F149	D145-G147 PolarHBondContact O-N 2.96Å; G147-F149 PolarHBondContact O-N 3.46Å
148	D	25.3	Very low	27.1	Very low	124 Å²	124	124.4 Å²	124.4	66%	0.663	58%	0.58	S	S	*	*			trans	-53.7	92.2	-173	-60	-53	0	0	0	113	Y150	D148-Y150 HydrophobicContact CB-CD2 4.13Å; D148-Y150 WeakPolarHBondContact OD1-CD2 3.46Å
149	F	25.5	Very low	27.5	Very low	197 Å²	197	116.9 Å²	116.9	86%	0.864	55%	0.554	S	S	*	*			trans	-95.9	48.5	147.7	-75.6	-83.2	0	0	0	108.8	G147 N151	G147-F149 PolarHBondContact O-N 3.46Å; F149-N151 VanDerWaalsContact C-N 3.29Å; F149-N151 PolarHBondContact O-N 3.38Å; F149-N151 VanDerWaalsContact O-N 3.07Å
150	Y	26.6	Very low	28.1	Very low	181 Å²	181	114.3 Å²	114.3	71%	0.71	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	95.8	157.8	-77.6	-83	0	0	0	106.1	D148	D148-Y150 HydrophobicContact CB-CD2 4.13Å; D148-Y150 WeakPolarHBondContact OD1-CD2 3.46Å
151	N	28.9	Very low	28.7	Very low	67 Å²	67	111.7 Å²	111.7	36%	0.358	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	158	45.9	148.6	-78	-5.3	0	0	0	113.6	F149 Q153 T761	F149-N151 VanDerWaalsContact C-N 3.29Å; F149-N151 PolarHBondContact O-N 3.38Å; F149-N151 VanDerWaalsContact O-N 3.07Å; N151-Q153 PolarHBondContact O-N 3Å; N151-T761 VanDerWaalsContact CB-OG1 3.32Å; N151-T761 WeakPolarHBondContact CB-OG1 3.42Å; N151-T761 PolarHBondContact ND2-OG1 3.1Å
152	E	30.2	Very low	29	Very low	85 Å²	85	106.4 Å²	106.4	40%	0.397	51%	0.51	S	S	.	.			trans	-72.1	29.7	158.9	-75.6	-165.8	-172.3	0	0	112.1	H154 H700	E152-H154 PolarHBondContact O-N 2.82Å; E152-H700 IonicContact OE1-ND1 3.19Å
153	Q	34.5	Very low	29.7	Very low	85 Å²	85	110 Å²	110	40%	0.397	52%	0.519	S	S	.	.			trans	-82.1	90.5	-176.3	-68.4	-174.9	-7.8	0	0	109.4	N151 N760	N151-Q153 PolarHBondContact O-N 3Å; Q153-N760 PolarHBondContact OE1-OD1 2.95Å
154	H	32.3	Very low	30.2	Very low	38 Å²	38	100.5 Å²	100.5	18%	0.176	50%	0.495	C	S	.	.			trans	83.4	103.3	168.8	-44	-65.9	0	0	0	116.2	E152 R156 W763	E152-H154 PolarHBondContact O-N 2.82Å; H154-R156 HydrophobicContact CB-CG 4.23Å; H154-W763 PolarHBondContact O-N 3.25Å
155	I	35.6	Very low	30.7	Very low	21 Å²	21	93.8 Å²	93.8	11%	0.108	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	118	156.9	-57.4	-166.2	0	0	0	107.7	S701 L703 Y704 F714 V765	I155-S701 WeakPolarHBondContact CD1-OG 3.44Å; I155-L703 HydrophobicContact CB-CD2 4.31Å; I155-L703 HydrophobicContact CG2-CD2 3.91Å; I155-L703 HydrophobicContact CG2-CG 4.34Å; I155-Y704 VanDerWaalsContact CD1-CB 3.45Å; I155-Y704 HydrophobicContact CD1-CD2 3.91Å; I155-Y704 HydrophobicContact CD1-CG 4.1Å; I155-F714 HydrophobicContact CG2-CE1 4.11Å; I155-V765 HydrophobicContact CG2-CG2 3.72Å
156	R	37.3	Very low	31.3	Very low	76 Å²	76	90.4 Å²	90.4	29%	0.287	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	115	179	-51.6	-165.5	175.4	162.9	-5.8	112.4	H154 L167 F168 T762 W763 V765	H154-R156 HydrophobicContact CB-CG 4.23Å; R156-L167 HydrophobicContact CB-CD2 4.38Å; R156-F168 WeakPolarHBondContact CA-O 3.43Å; R156-F168 WeakPolarHBondContact CB-O 3.38Å; R156-F168 WeakPolarHBondContact CG-O 3.42Å; R156-T762 VanDerWaalsContact CZ-CG2 3.49Å; R156-W763 VanDerWaalsContact CB-O 3.26Å; R156-W763 WeakPolarHBondContact CB-O 3.49Å; R156-W763 PolarHBondContact N-O 2.7Å; R156-W763 VanDerWaalsContact N-O 3.07Å; R156-V765 WeakPolarHBondContact O-CA 3.36Å; R156-V765 VanDerWaalsContact O-CB 3.29Å; R156-V765 WeakPolarHBondContact O-CB 3.33Å; R156-V765 PolarHBondContact O-N 3.01Å
157	L	37.8	Very low	32	Very low	13 Å²	13	86.2 Å²	86.2	7%	0.068	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	137.8	165.6	-63	169.4	0	0	0	109	F168 L513 L703 V765 I767	L157-F168 HydrophobicContact CB-CB 4.18Å; L157-F168 HydrophobicContact CB-CD2 3.99Å; L157-F168 HydrophobicContact CB-CG 4.38Å; L157-F168 WeakPolarHBondContact O-CD2 3.46Å; L157-F168 PolarHBondContact O-N 2.95Å; L157-L513 HydrophobicContact CD1-CD1 3.62Å; L157-L703 HydrophobicContact CD1-CD1 3.65Å; L157-L703 HydrophobicContact CD1-CD2 3.77Å; L157-L703 HydrophobicContact CD1-CG 4.03Å; L157-L703 HydrophobicContact CG-CD2 3.85Å; L157-L703 HydrophobicContact CG-CG 4.41Å; L157-V765 CarbonylContact C-O 3.4Å; L157-V765 VanDerWaalsContact CA-O 3.23Å; L157-V765 WeakPolarHBondContact CA-O 3.47Å; L157-V765 HydrophobicContact CD2-CB 3.57Å; L157-V765 HydrophobicContact CD2-CG1 3.36Å; L157-V765 HydrophobicContact CD2-CG2 4.49Å; L157-I767 HydrophobicContact CB-CD1 4.38Å; L157-I767 HydrophobicContact CD1-CD1 3.57Å; L157-I767 HydrophobicContact CD2-CD1 3.51Å; L157-I767 HydrophobicContact CD2-CG1 3.61Å; L157-I767 HydrophobicContact CG-CD1 3.97Å
158	V	34.5	Very low	33.1	Very low	12 Å²	12	85.6 Å²	85.6	7%	0.073	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	114.6	175.3	-178.1	0	0	0	0	107.2	I160 L167 R764 V765	V158-I160 HydrophobicContact CG1-CG1 4.25Å; V158-L167 HydrophobicContact CG2-CD2 4.39Å; V158-R764 HydrophobicContact CG2-CG 3.92Å; V158-V765 PolarHBondContact N-O 3.01Å
159	N	33.6	Very low	34.2	Very low	41 Å²	41	81.3 Å²	81.3	22%	0.219	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	123.8	168.1	-169.9	-25.8	0	0	0	108.3	N161	N159-N161 PolarHBondContact OD1-N 2.84Å; N159-N161 VanDerWaalsContact OD1-N 3.1Å
160	I	33.6	Very low	35.6	Very low	98 Å²	98	72.1 Å²	72.1	50%	0.503	38%	0.379	S	S	.	.			trans	-89.7	-4.4	-172.2	-57.1	177.1	0	0	0	112	V158 A162 I746 T766	V158-I160 HydrophobicContact CG1-CG1 4.25Å; I160-A162 PolarHBondContact O-N 2.98Å; I160-I746 HydrophobicContact CD1-CG2 4.29Å; I160-T766 HydrophobicContact CD1-CG2 3.52Å; I160-T766 HydrophobicContact CG1-CG2 4.06Å
161	N	33.9	Very low	37	Very low	124 Å²	124	65.8 Å²	65.8	66%	0.663	36%	0.357	S	S	*	.	S	Bend	trans	-88.3	6.9	-166.9	-76.3	-11.5	0	0	0	117.5	N159	N159-N161 PolarHBondContact OD1-N 2.84Å; N159-N161 VanDerWaalsContact OD1-N 3.1Å
162	A	29.3	Very low	38.3	Very low	52 Å²	52	64.2 Å²	64.2	43%	0.43	35%	0.35	S	S	.	.	S	Bend	trans	-143.6	95.5	-179.9	0	0	0	0	0	113.3	I160 G164	I160-A162 PolarHBondContact O-N 2.98Å; A162-G164 WeakPolarHBondContact O-CA 3.38Å; A162-G164 PolarHBondContact O-N 2.83Å
163	K	34	Very low	39.6	Very low	232 Å²	232	64.4 Å²	64.4	100%	1.009	35%	0.354	S	S	*	.	S	Bend	trans	25.9	39.5	160.3	-79	-170.9	174.6	-178.6	0	118.1
164	G	31.2	Very low	40.4	Very low	39 Å²	39	64.5 Å²	64.5	40%	0.402	36%	0.357	S	S	.	.	S	Bend	trans	160.1	129.6	-172.2	0	0	0	0	0	110.7	A162 H166	A162-G164 WeakPolarHBondContact O-CA 3.38Å; A162-G164 PolarHBondContact O-N 2.83Å; G164-H166 PolarHBondContact O-N 2.78Å
165	A	31.2	Very low	41.4	Very low	78 Å²	78	62.8 Å²	62.8	65%	0.645	35%	0.349	S	S	*	.			trans	-80.9	102.1	175.5	0	0	0	0	0	109
166	H	34.8	Very low	42.3	Very low	89 Å²	89	68.4 Å²	68.4	41%	0.412	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.4	171.2	-65.7	-72	0	0	0	109.4	G164	G164-H166 PolarHBondContact O-N 2.78Å
167	L	38.4	Very low	43.4	Very low	104 Å²	104	70.3 Å²	70.3	55%	0.545	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	109.2	179.9	-73.8	142.8	0	0	0	108.4	R156 V158	R156-L167 HydrophobicContact CB-CD2 4.38Å; V158-L167 HydrophobicContact CG2-CD2 4.39Å
168	F	46.3	Very low	44.6	Very low	41 Å²	41	75.7 Å²	75.7	18%	0.18	41%	0.414	C	S	.	.			trans	-75.6	148.2	163.8	-66.3	-87.1	0	0	0	108.6	R156 L157 L513 I515	R156-F168 WeakPolarHBondContact CA-O 3.43Å; R156-F168 WeakPolarHBondContact CB-O 3.38Å; R156-F168 WeakPolarHBondContact CG-O 3.42Å; L157-F168 HydrophobicContact CB-CB 4.18Å; L157-F168 HydrophobicContact CB-CD2 3.99Å; L157-F168 HydrophobicContact CB-CG 4.38Å; L157-F168 WeakPolarHBondContact O-CD2 3.46Å; L157-F168 PolarHBondContact O-N 2.95Å; F168-L513 HydrophobicContact CE1-CB 4.46Å; F168-I515 HydrophobicContact CE1-CD1 4.26Å; F168-I515 HydrophobicContact CE1-CG1 3.71Å; F168-I515 HydrophobicContact CZ-CD1 3.61Å; F168-I515 HydrophobicContact CZ-CG1 3.58Å
169	G	48.7	Very low	46.5	Very low	35 Å²	35	76.6 Å²	76.6	36%	0.361	42%	0.417	S	S	.	.			trans	-148.6	122.3	174.9	0	0	0	0	0	108.7	D171	G169-D171 PolarHBondContact O-N 2.98Å
170	E	55.5	Low	48.9	Very low	3 Å²	3	77.2 Å²	77.2	1%	0.014	43%	0.425	C	S	.	.			trans	-81.5	106.2	166	-167	171.3	-178.2	0	0	107.7	L175 I202 S701 L702 L703	E170-L175 HydrophobicContact CG-CD1 3.28Å; E170-L175 WeakPolarHBondContact OE1-CD1 3.4Å; E170-I202 HydrophobicContact CB-CD1 4.14Å; E170-I202 HydrophobicContact CG-CD1 3.76Å; E170-S701 VanDerWaalsContact OE2-CA 3.29Å; E170-S701 WeakPolarHBondContact OE2-CA 3.38Å; E170-S701 VanDerWaalsContact OE2-CB 3.24Å; E170-S701 WeakPolarHBondContact OE2-CB 3.32Å; E170-S701 PolarHBondContact OE2-OG 2.97Å; E170-L702 WeakPolarHBondContact OE1-CB 3.46Å; E170-L702 PolarHBondContact OE1-N 2.82Å; E170-L702 PolarHBondContact OE2-N 3.41Å; E170-L702 VanDerWaalsContact OE2-N 3.11Å; E170-L703 WeakPolarHBondContact OE2-CB 3.47Å; E170-L703 PolarHBondContact OE2-N 3.49Å
171	D	55.1	Low	51.4	Low	48 Å²	48	77.4 Å²	77.4	26%	0.257	42%	0.42	S	S	.	.			trans	-86.5	105.9	163.9	-167.7	-20.6	0	0	0	108.5	G169 N173 D174 L175	G169-D171 PolarHBondContact O-N 2.98Å; D171-N173 PolarHBondContact O-N 3.4Å; D171-N173 VanDerWaalsContact O-N 3.16Å; D171-N173 VanDerWaalsContact OD1-CB 3.3Å; D171-N173 WeakPolarHBondContact OD1-CB 3.32Å; D171-N173 PolarHBondContact OD1-N 3.36Å; D171-D174 HydrophobicContact CB-CB 4.31Å; D171-D174 PolarHBondContact O-N 2.82Å; D171-L175 WeakPolarHBondContact O-CG 3.35Å; D171-L175 PolarHBondContact O-N 3.46Å
172	T	56.9	Low	54.2	Low	35 Å²	35	77.5 Å²	77.5	22%	0.215	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.3	177.2	54.3	0	0	0	0	113	L175 K176	T172-L175 PolarHBondContact O-N 3.18Å; T172-K176 PolarHBondContact O-N 3.23Å
173	N	56.5	Low	57.2	Low	89 Å²	89	79.1 Å²	79.1	48%	0.476	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-38.5	177	-66.8	-47.3	0	0	0	112.2	D171 L175 K176	D171-N173 PolarHBondContact O-N 3.4Å; D171-N173 VanDerWaalsContact O-N 3.16Å; D171-N173 VanDerWaalsContact OD1-CB 3.3Å; D171-N173 WeakPolarHBondContact OD1-CB 3.32Å; D171-N173 PolarHBondContact OD1-N 3.36Å; N173-L175 PolarHBondContact O-N 3.17Å; N173-K176 WeakPolarHBondContact O-CB 3.49Å; N173-K176 PolarHBondContact O-N 3.25Å; N173-K176 PolarHBondContact OD1-NZ 3.41Å
174	D	52.4	Low	59.9	Low	86 Å²	86	71.8 Å²	71.8	46%	0.46	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-67.7	-22.4	174.7	-72.6	-17.7	0	0	0	112.1	D171	D171-D174 HydrophobicContact CB-CB 4.31Å; D171-D174 PolarHBondContact O-N 2.82Å
175	L	53.6	Low	62.7	Low	2 Å²	2	70.3 Å²	70.3	1%	0.01	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-83.8	-10.6	177.3	-70.6	176	0	0	0	114.4	E170 D171 T172 N173 N177 Y198 I698	E170-L175 HydrophobicContact CG-CD1 3.28Å; E170-L175 WeakPolarHBondContact OE1-CD1 3.4Å; D171-L175 WeakPolarHBondContact O-CG 3.35Å; D171-L175 PolarHBondContact O-N 3.46Å; T172-L175 PolarHBondContact O-N 3.18Å; N173-L175 PolarHBondContact O-N 3.17Å; L175-N177 PolarHBondContact O-N 3.43Å; L175-N177 VanDerWaalsContact O-N 3.12Å; L175-Y198 HydrophobicContact CD2-CD1 3.12Å; L175-Y198 HydrophobicContact CD2-CD2 4.08Å; L175-Y198 HydrophobicContact CD2-CE1 3.87Å; L175-Y198 HydrophobicContact CD2-CG 3.24Å; L175-Y198 HydrophobicContact CG-CD1 4.47Å; L175-I698 HydrophobicContact CB-CB 4.27Å; L175-I698 HydrophobicContact CB-CD1 3.65Å; L175-I698 HydrophobicContact CB-CG2 4.19Å; L175-I698 HydrophobicContact CD1-CD1 4.1Å; L175-I698 HydrophobicContact CD1-CG2 4.13Å; L175-I698 HydrophobicContact CD2-CD1 3.78Å; L175-I698 HydrophobicContact CG-CD1 4.05Å
176	K	54.7	Low	65.2	Low	140 Å²	140	70.1 Å²	70.1	61%	0.609	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-66.9	-10.9	-179.4	-81.8	174.2	179.5	161.8	0	114.2	T172 N173 Q178	T172-K176 PolarHBondContact O-N 3.23Å; N173-K176 WeakPolarHBondContact O-CB 3.49Å; N173-K176 PolarHBondContact O-N 3.25Å; N173-K176 PolarHBondContact OD1-NZ 3.41Å; K176-Q178 VanDerWaalsContact C-N 3.31Å; K176-Q178 PolarHBondContact O-N 3.21Å
177	N	58.6	Low	67.6	Low	115 Å²	115	71.8 Å²	71.8	62%	0.615	36%	0.364	S	S	*	.	S	Bend	trans	-66.7	94.9	171.6	-70.7	-26.4	0	0	0	109	L175 M179	L175-N177 PolarHBondContact O-N 3.43Å; L175-N177 VanDerWaalsContact O-N 3.12Å; N177-M179 PolarHBondContact O-N 3.08Å
178	Q	63.2	Low	69.7	Low	127 Å²	127	70.5 Å²	70.5	59%	0.593	35%	0.351	S	S	*	.			trans	-52.9	106.1	175.4	179.1	172.2	28.6	0	0	109.3	K176 S696	K176-Q178 VanDerWaalsContact C-N 3.31Å; K176-Q178 PolarHBondContact O-N 3.21Å; Q178-S696 WeakPolarHBondContact CG-O 3.44Å
179	M	75.1	Confident	71.6	Confident	30 Å²	30	72.8 Å²	72.8	15%	0.148	36%	0.361	C	S	.	.			trans	-85.2	126.5	172.1	-60	-177.8	-168.9	0	0	108.4	N177 Y181 L196 A197 Y198 K695 S696	N177-M179 PolarHBondContact O-N 3.08Å; M179-Y181 HydrophobicContact CB-CD2 4.5Å; M179-Y181 HydrophobicContact CB-CE2 3.96Å; M179-Y181 HydrophobicContact SD-CE2 4.44Å; M179-L196 HydrophobicContact CB-CD2 4.29Å; M179-L196 HydrophobicContact SD-CB 4.26Å; M179-A197 VanDerWaalsContact CE-O 3.27Å; M179-A197 WeakPolarHBondContact CE-O 3.42Å; M179-Y198 HydrophobicContact CE-CD1 3.29Å; M179-Y198 HydrophobicContact CE-CE1 3.57Å; M179-Y198 HydrophobicContact CE-CG 4Å; M179-Y198 HydrophobicContact CG-CE1 4.43Å; M179-Y198 HydrophobicContact SD-CD1 4.13Å; M179-Y198 HydrophobicContact SD-CE1 3.86Å; M179-K695 CarbonylContact O-C 3.56Å; M179-K695 WeakPolarHBondContact O-CA 3.2Å; M179-S696 WeakPolarHBondContact CB-OG 3.5Å; M179-S696 PolarHBondContact N-OG 2.93Å; M179-S696 VanDerWaalsContact N-OG 3.15Å; M179-S696 PolarHBondContact O-N 3.42Å; M179-S696 PolarHBondContact O-OG 2.94Å
180	S	83.1	Confident	73.4	Confident	55 Å²	55	72.3 Å²	72.3	39%	0.385	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129	167.9	-175.1	0	0	0	0	110.3	E693 I694	S180-E693 PolarHBondContact OG-OE1 3.48Å; S180-I694 CarbonylContact C-O 3.54Å; S180-I694 VanDerWaalsContact CA-O 3.23Å; S180-I694 WeakPolarHBondContact CA-O 3.33Å
181	Y	88	Confident	75.1	Confident	101 Å²	101	77 Å²	77	40%	0.396	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	123.9	172.5	-65.9	-84.4	0	0	0	109.5	M179 L196 E693 I694	M179-Y181 HydrophobicContact CB-CD2 4.5Å; M179-Y181 HydrophobicContact CB-CE2 3.96Å; M179-Y181 HydrophobicContact SD-CE2 4.44Å; Y181-L196 HydrophobicContact CD2-CD2 3.37Å; Y181-L196 HydrophobicContact CE2-CD2 3.43Å; Y181-L196 VanDerWaalsContact CE2-CD2 3.43Å; Y181-E693 CarbonylContact O-C 3.53Å; Y181-E693 WeakPolarHBondContact O-CA 3.42Å; Y181-I694 PolarHBondContact N-O 3.01Å; Y181-I694 PolarHBondContact O-N 2.68Å
182	K	91.4	Very high	77	Confident	126 Å²	126	75.8 Å²	75.8	55%	0.548	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.1	178.1	-172.8	169.9	179.6	169.8	0	110.3	T691 E693	K182-T691 VanDerWaalsContact CE-CG2 3.4Å; K182-T691 WeakPolarHBondContact CE-OG1 3.48Å; K182-T691 HydrophobicContact CG-CG2 4.4Å; K182-E693 HydrophobicContact CB-CB 4.31Å; K182-E693 HydrophobicContact CB-CG 4.05Å; K182-E693 HydrophobicContact CG-CB 4.18Å; K182-E693 HydrophobicContact CG-CG 4.37Å
183	K	92.9	Very high	78.8	Confident	86 Å²	86	77.3 Å²	77.3	37%	0.374	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.5	175.6	-69.5	-172.2	177.1	-170.5	0	110.7	L192 S193 F194 T691 I692	K183-L192 HydrophobicContact CB-CD1 3.92Å; K183-L192 HydrophobicContact CB-CD2 4.25Å; K183-L192 HydrophobicContact CD-CB 4.47Å; K183-L192 HydrophobicContact CD-CD2 4.27Å; K183-S193 PolarHBondContact NZ-O 2.73Å; K183-F194 HydrophobicContact CB-CE1 3.99Å; K183-F194 HydrophobicContact CB-CZ 3.91Å; K183-F194 HydrophobicContact CD-CD1 4.22Å; K183-F194 HydrophobicContact CD-CE1 3.74Å; K183-F194 HydrophobicContact CD-CZ 3.93Å; K183-F194 HydrophobicContact CG-CD1 4.46Å; K183-F194 HydrophobicContact CG-CE1 3.67Å; K183-F194 HydrophobicContact CG-CZ 4.02Å; K183-T691 VanDerWaalsContact O-CA 3.31Å; K183-T691 WeakPolarHBondContact O-CA 3.33Å; K183-I692 PolarHBondContact N-O 2.91Å; K183-I692 PolarHBondContact O-N 2.95Å
184	E	90.5	Very high	80.5	Confident	79 Å²	79	73.5 Å²	73.5	37%	0.369	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	142.5	-179.2	-65	-176.9	170.5	0	0	110.8	R689 T691	E184-R689 WeakPolarHBondContact OE1-CD 3.39Å; E184-R689 IonicContact OE1-CZ 3.55Å; E184-R689 IonicContact OE1-NE 3.8Å; E184-R689 IonicContact OE1-NH1 2.74Å; E184-R689 PolarHBondContact OE1-NH1 2.84Å; E184-R689 VanDerWaalsContact OE2-CD 3.28Å; E184-R689 WeakPolarHBondContact OE2-CD 3.26Å; E184-R689 IonicContact OE2-CZ 2.92Å; E184-R689 IonicContact OE2-NE 2.63Å; E184-R689 IonicContact OE2-NH1 2.69Å; E184-R689 PolarHBondContact OE2-NH1 2.93Å; E184-T691 HydrophobicContact CG-CG2 3.97Å
185	V	89.2	Confident	82.3	Confident	8 Å²	8	73.3 Å²	73.3	5%	0.048	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	115.9	172.2	-177.8	0	0	0	0	107.3	D190 L192 I211 L213 L214 S690 I692	V185-D190 HydrophobicContact CG1-CB 4.3Å; V185-L192 HydrophobicContact CG2-CD1 4.22Å; V185-I211 HydrophobicContact CG1-CB 4.49Å; V185-I211 HydrophobicContact CG1-CG2 3.89Å; V185-I211 HydrophobicContact CG2-CD1 4.47Å; V185-I211 HydrophobicContact CG2-CG2 3.78Å; V185-L213 HydrophobicContact CG2-CD1 4.16Å; V185-L214 HydrophobicContact CG1-CG 4.27Å; V185-S690 PolarHBondContact N-O 3.12Å; V185-I692 HydrophobicContact CG2-CD1 4.46Å; V185-I692 HydrophobicContact CG2-CG1 4.19Å
186	T	84	Confident	83.9	Confident	73 Å²	73	73.2 Å²	73.2	45%	0.448	36%	0.359	S	S	.	.			trans	-108.8	-29	-171.5	61.6	0	0	0	0	112.7	D190	T186-D190 WeakPolarHBondContact CA-OD2 3.31Å; T186-D190 PolarHBondContact N-OD2 2.84Å; T186-D190 PolarHBondContact OG1-OD2 3.02Å; T186-D190 VanDerWaalsContact OG1-OD2 3.08Å
187	Q	85.6	Confident	85.2	Confident	125 Å²	125	69 Å²	69	58%	0.584	35%	0.35	S	S	*	.	S	Bend	trans	-133.6	165.6	-179.2	-42.9	-178.5	0.3	0	0	111.7	D190	Q187-D190 VanDerWaalsContact CB-OD1 3.28Å; Q187-D190 WeakPolarHBondContact CB-OD1 3.42Å; Q187-D190 PolarHBondContact N-OD2 3.49Å
188	R	82.8	Confident	86.1	Confident	77 Å²	77	64 Å²	64	29%	0.291	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	133.9	172	-162.1	-174.6	-178	-161.9	4.1	109.2	D190 E216 T682	R188-D190 VanDerWaalsContact C-N 3.28Å; R188-E216 IonicContact CZ-OE1 2.64Å; R188-E216 IonicContact CZ-OE2 2.67Å; R188-E216 IonicContact NE-OE1 3.38Å; R188-E216 PolarHBondContact NE-OE1 3.15Å; R188-E216 IonicContact NE-OE2 3.92Å; R188-E216 PolarHBondContact NE-OE2 3.18Å; R188-E216 IonicContact NH2-OE1 3.28Å; R188-E216 PolarHBondContact NH2-OE1 3Å; R188-E216 IonicContact NH2-OE2 3.05Å; R188-E216 PolarHBondContact NH2-OE2 3.25Å; R188-T682 HydrophobicContact CB-CG2 4.13Å; R188-T682 HydrophobicContact CG-CG2 4.32Å
189	F	85.6	Confident	86.4	Confident	89 Å²	89	62.2 Å²	62.2	39%	0.39	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	28.3	-177.2	-46.8	-72.2	0	0	0	114.1	N210 I211 R212	F189-N210 HydrophobicContact CD1-CB 4.36Å; F189-I211 WeakPolarHBondContact CA-O 3.4Å; F189-I211 PolarHBondContact N-O 2.87Å; F189-R212 HydrophobicContact CD1-CG 3.98Å; F189-R212 HydrophobicContact CE1-CG 3.88Å
190	D	86	Confident	86	Confident	24 Å²	24	62.5 Å²	62.5	13%	0.128	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	147.8	170.1	-88.2	-7.7	0	0	0	111	V185 T186 Q187 R188 N210 I211	V185-D190 HydrophobicContact CG1-CB 4.3Å; T186-D190 WeakPolarHBondContact CA-OD2 3.31Å; T186-D190 PolarHBondContact N-OD2 2.84Å; T186-D190 PolarHBondContact OG1-OD2 3.02Å; T186-D190 VanDerWaalsContact OG1-OD2 3.08Å; Q187-D190 VanDerWaalsContact CB-OD1 3.28Å; Q187-D190 WeakPolarHBondContact CB-OD1 3.42Å; Q187-D190 PolarHBondContact N-OD2 3.49Å; R188-D190 VanDerWaalsContact C-N 3.28Å; D190-N210 PolarHBondContact O-N 3.41Å; D190-I211 HydrophobicContact CB-CD1 4.41Å; D190-I211 WeakPolarHBondContact O-CB 3.48Å; D190-I211 WeakPolarHBondContact O-CD1 3.47Å; D190-I211 VanDerWaalsContact O-CG1 3.27Å; D190-I211 WeakPolarHBondContact O-CG1 3.27Å; D190-I211 PolarHBondContact O-N 2.84Å
191	N	93.1	Very high	85.5	Confident	102 Å²	102	60.8 Å²	60.8	55%	0.545	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	122	174.1	-63.9	-44	0	0	0	108.4	V208 K209 N210	N191-V208 CarbonylContact C-O 3.53Å; N191-V208 WeakPolarHBondContact CA-O 3.5Å; N191-K209 WeakPolarHBondContact OD1-CA 3.28Å; N191-K209 WeakPolarHBondContact OD1-CB 3.17Å; N191-N210 PolarHBondContact OD1-N 2.95Å
192	L	94.1	Very high	84.9	Confident	22 Å²	22	56.2 Å²	56.2	12%	0.115	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	130	-178.8	-59.7	177.7	0	0	0	109.6	K183 V185 F194 V208 I211 I692	K183-L192 HydrophobicContact CB-CD1 3.92Å; K183-L192 HydrophobicContact CB-CD2 4.25Å; K183-L192 HydrophobicContact CD-CB 4.47Å; K183-L192 HydrophobicContact CD-CD2 4.27Å; V185-L192 HydrophobicContact CG2-CD1 4.22Å; L192-F194 HydrophobicContact CB-CD2 4.49Å; L192-F194 HydrophobicContact CB-CE2 3.66Å; L192-F194 HydrophobicContact CB-CZ 4.13Å; L192-F194 HydrophobicContact CD1-CZ 4.38Å; L192-V208 PolarHBondContact N-O 3.09Å; L192-V208 PolarHBondContact O-N 2.84Å; L192-I211 HydrophobicContact CB-CD1 4.07Å; L192-I211 HydrophobicContact CD1-CD1 3.58Å; L192-I211 HydrophobicContact CG-CD1 3.55Å; L192-I692 HydrophobicContact CD1-CB 4.32Å; L192-I692 HydrophobicContact CD1-CD1 4.33Å; L192-I692 HydrophobicContact CD1-CG1 4.47Å
193	S	93.7	Very high	84.5	Confident	68 Å²	68	50.7 Å²	50.7	48%	0.476	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	137.7	174.7	-64.9	0	0	0	0	110.6	K183 I206 N207	K183-S193 PolarHBondContact NZ-O 2.73Å; S193-I206 CarbonylContact C-O 3.56Å; S193-I206 WeakPolarHBondContact CA-O 3.47Å; S193-N207 VanDerWaalsContact CB-OD1 3.25Å; S193-N207 WeakPolarHBondContact CB-OD1 3.42Å; S193-N207 PolarHBondContact OG-OD1 2.82Å
194	F	92.7	Very high	84.3	Confident	9 Å²	9	46.6 Å²	46.6	4%	0.039	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	141.5	178.7	-55.8	-101.3	0	0	0	108.9	K183 L192 I206 V208 I692 I694	K183-F194 HydrophobicContact CB-CE1 3.99Å; K183-F194 HydrophobicContact CB-CZ 3.91Å; K183-F194 HydrophobicContact CD-CD1 4.22Å; K183-F194 HydrophobicContact CD-CE1 3.74Å; K183-F194 HydrophobicContact CD-CZ 3.93Å; K183-F194 HydrophobicContact CG-CD1 4.46Å; K183-F194 HydrophobicContact CG-CE1 3.67Å; K183-F194 HydrophobicContact CG-CZ 4.02Å; L192-F194 HydrophobicContact CB-CD2 4.49Å; L192-F194 HydrophobicContact CB-CE2 3.66Å; L192-F194 HydrophobicContact CB-CZ 4.13Å; L192-F194 HydrophobicContact CD1-CZ 4.38Å; F194-I206 HydrophobicContact CB-CB 4.34Å; F194-I206 PolarHBondContact N-O 2.87Å; F194-I206 PolarHBondContact O-N 3.12Å; F194-V208 HydrophobicContact CD2-CG2 4.36Å; F194-V208 HydrophobicContact CE2-CG2 3.98Å; F194-I692 HydrophobicContact CE2-CG2 4.34Å; F194-I692 HydrophobicContact CZ-CB 4.36Å; F194-I692 HydrophobicContact CZ-CG2 4.06Å; F194-I694 HydrophobicContact CB-CD1 3.63Å; F194-I694 HydrophobicContact CD1-CB 4.48Å; F194-I694 HydrophobicContact CD1-CD1 3.78Å; F194-I694 HydrophobicContact CD1-CG1 4.01Å; F194-I694 HydrophobicContact CD2-CD1 3.41Å; F194-I694 VanDerWaalsContact CD2-CD1 3.41Å; F194-I694 HydrophobicContact CD2-CG1 4.27Å; F194-I694 HydrophobicContact CE1-CD1 4.22Å; F194-I694 HydrophobicContact CE1-CG1 4.1Å; F194-I694 HydrophobicContact CE2-CD1 3.9Å; F194-I694 HydrophobicContact CE2-CG1 4.36Å; F194-I694 HydrophobicContact CG-CD1 3.34Å; F194-I694 HydrophobicContact CG-CG1 4.09Å; F194-I694 HydrophobicContact CZ-CD1 4.27Å; F194-I694 HydrophobicContact CZ-CG1 4.28Å
195	L	89.7	Confident	84.3	Confident	82 Å²	82	44.8 Å²	44.8	43%	0.429	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	114.2	177.3	175.9	60.9	0	0	0	108	A197 H205	L195-A197 HydrophobicContact CG-CB 4.3Å; L195-H205 VanDerWaalsContact CD1-CE1 3.48Å; L195-H205 WeakPolarHBondContact CD1-CE1 3.36Å
196	L	87.8	Confident	84.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	93.3	171.9	-50.5	178.8	0	0	0	107.2	M179 Y181 Y198 S203 V204 I206 I572 I694	M179-L196 HydrophobicContact CB-CD2 4.29Å; M179-L196 HydrophobicContact SD-CB 4.26Å; Y181-L196 HydrophobicContact CD2-CD2 3.37Å; Y181-L196 HydrophobicContact CE2-CD2 3.43Å; Y181-L196 VanDerWaalsContact CE2-CD2 3.43Å; L196-Y198 HydrophobicContact CB-CE2 3.78Å; L196-Y198 WeakPolarHBondContact O-CD2 3.34Å; L196-S203 CarbonylContact O-C 3.48Å; L196-S203 VanDerWaalsContact O-CA 3.31Å; L196-S203 WeakPolarHBondContact O-CA 3.09Å; L196-V204 HydrophobicContact CB-CB 4.25Å; L196-V204 HydrophobicContact CD1-CB 4.46Å; L196-V204 PolarHBondContact N-O 3.37Å; L196-V204 PolarHBondContact O-N 3Å; L196-I206 HydrophobicContact CD1-CD1 4.21Å; L196-I572 HydrophobicContact CD1-CD1 3.69Å; L196-I572 HydrophobicContact CD1-CG1 4.02Å; L196-I572 HydrophobicContact CD1-CG2 4.3Å; L196-I694 HydrophobicContact CD1-CG2 4.12Å; L196-I694 HydrophobicContact CD2-CG2 4.31Å
197	A	83	Confident	84.8	Confident	51 Å²	51	42.3 Å²	42.3	42%	0.421	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	109.5	-178.3	0	0	0	0	0	110	M179 L195	M179-A197 VanDerWaalsContact CE-O 3.27Å; M179-A197 WeakPolarHBondContact CE-O 3.42Å; L195-A197 HydrophobicContact CG-CB 4.3Å
198	Y	77.4	Confident	85.1	Confident	9 Å²	9	36.3 Å²	36.3	4%	0.035	21%	0.207	C	C	.	.			trans	-90.7	148.9	-177.1	-62.6	-80	0	0	0	112.1	L175 M179 L196 S200 G201 I202 V204 S696 I698 L702	L175-Y198 HydrophobicContact CD2-CD1 3.12Å; L175-Y198 HydrophobicContact CD2-CD2 4.08Å; L175-Y198 HydrophobicContact CD2-CE1 3.87Å; L175-Y198 HydrophobicContact CD2-CG 3.24Å; L175-Y198 HydrophobicContact CG-CD1 4.47Å; M179-Y198 HydrophobicContact CE-CD1 3.29Å; M179-Y198 HydrophobicContact CE-CE1 3.57Å; M179-Y198 HydrophobicContact CE-CG 4Å; M179-Y198 HydrophobicContact CG-CE1 4.43Å; M179-Y198 HydrophobicContact SD-CD1 4.13Å; M179-Y198 HydrophobicContact SD-CE1 3.86Å; L196-Y198 HydrophobicContact CB-CE2 3.78Å; L196-Y198 WeakPolarHBondContact O-CD2 3.34Å; Y198-S200 PolarHBondContact O-N 2.91Å; Y198-S200 VanDerWaalsContact O-N 3.07Å; Y198-G201 PolarHBondContact O-N 3.46Å; Y198-I202 WeakPolarHBondContact CB-O 3.09Å; Y198-I202 HydrophobicContact CD2-CB 4.42Å; Y198-I202 HydrophobicContact CD2-CG2 4.24Å; Y198-I202 WeakPolarHBondContact CD2-O 3.48Å; Y198-I202 PolarHBondContact N-O 3.03Å; Y198-V204 HydrophobicContact CE2-CG2 4.13Å; Y198-S696 WeakPolarHBondContact OH-CB 3.3Å; Y198-S696 PolarHBondContact OH-OG 3.32Å; Y198-I698 HydrophobicContact CD1-CD1 4.11Å; Y198-I698 HydrophobicContact CE1-CD1 3.4Å; Y198-I698 HydrophobicContact CE2-CD1 4.3Å; Y198-L702 HydrophobicContact CD2-CD1 4.2Å; Y198-L702 HydrophobicContact CE2-CD1 3.71Å
199	P	68.8	Low	85.6	Confident	90 Å²	90	35.8 Å²	35.8	58%	0.584	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.1	178.8	-25.7	34.6	0	0	0	114.2	G201	P199-G201 PolarHBondContact O-N 2.98Å; P199-G201 VanDerWaalsContact O-N 3.12Å
200	S	67.1	Low	85.9	Confident	37 Å²	37	35.4 Å²	35.4	26%	0.259	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-4.3	176.6	57.6	0	0	0	0	114.6	Y198 I202	Y198-S200 PolarHBondContact O-N 2.91Å; Y198-S200 VanDerWaalsContact O-N 3.07Å; S200-I202 PolarHBondContact O-N 3.23Å; S200-I202 WeakPolarHBondContact OG-CG1 3.45Å
201	G	71.6	Confident	86.1	Confident	19 Å²	19	34.3 Å²	34.3	20%	0.196	20%	0.203	C	C	.	.	S	Bend	trans	83.6	-2.5	-172.5	0	0	0	0	0	113.6	Y198 P199 E514	Y198-G201 PolarHBondContact O-N 3.46Å; P199-G201 PolarHBondContact O-N 2.98Å; P199-G201 VanDerWaalsContact O-N 3.12Å; G201-E514 PolarHBondContact O-N 3.38Å
202	I	75.7	Confident	86	Confident	5 Å²	5	32 Å²	32	3%	0.026	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	130	169.9	-60.7	172.7	0	0	0	108.7	E170 Y198 S200 L511 L513 L702	E170-I202 HydrophobicContact CB-CD1 4.14Å; E170-I202 HydrophobicContact CG-CD1 3.76Å; Y198-I202 WeakPolarHBondContact CB-O 3.09Å; Y198-I202 HydrophobicContact CD2-CB 4.42Å; Y198-I202 HydrophobicContact CD2-CG2 4.24Å; Y198-I202 WeakPolarHBondContact CD2-O 3.48Å; Y198-I202 PolarHBondContact N-O 3.03Å; S200-I202 PolarHBondContact O-N 3.23Å; S200-I202 WeakPolarHBondContact OG-CG1 3.45Å; I202-L511 HydrophobicContact CG2-CD1 3.69Å; I202-L511 HydrophobicContact CG2-CD2 4.11Å; I202-L511 HydrophobicContact CG2-CG 3.89Å; I202-L513 HydrophobicContact CB-CD2 4.32Å; I202-L513 HydrophobicContact CG1-CD2 3.55Å; I202-L702 HydrophobicContact CG2-CD1 4.26Å
203	S	84.2	Confident	85.8	Confident	10 Å²	10	30.9 Å²	30.9	7%	0.07	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	124.9	173.8	-74.9	0	0	0	0	110.6	L196 L511 T512	L196-S203 CarbonylContact O-C 3.48Å; L196-S203 VanDerWaalsContact O-CA 3.31Å; L196-S203 WeakPolarHBondContact O-CA 3.09Å; S203-L511 CarbonylContact O-C 3.54Å; S203-L511 WeakPolarHBondContact O-CA 3.04Å; S203-T512 WeakPolarHBondContact CB-OG1 3.43Å; S203-T512 PolarHBondContact N-O 3.46Å; S203-T512 PolarHBondContact O-N 3.07Å
204	V	87.1	Confident	85.6	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	120.7	175	-174.6	0	0	0	0	109.5	L196 Y198 I206 L511 I572 L702	L196-V204 HydrophobicContact CB-CB 4.25Å; L196-V204 HydrophobicContact CD1-CB 4.46Å; L196-V204 PolarHBondContact N-O 3.37Å; L196-V204 PolarHBondContact O-N 3Å; Y198-V204 HydrophobicContact CE2-CG2 4.13Å; V204-I206 HydrophobicContact CG1-CD1 4.34Å; V204-I206 HydrophobicContact CG1-CG1 4.11Å; V204-L511 HydrophobicContact CG2-CD1 4.13Å; V204-L511 HydrophobicContact CG2-CG 4.35Å; V204-I572 HydrophobicContact CB-CD1 4.13Å; V204-I572 HydrophobicContact CG1-CD1 3.7Å; V204-I572 HydrophobicContact CG2-CD1 4.15Å; V204-L702 HydrophobicContact CG2-CD1 4.04Å
205	H	90.6	Very high	85.5	Confident	41 Å²	41	27.6 Å²	27.6	19%	0.19	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	131.4	177.2	-61.7	-104.6	0	0	0	109.1	L195 T509 W510 T512	L195-H205 VanDerWaalsContact CD1-CE1 3.48Å; L195-H205 WeakPolarHBondContact CD1-CE1 3.36Å; H205-T509 WeakPolarHBondContact O-CA 3.45Å; H205-T509 WeakPolarHBondContact O-CB 3.37Å; H205-T509 PolarHBondContact O-OG1 3.14Å; H205-W510 HydrophobicContact CB-CD2 3.66Å; H205-W510 HydrophobicContact CB-CE3 4.06Å; H205-W510 HydrophobicContact CB-CG 4.24Å; H205-W510 HydrophobicContact CB-CH2 3.79Å; H205-W510 HydrophobicContact CB-CZ2 3.38Å; H205-W510 HydrophobicContact CB-CZ3 4.11Å; H205-W510 AromaticContact CD2-CD1 3.93Å; H205-W510 AromaticContact CD2-CE2 3.98Å; H205-W510 AromaticContact CD2-NE1 3.41Å; H205-W510 PolarHBondContact CD2-NE1 3.36Å; H205-W510 AromaticContact CG-CE2 3.52Å; H205-W510 AromaticContact CG-CZ2 3.61Å; H205-W510 AromaticContact CG-NE1 3.45Å; H205-W510 PolarHBondContact N-O 3.13Å; H205-W510 AromaticContact ND1-CZ2 3.77Å; H205-W510 PolarHBondContact O-N 3.46Å; H205-W510 VanDerWaalsContact O-N 3.09Å; H205-T512 PolarHBondContact NE2-OG1 3.2Å
206	I	91.5	Very high	85.6	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	113.9	178.1	-55.8	167.8	0	0	0	108.4	S193 F194 L196 V204 V208 I507 I572 I694	S193-I206 CarbonylContact C-O 3.56Å; S193-I206 WeakPolarHBondContact CA-O 3.47Å; F194-I206 HydrophobicContact CB-CB 4.34Å; F194-I206 PolarHBondContact N-O 2.87Å; F194-I206 PolarHBondContact O-N 3.12Å; L196-I206 HydrophobicContact CD1-CD1 4.21Å; V204-I206 HydrophobicContact CG1-CD1 4.34Å; V204-I206 HydrophobicContact CG1-CG1 4.11Å; I206-V208 HydrophobicContact CG2-CG2 4.26Å; I206-I507 HydrophobicContact CG2-CG2 4.07Å; I206-I572 HydrophobicContact CD1-CD1 4.45Å; I206-I572 HydrophobicContact CD1-CG2 3.79Å; I206-I694 HydrophobicContact CB-CD1 3.93Å; I206-I694 HydrophobicContact CD1-CD1 3.72Å; I206-I694 HydrophobicContact CD1-CG2 3.97Å; I206-I694 HydrophobicContact CG1-CD1 4.42Å; I206-I694 HydrophobicContact CG2-CD1 3.75Å
207	N	93	Very high	85.8	Confident	28 Å²	28	23.9 Å²	23.9	15%	0.15	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	117.9	173.6	-75.4	-17.8	0	0	0	109.2	S193 I507 E508 W510	S193-N207 VanDerWaalsContact CB-OD1 3.25Å; S193-N207 WeakPolarHBondContact CB-OD1 3.42Å; S193-N207 PolarHBondContact OG-OD1 2.82Å; N207-I507 CarbonylContact O-C 3.47Å; N207-I507 WeakPolarHBondContact O-CA 2.98Å; N207-E508 HydrophobicContact CB-CB 4.26Å; N207-E508 PolarHBondContact N-O 3.22Å; N207-E508 PolarHBondContact O-N 3.06Å; N207-W510 VanDerWaalsContact ND2-CH2 3.31Å; N207-W510 WeakPolarHBondContact ND2-CH2 3.42Å
208	V	92.7	Very high	86.4	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	113.8	171.9	-166.4	0	0	0	0	107.8	N191 L192 F194 I206 I211 Y505 T506 L574 I692	N191-V208 CarbonylContact C-O 3.53Å; N191-V208 WeakPolarHBondContact CA-O 3.5Å; L192-V208 PolarHBondContact N-O 3.09Å; L192-V208 PolarHBondContact O-N 2.84Å; F194-V208 HydrophobicContact CD2-CG2 4.36Å; F194-V208 HydrophobicContact CE2-CG2 3.98Å; I206-V208 HydrophobicContact CG2-CG2 4.26Å; V208-I211 HydrophobicContact CB-CD1 4.16Å; V208-I211 HydrophobicContact CB-CG1 4.4Å; V208-I211 HydrophobicContact CG1-CD1 3.93Å; V208-I211 HydrophobicContact CG1-CG1 3.72Å; V208-Y505 HydrophobicContact CG1-CD2 3.69Å; V208-Y505 HydrophobicContact CG1-CE2 4.43Å; V208-Y505 HydrophobicContact CG1-CG 3.78Å; V208-T506 CarbonylContact C-O 3.49Å; V208-T506 WeakPolarHBondContact CA-O 2.91Å; V208-L574 HydrophobicContact CG2-CD1 3.69Å; V208-I692 HydrophobicContact CB-CD1 4.44Å; V208-I692 HydrophobicContact CG1-CD1 3.81Å
209	K	92.3	Very high	87.2	Confident	66 Å²	66	22.8 Å²	22.8	29%	0.287	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	155	-172.4	-62.8	179.6	178.1	176.3	0	111.8	N191 I211 Y505 T506 E508	N191-K209 WeakPolarHBondContact OD1-CA 3.28Å; N191-K209 WeakPolarHBondContact OD1-CB 3.17Å; K209-I211 VanDerWaalsContact C-N 3.35Å; K209-I211 PolarHBondContact O-N 2.88Å; K209-Y505 WeakPolarHBondContact O-CB 3.23Å; K209-T506 PolarHBondContact N-O 2.83Å; K209-T506 PolarHBondContact O-N 3.19Å; K209-E508 WeakPolarHBondContact CE-OE2 3.42Å; K209-E508 IonicContact NZ-OE1 2.81Å; K209-E508 PolarHBondContact NZ-OE1 3.13Å; K209-E508 VanDerWaalsContact NZ-OE1 3.09Å; K209-E508 IonicContact NZ-OE2 3.99Å; K209-E508 PolarHBondContact NZ-OE2 2.96Å
210	N	91.8	Very high	88.5	Confident	81 Å²	81	19.8 Å²	19.8	43%	0.433	11%	0.105	S	C	.	.	E	Extended strand (participates in β ladder)	trans	54.3	47.1	174.5	-59.6	-41.2	0	0	0	112.7	F189 D190 N191 R212	F189-N210 HydrophobicContact CD1-CB 4.36Å; D190-N210 PolarHBondContact O-N 3.41Å; N191-N210 PolarHBondContact OD1-N 2.95Å; N210-R212 PolarHBondContact O-N 2.79Å
211	I	91.2	Very high	89.7	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	126.6	-173.4	-58.2	160.6	0	0	0	111.6	V185 F189 D190 L192 V208 K209 L213 Y505 I692	V185-I211 HydrophobicContact CG1-CB 4.49Å; V185-I211 HydrophobicContact CG1-CG2 3.89Å; V185-I211 HydrophobicContact CG2-CD1 4.47Å; V185-I211 HydrophobicContact CG2-CG2 3.78Å; F189-I211 WeakPolarHBondContact CA-O 3.4Å; F189-I211 PolarHBondContact N-O 2.87Å; D190-I211 HydrophobicContact CB-CD1 4.41Å; D190-I211 WeakPolarHBondContact O-CB 3.48Å; D190-I211 WeakPolarHBondContact O-CD1 3.47Å; D190-I211 VanDerWaalsContact O-CG1 3.27Å; D190-I211 WeakPolarHBondContact O-CG1 3.27Å; D190-I211 PolarHBondContact O-N 2.84Å; L192-I211 HydrophobicContact CB-CD1 4.07Å; L192-I211 HydrophobicContact CD1-CD1 3.58Å; L192-I211 HydrophobicContact CG-CD1 3.55Å; V208-I211 HydrophobicContact CB-CD1 4.16Å; V208-I211 HydrophobicContact CB-CG1 4.4Å; V208-I211 HydrophobicContact CG1-CD1 3.93Å; V208-I211 HydrophobicContact CG1-CG1 3.72Å; K209-I211 VanDerWaalsContact C-N 3.35Å; K209-I211 PolarHBondContact O-N 2.88Å; I211-L213 HydrophobicContact CG2-CB 4.09Å; I211-L213 HydrophobicContact CG2-CD1 3.79Å; I211-L213 HydrophobicContact CG2-CG 3.72Å; I211-Y505 HydrophobicContact CG2-CD1 4.48Å; I211-I692 HydrophobicContact CD1-CD1 3.7Å; I211-I692 HydrophobicContact CG1-CD1 4.07Å; I211-I692 HydrophobicContact CG2-CD1 4.09Å
212	R	90.4	Very high	90.8	Very high	53 Å²	53	24.9 Å²	24.9	20%	0.2	12%	0.12	C	C	.	.			trans	-125.1	55.3	179.1	-61.6	-177.8	74.7	-174.1	-4.7	111.3	F189 N210 E216 P501 I504	F189-R212 HydrophobicContact CD1-CG 3.98Å; F189-R212 HydrophobicContact CE1-CG 3.88Å; N210-R212 PolarHBondContact O-N 2.79Å; R212-E216 IonicContact CZ-OE1 3.76Å; R212-E216 IonicContact CZ-OE2 2.77Å; R212-E216 IonicContact NE-OE1 2.66Å; R212-E216 PolarHBondContact NE-OE1 2.84Å; R212-E216 IonicContact NE-OE2 3.37Å; R212-E216 IonicContact NH2-OE1 3.66Å; R212-E216 PolarHBondContact NH2-OE1 2.79Å; R212-E216 VanDerWaalsContact NH2-OE1 3.09Å; R212-E216 IonicContact NH2-OE2 3.63Å; R212-E216 PolarHBondContact NH2-OE2 2.89Å; R212-P501 HydrophobicContact CB-CB 3.9Å; R212-P501 HydrophobicContact CB-CG 4.01Å; R212-P501 VanDerWaalsContact CZ-CB 3.41Å; R212-I504 PolarHBondContact N-O 2.67Å
213	L	88.7	Confident	91.4	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.167	C	C	.	.			trans	-90.6	-14.9	176.6	-71.4	175.3	0	0	0	113.7	V185 I211 I504 Y505 L560 H576 I692	V185-L213 HydrophobicContact CG2-CD1 4.16Å; I211-L213 HydrophobicContact CG2-CB 4.09Å; I211-L213 HydrophobicContact CG2-CD1 3.79Å; I211-L213 HydrophobicContact CG2-CG 3.72Å; L213-I504 HydrophobicContact CD2-CG2 3.41Å; L213-I504 VanDerWaalsContact CD2-CG2 3.41Å; L213-I504 HydrophobicContact CG-CG2 4.13Å; L213-Y505 HydrophobicContact CD1-CE1 4.35Å; L213-Y505 HydrophobicContact CD2-CE1 4.16Å; L213-Y505 HydrophobicContact CG-CD1 4.4Å; L213-Y505 HydrophobicContact CG-CE1 4.41Å; L213-L560 HydrophobicContact CD2-CD1 4.3Å; L213-H576 HydrophobicContact CD1-CB 3.73Å; L213-H576 HydrophobicContact CD2-CB 4.31Å; L213-H576 WeakPolarHBondContact CD2-CD2 3.41Å; L213-I692 HydrophobicContact CD1-CD1 3.86Å; L213-I692 HydrophobicContact CD1-CG1 3.67Å
214	L	90.1	Very high	91.7	Very high	7 Å²	7	34.2 Å²	34.2	4%	0.037	17%	0.17	C	C	.	.	S	Bend	trans	-75	130.9	174.8	-61.8	-178	0	0	0	109.4	V185 E216 T668 T682 K684	V185-L214 HydrophobicContact CG1-CG 4.27Å; L214-E216 PolarHBondContact O-N 3.34Å; L214-T668 HydrophobicContact CD1-CG2 3.63Å; L214-T682 HydrophobicContact CB-CG2 3.86Å; L214-T682 HydrophobicContact CD1-CG2 4.22Å; L214-K684 HydrophobicContact CD1-CB 4.42Å; L214-K684 HydrophobicContact CD2-CB 4.28Å
215	P	90.6	Very high	92.1	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.006	18%	0.177	C	C	.	.			trans	-57.5	127.2	178.4	-25.7	34.4	0	0	0	112	Y217 L580 I582 L683	P215-Y217 HydrophobicContact CB-CD2 4.26Å; P215-Y217 HydrophobicContact CB-CE2 3.71Å; P215-L580 HydrophobicContact CG-CB 3.96Å; P215-L580 HydrophobicContact CG-CD1 4.04Å; P215-I582 HydrophobicContact CB-CG1 4.22Å; P215-I582 HydrophobicContact CG-CD1 4.37Å; P215-I582 HydrophobicContact CG-CG1 3.89Å; P215-L683 PolarHBondContact O-N 3.48Å
216	E	91.1	Very high	92.2	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.019	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.3	176.2	-61.1	-173.7	-159.9	0	0	109.6	R188 R212 L214 H498 R499 L680 Y681 T682	R188-E216 IonicContact CZ-OE1 2.64Å; R188-E216 IonicContact CZ-OE2 2.67Å; R188-E216 IonicContact NE-OE1 3.38Å; R188-E216 PolarHBondContact NE-OE1 3.15Å; R188-E216 IonicContact NE-OE2 3.92Å; R188-E216 PolarHBondContact NE-OE2 3.18Å; R188-E216 IonicContact NH2-OE1 3.28Å; R188-E216 PolarHBondContact NH2-OE1 3Å; R188-E216 IonicContact NH2-OE2 3.05Å; R188-E216 PolarHBondContact NH2-OE2 3.25Å; R212-E216 IonicContact CZ-OE1 3.76Å; R212-E216 IonicContact CZ-OE2 2.77Å; R212-E216 IonicContact NE-OE1 2.66Å; R212-E216 PolarHBondContact NE-OE1 2.84Å; R212-E216 IonicContact NE-OE2 3.37Å; R212-E216 IonicContact NH2-OE1 3.66Å; R212-E216 PolarHBondContact NH2-OE1 2.79Å; R212-E216 VanDerWaalsContact NH2-OE1 3.09Å; R212-E216 IonicContact NH2-OE2 3.63Å; R212-E216 PolarHBondContact NH2-OE2 2.89Å; L214-E216 PolarHBondContact O-N 3.34Å; E216-H498 PolarHBondContact O-ND1 2.64Å; E216-R499 PolarHBondContact O-N 2.66Å; E216-L680 HydrophobicContact CB-CD1 4.27Å; E216-Y681 WeakPolarHBondContact CA-O 3.38Å; E216-T682 HydrophobicContact CG-CG2 4.41Å
217	Y	93.7	Very high	92.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	141.2	179.4	-74	-94.9	0	0	0	110.3	P215 V496 Q497 H498 W583 A586 L598 L680 Y681 L683	P215-Y217 HydrophobicContact CB-CD2 4.26Å; P215-Y217 HydrophobicContact CB-CE2 3.71Å; Y217-V496 HydrophobicContact CD1-CB 4.27Å; Y217-V496 HydrophobicContact CD1-CG2 3.61Å; Y217-V496 HydrophobicContact CE1-CG2 4.41Å; Y217-V496 HydrophobicContact CG-CG2 3.97Å; Y217-Q497 WeakPolarHBondContact CA-O 3.5Å; Y217-Q497 VanDerWaalsContact CD1-C 3.5Å; Y217-H498 HydrophobicContact CD1-CB 4.08Å; Y217-H498 HydrophobicContact CE1-CB 3.71Å; Y217-W583 VanDerWaalsContact CE1-O 3.26Å; Y217-W583 WeakPolarHBondContact CE1-O 3.31Å; Y217-W583 PolarHBondContact OH-N 3.48Å; Y217-W583 PolarHBondContact OH-O 2.92Å; Y217-A586 HydrophobicContact CD1-CB 4.31Å; Y217-A586 HydrophobicContact CE1-CB 3.73Å; Y217-L598 HydrophobicContact CE2-CD2 4.03Å; Y217-L680 CarbonylContact O-C 3.22Å; Y217-L680 WeakPolarHBondContact O-CA 3.28Å; Y217-Y681 PolarHBondContact N-O 3.03Å; Y217-Y681 PolarHBondContact O-N 3.18Å; Y217-L683 HydrophobicContact CD2-CD1 3.75Å; Y217-L683 HydrophobicContact CD2-CG 4.46Å; Y217-L683 HydrophobicContact CE2-CD1 4.02Å
218	E	94.6	Very high	92.2	Very high	31 Å²	31	35.3 Å²	35.3	15%	0.145	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	141.9	170.3	-75.3	178.2	178	0	0	109.6	V496 Q497 R499 T674 A678 F679 L680	E218-V496 CarbonylContact O-C 3.57Å; E218-V496 WeakPolarHBondContact O-CA 3.45Å; E218-V496 WeakPolarHBondContact O-CB 3.29Å; E218-Q497 PolarHBondContact N-O 2.92Å; E218-Q497 PolarHBondContact O-N 2.82Å; E218-R499 HydrophobicContact CB-CG 4.06Å; E218-R499 HydrophobicContact CG-CG 3.73Å; E218-R499 IonicContact OE2-CZ 3.09Å; E218-R499 VanDerWaalsContact OE2-CZ 3.26Å; E218-R499 IonicContact OE2-NE 3.89Å; E218-R499 PolarHBondContact OE2-NE 3.3Å; E218-R499 IonicContact OE2-NH2 2.82Å; E218-R499 PolarHBondContact OE2-NH2 2.94Å; E218-T674 HydrophobicContact CG-CG2 4.46Å; E218-A678 HydrophobicContact CB-CB 4.13Å; E218-A678 HydrophobicContact CG-CB 4.3Å; E218-F679 WeakPolarHBondContact CA-O 3.32Å; E218-L680 HydrophobicContact CG-CD1 3.97Å
219	D	94.9	Very high	92	Very high	5 Å²	5	36 Å²	36	3%	0.027	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	144	169	75.7	-29.4	0	0	0	111.1	R255 H495 V496 A678 F679 Y681	D219-R255 VanDerWaalsContact CG-NE 3.3Å; D219-R255 PolarHBondContact O-NH2 3.49Å; D219-R255 IonicContact OD1-CZ 3.64Å; D219-R255 VanDerWaalsContact OD1-CZ 3.31Å; D219-R255 IonicContact OD1-NE 2.69Å; D219-R255 PolarHBondContact OD1-NE 3.39Å; D219-R255 IonicContact OD1-NH2 3.76Å; D219-R255 PolarHBondContact OD1-NH2 2.94Å; D219-R255 WeakPolarHBondContact OD2-CB 3.34Å; D219-R255 WeakPolarHBondContact OD2-CG 3.29Å; D219-R255 IonicContact OD2-CZ 3.47Å; D219-R255 PolarHBondContact OD2-N 3.02Å; D219-R255 IonicContact OD2-NE 3.55Å; D219-R255 PolarHBondContact OD2-NE 2.77Å; D219-R255 IonicContact OD2-NH2 2.99Å; D219-H495 WeakPolarHBondContact CA-O 3.36Å; D219-V496 HydrophobicContact CB-CG1 4.43Å; D219-A678 WeakPolarHBondContact OD1-CA 3.35Å; D219-A678 WeakPolarHBondContact OD1-CB 3.45Å; D219-F679 PolarHBondContact N-O 2.86Å; D219-F679 PolarHBondContact OD1-N 3.3Å; D219-Y681 HydrophobicContact CB-CE2 4.47Å
220	V	94.7	Very high	91.9	Very high	28 Å²	28	32.9 Å²	32.9	17%	0.17	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-83	135.2	-175	178.4	0	0	0	0	110.3	H222 Y256 H495 Q497	V220-H222 PolarHBondContact O-CD2 3.49Å; V220-H222 VanDerWaalsContact O-CD2 3.28Å; V220-Y256 WeakPolarHBondContact O-CD2 3.45Å; V220-H495 WeakPolarHBondContact CB-ND1 3.47Å; V220-H495 PolarHBondContact N-O 2.02Å; V220-Q497 HydrophobicContact CG2-CB 3.66Å
221	E	93.6	Very high	91.8	Very high	135 Å²	135	32 Å²	32	63%	0.631	18%	0.175	S	C	*	.	P	Polyproline II helix	trans	-79.2	124.9	171.3	-172.1	171.2	-177.8	0	0	110.4	R255 Y256	E221-R255 IonicContact OE2-NH1 2.88Å; E221-Y256 HydrophobicContact CG-CE2 4.33Å
222	H	93.4	Very high	91.6	Very high	28 Å²	28	34 Å²	34	13%	0.13	19%	0.186	C	C	.	.			trans	-112	133.2	-179.8	-69.8	-80.6	0	0	0	111	V220 A224 Y256 H495 F631	V220-H222 PolarHBondContact O-CD2 3.49Å; V220-H222 VanDerWaalsContact O-CD2 3.28Å; H222-A224 WeakPolarHBondContact CB-O 3.36Å; H222-A224 PolarHBondContact O-N 3.27Å; H222-Y256 HydrophobicContact CB-CD2 4.43Å; H222-Y256 HydrophobicContact CB-CG 4.45Å; H222-H495 AromaticContact CE1-ND1 3.3Å; H222-H495 PolarHBondContact CE1-ND1 2.99Å; H222-H495 VanDerWaalsContact CE1-ND1 3.3Å; H222-H495 AromaticContact NE2-CG 3.86Å; H222-H495 AromaticContact NE2-ND1 3.08Å; H222-H495 PolarHBondContact NE2-ND1 2.97Å; H222-F631 HydrophobicContact CB-CD2 3.9Å; H222-F631 AromaticContact CD2-CD2 3.54Å; H222-F631 AromaticContact CD2-CE2 3.75Å; H222-F631 AromaticContact CE1-CD2 3.97Å; H222-F631 AromaticContact CG-CD2 3.47Å; H222-F631 VanDerWaalsContact CG-CD2 3.47Å; H222-F631 AromaticContact ND1-CD2 3.75Å; H222-F631 AromaticContact NE2-CD2 3.86Å
223	L	88.4	Confident	90.9	Very high	195 Å²	195	36.6 Å²	36.6	100%	1.021	21%	0.21	S	C	*	.	S	Bend	trans	-64.2	-25.9	176.3	-65.7	175.5	0	0	0	112.9
224	A	91.9	Very high	90.4	Very high	16 Å²	16	41.1 Å²	41.1	13%	0.132	24%	0.241	C	C	.	.	S	Bend	trans	-131	147	-179.6	0	0	0	0	0	108.8	H222 F631 S634 S636 N637	H222-A224 WeakPolarHBondContact CB-O 3.36Å; H222-A224 PolarHBondContact O-N 3.27Å; A224-F631 WeakPolarHBondContact O-CB 3.3Å; A224-S634 WeakPolarHBondContact CB-OG 3.3Å; A224-S636 WeakPolarHBondContact CB-OG 3.03Å; A224-N637 HydrophobicContact CB-CB 4.07Å
225	S	94.5	Very high	89.1	Confident	19 Å²	19	44.6 Å²	44.6	13%	0.133	25%	0.254	C	S	.	.			trans	-153.2	174.9	176.1	71.3	0	0	0	0	111.8	N227 Y256 S636	S225-N227 PolarHBondContact OG-N 3.5Å; S225-Y256 VanDerWaalsContact CB-CD1 3.48Å; S225-S636 PolarHBondContact N-OG 3.44Å; S225-S636 WeakPolarHBondContact O-CB 3.4Å; S225-S636 PolarHBondContact O-OG 2.93Å
226	D	93.9	Very high	87.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	-96.7	0.6	174.3	-67.8	-55.6	0	0	0	113.4	G228 I229 Y262 P483 F485 F631 T635	D226-G228 VanDerWaalsContact C-N 3.29Å; D226-G228 PolarHBondContact O-N 3.36Å; D226-I229 WeakPolarHBondContact O-CG2 3.42Å; D226-Y262 VanDerWaalsContact OD2-CE1 3.3Å; D226-Y262 WeakPolarHBondContact OD2-CE1 3.49Å; D226-Y262 PolarHBondContact OD2-OH 2.79Å; D226-P483 HydrophobicContact CB-CB 4.25Å; D226-P483 HydrophobicContact CB-CG 3.99Å; D226-F485 HydrophobicContact CB-CE2 4.34Å; D226-F485 HydrophobicContact CB-CZ 3.91Å; D226-F631 HydrophobicContact CB-CE1 4.47Å; D226-T635 WeakPolarHBondContact CA-OG1 3.41Å; D226-T635 WeakPolarHBondContact OD1-CB 3.32Å; D226-T635 VanDerWaalsContact OD1-CG2 3.32Å; D226-T635 WeakPolarHBondContact OD1-CG2 3.37Å; D226-T635 PolarHBondContact OD1-N 2.72Å; D226-T635 PolarHBondContact OD1-OG1 2.89Å
227	N	93.4	Very high	86.6	Confident	20 Å²	20	55.4 Å²	55.4	11%	0.107	30%	0.304	C	S	.	.	H	α-helix	trans	-61.4	-40.3	-177.5	-67.5	-8.7	0	0	0	111.6	S225 I229 V230 M231 I250 R255	S225-N227 PolarHBondContact OG-N 3.5Å; N227-I229 PolarHBondContact O-N 3.31Å; N227-V230 PolarHBondContact O-N 3.3Å; N227-M231 VanDerWaalsContact O-CB 3.31Å; N227-M231 WeakPolarHBondContact O-CB 3.28Å; N227-M231 WeakPolarHBondContact O-CG 3.31Å; N227-M231 PolarHBondContact O-N 3.48Å; N227-I250 HydrophobicContact CB-CD1 4.3Å; N227-R255 PolarHBondContact ND2-O 3.34Å
228	G	90.4	Very high	85.7	Confident	52 Å²	52	61 Å²	61	54%	0.536	33%	0.334	S	S	.	.	H	α-helix	trans	-59	-45.3	-175.5	0	0	0	0	0	113.3	D226 V230 M231 D232	D226-G228 VanDerWaalsContact C-N 3.29Å; D226-G228 PolarHBondContact O-N 3.36Å; G228-V230 PolarHBondContact O-N 2.9Å; G228-M231 PolarHBondContact O-N 2.64Å; G228-D232 WeakPolarHBondContact O-CB 3.25Å; G228-D232 PolarHBondContact O-N 2.8Å
229	I	89.3	Confident	85.2	Confident	15 Å²	15	59.7 Å²	59.7	8%	0.077	33%	0.327	C	S	.	.	H	α-helix	trans	-71.4	-31.6	-177.1	-162.6	167.2	0	0	0	112.8	D226 N227 M239 N332 P483 T635	D226-I229 WeakPolarHBondContact O-CG2 3.42Å; N227-I229 PolarHBondContact O-N 3.31Å; I229-M239 HydrophobicContact CD1-SD 4.45Å; I229-M239 HydrophobicContact CG1-SD 4.28Å; I229-M239 HydrophobicContact CG2-SD 3.91Å; I229-N332 HydrophobicContact CD1-CB 3.78Å; I229-P483 HydrophobicContact CG2-CG 4.49Å; I229-T635 HydrophobicContact CD1-CG2 4Å; I229-T635 HydrophobicContact CG2-CG2 3.99Å; I229-T635 VanDerWaalsContact CG2-OG1 3.27Å; I229-T635 WeakPolarHBondContact CG2-OG1 3.43Å
230	V	90.3	Very high	84.7	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-77	-38.5	178.1	-178.8	0	0	0	0	110.6	N227 G228 M239 W242 R243 L246 F485	N227-V230 PolarHBondContact O-N 3.3Å; G228-V230 PolarHBondContact O-N 2.9Å; V230-M239 HydrophobicContact CG2-CB 4.5Å; V230-M239 HydrophobicContact CG2-SD 4.39Å; V230-W242 HydrophobicContact CG1-CB 3.86Å; V230-R243 PolarHBondContact O-NE 3.39Å; V230-R243 PolarHBondContact O-NH2 2.98Å; V230-R243 VanDerWaalsContact O-NH2 3.16Å; V230-L246 HydrophobicContact CB-CD2 3.6Å; V230-L246 HydrophobicContact CG1-CB 4.44Å; V230-L246 HydrophobicContact CG1-CD2 3.55Å; V230-L246 HydrophobicContact CG2-CD2 4.22Å; V230-F485 HydrophobicContact CG2-CD2 4.46Å; V230-F485 HydrophobicContact CG2-CE2 3.88Å
231	M	89.4	Confident	84.4	Confident	64 Å²	64	69 Å²	69	32%	0.315	37%	0.369	S	S	.	.	H	α-helix	trans	-80.8	-14.1	-178.4	-61.1	-62.3	-88.8	0	0	113.4	N227 G228 P233 R243 L246 E247	N227-M231 VanDerWaalsContact O-CB 3.31Å; N227-M231 WeakPolarHBondContact O-CB 3.28Å; N227-M231 WeakPolarHBondContact O-CG 3.31Å; N227-M231 PolarHBondContact O-N 3.48Å; G228-M231 PolarHBondContact O-N 2.64Å; M231-P233 VanDerWaalsContact O-CD 3.23Å; M231-P233 WeakPolarHBondContact O-CD 2.95Å; M231-R243 PolarHBondContact O-NE 3.25Å; M231-R243 PolarHBondContact O-NH2 2.86Å; M231-R243 HydrophobicContact SD-CG 3.87Å; M231-L246 HydrophobicContact CG-CD2 4.11Å; M231-L246 HydrophobicContact SD-CD2 4.1Å; M231-L246 HydrophobicContact SD-CG 4.45Å; M231-E247 HydrophobicContact CE-CB 3.81Å; M231-E247 HydrophobicContact CE-CG 3.9Å; M231-E247 HydrophobicContact SD-CB 4.48Å
232	D	86.6	Confident	84.3	Confident	42 Å²	42	64.3 Å²	64.3	23%	0.225	35%	0.345	C	S	.	.			trans	-63.7	107.9	-179.5	-179.7	-0.3	0	0	0	113	G228 S234 R235 R243	G228-D232 WeakPolarHBondContact O-CB 3.25Å; G228-D232 PolarHBondContact O-N 2.8Å; D232-S234 VanDerWaalsContact C-N 3.27Å; D232-S234 VanDerWaalsContact CG-OG 3.25Å; D232-S234 PolarHBondContact O-N 2.79Å; D232-S234 VanDerWaalsContact OD1-CB 3.3Å; D232-S234 WeakPolarHBondContact OD1-CB 3.5Å; D232-S234 PolarHBondContact OD1-N 2.82Å; D232-S234 PolarHBondContact OD1-OG 2.78Å; D232-S234 PolarHBondContact OD2-OG 2.8Å; D232-R235 IonicContact OD2-NE 3.94Å; D232-R235 PolarHBondContact OD2-NE 2.68Å; D232-R243 PolarHBondContact O-NH2 3.17Å
233	P	75.5	Confident	84.2	Confident	107 Å²	107	65.4 Å²	65.4	70%	0.695	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-18.2	-177	32	-35.2	0	0	0	113.7	M231 R235	M231-P233 VanDerWaalsContact O-CD 3.23Å; M231-P233 WeakPolarHBondContact O-CD 2.95Å; P233-R235 VanDerWaalsContact C-N 3.29Å; P233-R235 PolarHBondContact O-N 2.91Å
234	S	77.3	Confident	84.4	Confident	95 Å²	95	64 Å²	64	66%	0.664	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-25.5	-174.8	71.6	0	0	0	0	112.8	D232	D232-S234 VanDerWaalsContact C-N 3.27Å; D232-S234 VanDerWaalsContact CG-OG 3.25Å; D232-S234 PolarHBondContact O-N 2.79Å; D232-S234 VanDerWaalsContact OD1-CB 3.3Å; D232-S234 WeakPolarHBondContact OD1-CB 3.5Å; D232-S234 PolarHBondContact OD1-N 2.82Å; D232-S234 PolarHBondContact OD1-OG 2.78Å; D232-S234 PolarHBondContact OD2-OG 2.8Å
235	R	63.8	Low	84.5	Confident	80 Å²	80	65.3 Å²	65.3	30%	0.302	34%	0.341	S	S	.	.			trans	-89.8	124.4	-179.1	-61.2	-177.4	-176.8	-154.9	-4.9	109.8	D232 P233 S237 N332	D232-R235 IonicContact OD2-NE 3.94Å; D232-R235 PolarHBondContact OD2-NE 2.68Å; P233-R235 VanDerWaalsContact C-N 3.29Å; P233-R235 PolarHBondContact O-N 2.91Å; R235-S237 PolarHBondContact O-N 2.8Å; R235-N332 PolarHBondContact NH1-OD1 2.8Å
236	K	63	Low	84.5	Confident	210 Å²	210	64.4 Å²	64.4	91%	0.913	34%	0.335	S	S	*	.			trans	-67.5	50.6	151.7	-68.4	-176.1	178.9	179.9	0	109.5
237	S	65.9	Low	84.5	Confident	22 Å²	22	67.9 Å²	67.9	15%	0.154	35%	0.351	C	S	.	.			trans	-71.6	150.2	-177.2	68.6	0	0	0	0	109.1	R235 M239 Q240	R235-S237 PolarHBondContact O-N 2.8Å; S237-M239 PolarHBondContact O-N 2.87Å; S237-M239 PolarHBondContact OG-N 2.89Å; S237-Q240 PolarHBondContact O-N 2.83Å
238	N	74.8	Confident	84.5	Confident	118 Å²	118	70.6 Å²	70.6	63%	0.631	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-9.6	166.6	58.1	-17.4	0	0	0	113.2	H241	N238-H241 PolarHBondContact O-CE1 2.83Å; N238-H241 PolarHBondContact O-ND1 2.82Å
239	M	85.3	Confident	84.6	Confident	3 Å²	3	68.5 Å²	68.5	2%	0.015	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-4	-178.1	-55.7	179.7	-179.4	0	0	114.1	I229 V230 S237 H241 W242 N482 P483	I229-M239 HydrophobicContact CD1-SD 4.45Å; I229-M239 HydrophobicContact CG1-SD 4.28Å; I229-M239 HydrophobicContact CG2-SD 3.91Å; V230-M239 HydrophobicContact CG2-CB 4.5Å; V230-M239 HydrophobicContact CG2-SD 4.39Å; S237-M239 PolarHBondContact O-N 2.87Å; S237-M239 PolarHBondContact OG-N 2.89Å; M239-H241 PolarHBondContact O-N 3.11Å; M239-H241 VanDerWaalsContact O-N 3.09Å; M239-W242 HydrophobicContact CB-CE3 3.89Å; M239-W242 HydrophobicContact CB-CZ3 4.19Å; M239-W242 HydrophobicContact CG-CE3 4.03Å; M239-W242 HydrophobicContact CG-CZ3 3.82Å; M239-W242 PolarHBondContact O-N 2.85Å; M239-N482 HydrophobicContact CE-CB 3.59Å; M239-N482 WeakPolarHBondContact CE-OD1 3.2Å; M239-P483 HydrophobicContact CE-CG 4.23Å; M239-P483 HydrophobicContact SD-CG 4.32Å
240	Q	83.7	Confident	84.9	Confident	110 Å²	110	69.6 Å²	69.6	51%	0.514	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-56.4	-31.4	-175.8	-173	175.3	3.5	0	0	113.1	S237 W242 R243	S237-Q240 PolarHBondContact O-N 2.83Å; Q240-W242 PolarHBondContact O-N 2.96Å; Q240-R243 WeakPolarHBondContact O-CB 3.49Å; Q240-R243 PolarHBondContact O-N 3.2Å
241	H	88	Confident	84.9	Confident	119 Å²	119	75.6 Å²	75.6	55%	0.551	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-64.1	-22.6	178.5	68.3	-79.8	0	0	0	113.7	N238 M239	N238-H241 PolarHBondContact O-CE1 2.83Å; N238-H241 PolarHBondContact O-ND1 2.82Å; M239-H241 PolarHBondContact O-N 3.11Å; M239-H241 VanDerWaalsContact O-N 3.09Å
242	W	91.7	Very high	85	Confident	36 Å²	36	76 Å²	76	14%	0.136	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-86.4	-11.1	176.1	-67.2	-41.8	0	0	0	114.5	V230 M239 Q240 K244 P245 L246 P483 E484 F485 F487	V230-W242 HydrophobicContact CG1-CB 3.86Å; M239-W242 HydrophobicContact CB-CE3 3.89Å; M239-W242 HydrophobicContact CB-CZ3 4.19Å; M239-W242 HydrophobicContact CG-CE3 4.03Å; M239-W242 HydrophobicContact CG-CZ3 3.82Å; M239-W242 PolarHBondContact O-N 2.85Å; Q240-W242 PolarHBondContact O-N 2.96Å; W242-K244 PolarHBondContact O-N 3.01Å; W242-P245 WeakPolarHBondContact O-CD 3.41Å; W242-L246 WeakPolarHBondContact O-CB 3.29Å; W242-L246 PolarHBondContact O-N 3.47Å; W242-P483 WeakPolarHBondContact CH2-O 3.2Å; W242-P483 VanDerWaalsContact CZ3-O 3.29Å; W242-P483 WeakPolarHBondContact CZ3-O 3.38Å; W242-E484 HydrophobicContact CH2-CB 4.4Å; W242-E484 HydrophobicContact CH2-CG 4.18Å; W242-E484 HydrophobicContact CZ2-CG 4.13Å; W242-F485 HydrophobicContact CD2-CB 4.12Å; W242-F485 HydrophobicContact CD2-CD2 4.17Å; W242-F485 AromaticContact CE3-CD2 3.88Å; W242-F485 HydrophobicContact CE3-CD2 3.88Å; W242-F485 HydrophobicContact CG-CB 4.31Å; W242-F485 HydrophobicContact CZ3-CD2 4.25Å; W242-F485 PolarHBondContact NE1-O 3.28Å; W242-F487 HydrophobicContact CB-CD2 4.04Å; W242-F487 HydrophobicContact CB-CE2 4.09Å; W242-F487 AromaticContact CD1-CD2 3.83Å; W242-F487 HydrophobicContact CG-CD2 4.09Å; W242-F487 HydrophobicContact CG-CE2 4.34Å
243	R	91.3	Very high	85.2	Confident	51 Å²	51	74.3 Å²	74.3	19%	0.192	38%	0.375	C	S	.	.	H	α-helix	trans	-56.4	-54.7	-174.2	177.5	173.2	-67.4	155.3	9.5	113.1	V230 M231 D232 Q240 L246 E247	V230-R243 PolarHBondContact O-NE 3.39Å; V230-R243 PolarHBondContact O-NH2 2.98Å; V230-R243 VanDerWaalsContact O-NH2 3.16Å; M231-R243 PolarHBondContact O-NE 3.25Å; M231-R243 PolarHBondContact O-NH2 2.86Å; M231-R243 HydrophobicContact SD-CG 3.87Å; D232-R243 PolarHBondContact O-NH2 3.17Å; Q240-R243 WeakPolarHBondContact O-CB 3.49Å; Q240-R243 PolarHBondContact O-N 3.2Å; R243-L246 PolarHBondContact O-N 2.69Å; R243-E247 WeakPolarHBondContact O-CB 3.23Å; R243-E247 PolarHBondContact O-N 2.94Å
244	K	91.9	Very high	86.1	Confident	164 Å²	164	69.3 Å²	69.3	71%	0.713	34%	0.342	S	S	*	.	H	α-helix	trans	-65.9	-45.3	-176.1	-178.6	-179	-177.7	-178	0	112.3	W242 T248	W242-K244 PolarHBondContact O-N 3.01Å; K244-T248 PolarHBondContact O-N 3.21Å; K244-T248 VanDerWaalsContact O-N 3.14Å; K244-T248 PolarHBondContact O-OG1 3.36Å
245	P	94	Very high	86.9	Confident	44 Å²	44	66 Å²	66	29%	0.286	32%	0.315	S	S	.	.	H	α-helix	trans	-58	-47	171.2	-25.3	32.8	0	0	0	113.2	W242 E247 T248 I249 F487	W242-P245 WeakPolarHBondContact O-CD 3.41Å; P245-E247 PolarHBondContact O-N 3.01Å; P245-T248 WeakPolarHBondContact O-CB 2.88Å; P245-T248 PolarHBondContact O-N 3.49Å; P245-I249 WeakPolarHBondContact O-CG1 3.4Å; P245-I249 PolarHBondContact O-N 3.34Å; P245-F487 HydrophobicContact CB-CB 3.65Å; P245-F487 HydrophobicContact CB-CD2 3.92Å; P245-F487 HydrophobicContact CB-CG 4.06Å; P245-F487 HydrophobicContact CG-CB 4.46Å
246	L	94.9	Very high	88.5	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-59.7	-48	179.4	178.2	62.5	0	0	0	111.6	V230 M231 W242 R243 T248 I249 I250 P257 F487	V230-L246 HydrophobicContact CB-CD2 3.6Å; V230-L246 HydrophobicContact CG1-CB 4.44Å; V230-L246 HydrophobicContact CG1-CD2 3.55Å; V230-L246 HydrophobicContact CG2-CD2 4.22Å; M231-L246 HydrophobicContact CG-CD2 4.11Å; M231-L246 HydrophobicContact SD-CD2 4.1Å; M231-L246 HydrophobicContact SD-CG 4.45Å; W242-L246 WeakPolarHBondContact O-CB 3.29Å; W242-L246 PolarHBondContact O-N 3.47Å; R243-L246 PolarHBondContact O-N 2.69Å; L246-T248 PolarHBondContact O-N 3.39Å; L246-I249 PolarHBondContact O-N 3Å; L246-I249 VanDerWaalsContact O-N 3.16Å; L246-I250 HydrophobicContact CD1-CD1 3.79Å; L246-I250 HydrophobicContact CD1-CG1 4Å; L246-I250 HydrophobicContact CD2-CD1 4.25Å; L246-I250 HydrophobicContact CG-CD1 3.66Å; L246-I250 HydrophobicContact CG-CG1 4.26Å; L246-I250 VanDerWaalsContact O-CG1 3.32Å; L246-I250 WeakPolarHBondContact O-CG1 3.28Å; L246-I250 PolarHBondContact O-N 2.8Å; L246-P257 HydrophobicContact CD1-CB 4.26Å; L246-P257 HydrophobicContact CD1-CG 3.79Å; L246-F487 HydrophobicContact CB-CE2 3.89Å; L246-F487 HydrophobicContact CB-CZ 4.37Å; L246-F487 HydrophobicContact CD1-CE2 4.19Å; L246-F487 HydrophobicContact CD1-CZ 3.85Å
247	E	94	Very high	90	Very high	73 Å²	73	54.4 Å²	54.4	34%	0.341	27%	0.266	S	S	.	.	H	α-helix	trans	-58	-39.6	178.1	-170.3	-179.8	175.5	0	0	112	M231 R243 P245 K251	M231-E247 HydrophobicContact CE-CB 3.81Å; M231-E247 HydrophobicContact CE-CG 3.9Å; M231-E247 HydrophobicContact SD-CB 4.48Å; R243-E247 WeakPolarHBondContact O-CB 3.23Å; R243-E247 PolarHBondContact O-N 2.94Å; P245-E247 PolarHBondContact O-N 3.01Å; E247-K251 HydrophobicContact CG-CD 4.31Å; E247-K251 WeakPolarHBondContact O-CB 3.17Å; E247-K251 VanDerWaalsContact O-CG 3.31Å; E247-K251 WeakPolarHBondContact O-CG 3.49Å; E247-K251 PolarHBondContact O-N 2.92Å; E247-K251 VanDerWaalsContact O-N 3.1Å; E247-K251 WeakPolarHBondContact OE1-CE 3.44Å; E247-K251 IonicContact OE1-NZ 2.76Å; E247-K251 PolarHBondContact OE1-NZ 2.78Å
248	T	93.6	Very high	91.5	Very high	78 Å²	78	53.9 Å²	53.9	48%	0.479	26%	0.261	S	S	.	.	H	α-helix	trans	-63.6	-46.7	177.2	-55.2	0	0	0	0	110.8	K244 P245 L246 K251 T252	K244-T248 PolarHBondContact O-N 3.21Å; K244-T248 VanDerWaalsContact O-N 3.14Å; K244-T248 PolarHBondContact O-OG1 3.36Å; P245-T248 WeakPolarHBondContact O-CB 2.88Å; P245-T248 PolarHBondContact O-N 3.49Å; L246-T248 PolarHBondContact O-N 3.39Å; T248-K251 PolarHBondContact O-N 2.94Å; T248-T252 WeakPolarHBondContact O-CB 3.3Å; T248-T252 WeakPolarHBondContact O-CG2 3.49Å; T248-T252 PolarHBondContact O-N 2.82Å; T248-T252 VanDerWaalsContact O-N 3.13Å; T248-T252 PolarHBondContact O-OG1 2.78Å
249	I	93.7	Very high	92.5	Very high	8 Å²	8	48.7 Å²	48.7	4%	0.041	23%	0.234	C	C	.	.	H	α-helix	trans	-66.3	-44.1	179.7	-63.5	158.8	0	0	0	110.9	P245 L246 K251 T252 A253 C254 P257 F487 Y492	P245-I249 WeakPolarHBondContact O-CG1 3.4Å; P245-I249 PolarHBondContact O-N 3.34Å; L246-I249 PolarHBondContact O-N 3Å; L246-I249 VanDerWaalsContact O-N 3.16Å; I249-K251 PolarHBondContact O-N 3.09Å; I249-T252 PolarHBondContact O-N 2.83Å; I249-T252 VanDerWaalsContact O-N 3.15Å; I249-A253 HydrophobicContact CG2-CB 4.36Å; I249-A253 PolarHBondContact O-N 2.91Å; I249-C254 HydrophobicContact CG2-CB 4.13Å; I249-C254 PolarHBondContact O-N 2.91Å; I249-C254 VanDerWaalsContact O-N 3.08Å; I249-P257 HydrophobicContact CB-CG 4.23Å; I249-P257 HydrophobicContact CG2-CB 4.31Å; I249-P257 HydrophobicContact CG2-CG 3.51Å; I249-F487 HydrophobicContact CD1-CD1 3.42Å; I249-F487 VanDerWaalsContact CD1-CD1 3.42Å; I249-F487 HydrophobicContact CD1-CE1 3.63Å; I249-F487 HydrophobicContact CD1-CG 3.99Å; I249-F487 HydrophobicContact CD1-CZ 4.35Å; I249-Y492 HydrophobicContact CG1-CD1 4.42Å; I249-Y492 HydrophobicContact CG2-CD1 4.24Å; I249-Y492 HydrophobicContact CG2-CD2 4.43Å; I249-Y492 HydrophobicContact CG2-CG 4.01Å
250	I	93.7	Very high	92.9	Very high	38 Å²	38	53.9 Å²	53.9	20%	0.195	26%	0.257	C	S	.	.	H	α-helix	trans	-58	-38.4	177.9	-69.9	172.6	0	0	0	111.3	N227 L246 C254 P257 R673 F679	N227-I250 HydrophobicContact CB-CD1 4.3Å; L246-I250 HydrophobicContact CD1-CD1 3.79Å; L246-I250 HydrophobicContact CD1-CG1 4Å; L246-I250 HydrophobicContact CD2-CD1 4.25Å; L246-I250 HydrophobicContact CG-CD1 3.66Å; L246-I250 HydrophobicContact CG-CG1 4.26Å; L246-I250 VanDerWaalsContact O-CG1 3.32Å; L246-I250 WeakPolarHBondContact O-CG1 3.28Å; L246-I250 PolarHBondContact O-N 2.8Å; I250-C254 VanDerWaalsContact CA-O 3.28Å; I250-C254 WeakPolarHBondContact CA-O 3.18Å; I250-P257 HydrophobicContact CG1-CG 4.45Å; I250-R673 PolarHBondContact O-NH2 3.23Å; I250-F679 WeakPolarHBondContact O-CE2 3.11Å; I250-F679 WeakPolarHBondContact O-CZ 3.03Å
251	K	91.1	Very high	93.5	Very high	125 Å²	125	50.3 Å²	50.3	54%	0.543	24%	0.24	S	C	.	.	H	α-helix	trans	-75	-31.9	179.6	-73.9	177.6	-174.5	174.9	0	113.3	E247 T248 I249 F679	E247-K251 HydrophobicContact CG-CD 4.31Å; E247-K251 WeakPolarHBondContact O-CB 3.17Å; E247-K251 VanDerWaalsContact O-CG 3.31Å; E247-K251 WeakPolarHBondContact O-CG 3.49Å; E247-K251 PolarHBondContact O-N 2.92Å; E247-K251 VanDerWaalsContact O-N 3.1Å; E247-K251 WeakPolarHBondContact OE1-CE 3.44Å; E247-K251 IonicContact OE1-NZ 2.76Å; E247-K251 PolarHBondContact OE1-NZ 2.78Å; T248-K251 PolarHBondContact O-N 2.94Å; I249-K251 PolarHBondContact O-N 3.09Å; K251-F679 WeakPolarHBondContact O-CZ 3.32Å
252	T	90.5	Very high	93.9	Very high	73 Å²	73	44.8 Å²	44.8	45%	0.448	21%	0.214	S	C	.	.	H	α-helix	trans	-114.9	-22	-163.9	58.9	0	0	0	0	115.6	T248 I249 F679	T248-T252 WeakPolarHBondContact O-CB 3.3Å; T248-T252 WeakPolarHBondContact O-CG2 3.49Å; T248-T252 PolarHBondContact O-N 2.82Å; T248-T252 VanDerWaalsContact O-N 3.13Å; T248-T252 PolarHBondContact O-OG1 2.78Å; I249-T252 PolarHBondContact O-N 2.83Å; I249-T252 VanDerWaalsContact O-N 3.15Å; T252-F679 VanDerWaalsContact C-CE1 3.42Å
253	A	91.5	Very high	94.1	Very high	7 Å²	7	46.9 Å²	46.9	6%	0.058	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141.7	-48.4	-167.6	0	0	0	0	0	115	I249 Y492 F679 Y681	I249-A253 HydrophobicContact CG2-CB 4.36Å; I249-A253 PolarHBondContact O-N 2.91Å; A253-Y492 HydrophobicContact CB-CE1 3.78Å; A253-Y492 HydrophobicContact CB-CE2 4.21Å; A253-F679 VanDerWaalsContact C-CD2 3.48Å; A253-F679 WeakPolarHBondContact O-CB 3.47Å; A253-F679 VanDerWaalsContact O-CD2 3.25Å; A253-F679 WeakPolarHBondContact O-CD2 3.09Å; A253-F679 WeakPolarHBondContact O-CG 3.47Å; A253-Y681 PolarHBondContact O-OH 2.69Å
254	C	94.6	Very high	94.4	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.007	21%	0.213	C	C	.	.			trans	-147.1	126.3	-169.7	-178.1	0	0	0	0	111.2	I249 I250 Y256 P257 Y492 C494	I249-C254 HydrophobicContact CG2-CB 4.13Å; I249-C254 PolarHBondContact O-N 2.91Å; I249-C254 VanDerWaalsContact O-N 3.08Å; I250-C254 VanDerWaalsContact CA-O 3.28Å; I250-C254 WeakPolarHBondContact CA-O 3.18Å; C254-Y256 VanDerWaalsContact C-N 3.32Å; C254-Y256 PolarHBondContact O-N 3.17Å; C254-Y256 VanDerWaalsContact SG-C 3.57Å; C254-P257 HydrophobicContact CB-CG 4.32Å; C254-Y492 HydrophobicContact CB-CD2 4.4Å; C254-Y492 HydrophobicContact CB-CE2 4.43Å; C254-C494 HydrophobicContact CB-CB 3.68Å; C254-C494 WeakPolarHBondContact CB-SG 3.32Å; C254-C494 WeakPolarHBondContact SG-CB 3.29Å; C254-C494 CovalentContact SG-SG 2.03Å; C254-C494 PolarHBondContact SG-SG 3.43Å
255	R	94.7	Very high	94.6	Very high	25 Å²	25	37.9 Å²	37.9	9%	0.094	19%	0.19	C	C	.	.	S	Bend	trans	-64.6	-36.7	-179.7	-69.3	177.8	-74.5	172.9	-0.4	112.7	D219 E221 N227 N677 F679	D219-R255 VanDerWaalsContact CG-NE 3.3Å; D219-R255 PolarHBondContact O-NH2 3.49Å; D219-R255 IonicContact OD1-CZ 3.64Å; D219-R255 VanDerWaalsContact OD1-CZ 3.31Å; D219-R255 IonicContact OD1-NE 2.69Å; D219-R255 PolarHBondContact OD1-NE 3.39Å; D219-R255 IonicContact OD1-NH2 3.76Å; D219-R255 PolarHBondContact OD1-NH2 2.94Å; D219-R255 WeakPolarHBondContact OD2-CB 3.34Å; D219-R255 WeakPolarHBondContact OD2-CG 3.29Å; D219-R255 IonicContact OD2-CZ 3.47Å; D219-R255 PolarHBondContact OD2-N 3.02Å; D219-R255 IonicContact OD2-NE 3.55Å; D219-R255 PolarHBondContact OD2-NE 2.77Å; D219-R255 IonicContact OD2-NH2 2.99Å; E221-R255 IonicContact OE2-NH1 2.88Å; N227-R255 PolarHBondContact ND2-O 3.34Å; R255-N677 WeakPolarHBondContact CD-O 2.98Å; R255-F679 HydrophobicContact CG-CD2 4.06Å; R255-F679 HydrophobicContact CG-CE2 4.04Å
256	Y	95.8	Very high	94.7	Very high	48 Å²	48	35.9 Å²	35.9	19%	0.188	18%	0.176	C	C	.	.	S	Bend	trans	-132.1	77.9	-175.3	-53.1	-77.2	0	0	0	110.8	V220 E221 H222 S225 C254 L258	V220-Y256 WeakPolarHBondContact O-CD2 3.45Å; E221-Y256 HydrophobicContact CG-CE2 4.33Å; H222-Y256 HydrophobicContact CB-CD2 4.43Å; H222-Y256 HydrophobicContact CB-CG 4.45Å; S225-Y256 VanDerWaalsContact CB-CD1 3.48Å; C254-Y256 VanDerWaalsContact C-N 3.32Å; C254-Y256 PolarHBondContact O-N 3.17Å; C254-Y256 VanDerWaalsContact SG-C 3.57Å; Y256-L258 PolarHBondContact O-N 3.4Å
257	P	96.4	Very high	94.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-58.4	136.3	175.7	-25.3	38.2	0	0	0	110.7	L246 I249 I250 C254 F485 F487 T493	L246-P257 HydrophobicContact CD1-CB 4.26Å; L246-P257 HydrophobicContact CD1-CG 3.79Å; I249-P257 HydrophobicContact CB-CG 4.23Å; I249-P257 HydrophobicContact CG2-CB 4.31Å; I249-P257 HydrophobicContact CG2-CG 3.51Å; I250-P257 HydrophobicContact CG1-CG 4.45Å; C254-P257 HydrophobicContact CB-CG 4.32Å; P257-F485 WeakPolarHBondContact O-CE1 3.36Å; P257-F487 HydrophobicContact CB-CE1 4.07Å; P257-F487 HydrophobicContact CB-CZ 4.21Å; P257-T493 WeakPolarHBondContact CA-O 3.24Å
258	L	96.9	Very high	94.6	Very high	11 Å²	11	35.7 Å²	35.7	6%	0.058	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-83.2	137.9	179.7	-59.6	-179.2	0	0	0	110.6	Y256 T493 H495 I587 P630 F631 I656	Y256-L258 PolarHBondContact O-N 3.4Å; L258-T493 HydrophobicContact CB-CG2 4.32Å; L258-T493 HydrophobicContact CD1-CG2 4.09Å; L258-T493 PolarHBondContact N-O 3.06Å; L258-H495 HydrophobicContact CD1-CB 4.19Å; L258-H495 HydrophobicContact CD2-CB 4.49Å; L258-I587 HydrophobicContact CD1-CD1 3.64Å; L258-P630 HydrophobicContact CD2-CB 3.86Å; L258-F631 HydrophobicContact CD2-CD2 3.96Å; L258-F631 HydrophobicContact CD2-CE1 4.4Å; L258-F631 HydrophobicContact CD2-CE2 3.36Å; L258-F631 HydrophobicContact CD2-CZ 3.63Å; L258-I656 HydrophobicContact CD1-CG2 4.17Å
259	P	95.6	Very high	94.5	Very high	8 Å²	8	34.9 Å²	34.9	5%	0.052	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-68.4	151.3	167.2	28	-30.2	0	0	0	110.3	Q261 Y262 P483 E484 F485	P259-Q261 VanDerWaalsContact C-N 3.28Å; P259-Y262 HydrophobicContact CG-CD2 4.32Å; P259-Y262 HydrophobicContact CG-CE1 3.81Å; P259-Y262 HydrophobicContact CG-CE2 3.54Å; P259-Y262 WeakPolarHBondContact CG-OH 3.4Å; P259-P483 HydrophobicContact CB-CB 3.77Å; P259-P483 HydrophobicContact CG-CB 4.06Å; P259-E484 CarbonylContact C-O 3.57Å; P259-E484 WeakPolarHBondContact CA-O 3.39Å; P259-E484 VanDerWaalsContact CB-O 3.26Å; P259-E484 WeakPolarHBondContact CB-O 3.48Å; P259-F485 HydrophobicContact CB-CD1 4Å; P259-F485 HydrophobicContact CB-CE1 3.81Å; P259-F485 HydrophobicContact CB-CE2 4.48Å; P259-F485 HydrophobicContact CB-CG 4.44Å; P259-F485 HydrophobicContact CB-CZ 4.07Å; P259-F485 HydrophobicContact CG-CE1 4.34Å; P259-F485 HydrophobicContact CG-CZ 4.46Å
260	K	94.5	Very high	94.2	Very high	113 Å²	113	38.1 Å²	38.1	49%	0.491	18%	0.182	S	C	.	.	S	Bend	trans	-61.7	-42.6	173.9	178.4	178.5	177.9	177.9	0	110.4	E484 D486 Q626	K260-E484 PolarHBondContact N-O 3.09Å; K260-D486 HydrophobicContact CD-CB 4.38Å; K260-Q626 PolarHBondContact O-NE2 3.09Å
261	Q	95.5	Very high	93.6	Very high	34 Å²	34	39.7 Å²	39.7	16%	0.159	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	175.5	-178.8	60.5	-168.8	13.8	0	0	110.4	P259 E484 V624 A653	P259-Q261 VanDerWaalsContact C-N 3.28Å; Q261-E484 HydrophobicContact CG-CB 4.06Å; Q261-E484 WeakPolarHBondContact CG-OE2 3.17Å; Q261-E484 PolarHBondContact NE2-OE2 3.08Å; Q261-E484 PolarHBondContact O-N 3.31Å; Q261-V624 HydrophobicContact CB-CG1 4.18Å; Q261-V624 HydrophobicContact CG-CG1 3.82Å; Q261-A653 HydrophobicContact CB-CB 4.39Å
262	Y	96.9	Very high	93.3	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.016	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	142.7	174.6	-67.3	-91.2	0	0	0	111.4	D226 P259 L481 N482 P483 V624 V625 F627	D226-Y262 VanDerWaalsContact OD2-CE1 3.3Å; D226-Y262 WeakPolarHBondContact OD2-CE1 3.49Å; D226-Y262 PolarHBondContact OD2-OH 2.79Å; P259-Y262 HydrophobicContact CG-CD2 4.32Å; P259-Y262 HydrophobicContact CG-CE1 3.81Å; P259-Y262 HydrophobicContact CG-CE2 3.54Å; P259-Y262 WeakPolarHBondContact CG-OH 3.4Å; Y262-L481 HydrophobicContact CD1-CD1 3.91Å; Y262-L481 HydrophobicContact CD1-CD2 4.02Å; Y262-L481 HydrophobicContact CD1-CG 3.84Å; Y262-L481 HydrophobicContact CE1-CD2 4.23Å; Y262-L481 HydrophobicContact CE1-CG 4.48Å; Y262-L481 HydrophobicContact CG-CD1 4.06Å; Y262-L481 HydrophobicContact CG-CG 4.49Å; Y262-N482 WeakPolarHBondContact CA-O 3.35Å; Y262-P483 HydrophobicContact CD1-CB 4.03Å; Y262-P483 HydrophobicContact CE1-CB 3.82Å; Y262-V624 WeakPolarHBondContact O-CA 3.46Å; Y262-V625 PolarHBondContact N-O 2.88Å; Y262-V625 PolarHBondContact O-N 3.03Å; Y262-F627 HydrophobicContact CD1-CE2 4.15Å; Y262-F627 AromaticContact CD2-CD2 3.64Å; Y262-F627 HydrophobicContact CD2-CD2 3.64Å; Y262-F627 AromaticContact CD2-CE2 3.37Å; Y262-F627 HydrophobicContact CD2-CE2 3.37Å; Y262-F627 HydrophobicContact CD2-CZ 4.32Å; Y262-F627 HydrophobicContact CE1-CE2 4.36Å; Y262-F627 AromaticContact CE2-CD2 3.57Å; Y262-F627 HydrophobicContact CE2-CD2 3.57Å; Y262-F627 AromaticContact CE2-CE2 3.62Å; Y262-F627 HydrophobicContact CE2-CE2 3.62Å; Y262-F627 HydrophobicContact CG-CD2 4.38Å; Y262-F627 AromaticContact CG-CE2 3.66Å; Y262-F627 HydrophobicContact CG-CE2 3.66Å; Y262-F627 HydrophobicContact CG-CZ 4.35Å
263	Y	95.8	Very high	93.1	Very high	79 Å²	79	31.3 Å²	31.3	31%	0.31	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	119.3	162.8	-64.6	-82.2	0	0	0	108.9	N482 E484 Y622 V624	Y263-N482 PolarHBondContact N-O 3.37Å; Y263-N482 PolarHBondContact O-N 2.85Å; Y263-E484 HydrophobicContact CD2-CB 4.25Å; Y263-E484 HydrophobicContact CE2-CB 3.76Å; Y263-E484 HydrophobicContact CE2-CG 4.08Å; Y263-E484 WeakPolarHBondContact CE2-OE2 3.31Å; Y263-E484 PolarHBondContact OH-OE2 2.69Å; Y263-Y622 HydrophobicContact CD1-CD2 4.29Å; Y263-V624 HydrophobicContact CD1-CG1 4.42Å; Y263-V624 HydrophobicContact CD1-CG2 3.84Å; Y263-V624 HydrophobicContact CE1-CG1 4.16Å; Y263-V624 HydrophobicContact CE1-CG2 3.61Å
264	L	96.7	Very high	92.9	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	111.1	169.7	177.2	54.1	0	0	0	108.2	L342 L346 F347 F479 L481 Y622 I623 V625 W638	L264-L342 HydrophobicContact CD2-CD1 4.19Å; L264-L346 HydrophobicContact CD2-CD2 4.23Å; L264-F347 HydrophobicContact CD2-CE2 4.01Å; L264-F347 HydrophobicContact CD2-CZ 4.41Å; L264-F347 HydrophobicContact CG-CE2 3.98Å; L264-F347 HydrophobicContact CG-CZ 3.91Å; L264-F347 WeakPolarHBondContact O-CZ 3.26Å; L264-F479 HydrophobicContact CD1-CB 4.32Å; L264-L481 HydrophobicContact CB-CD1 4.35Å; L264-Y622 VanDerWaalsContact O-CA 3.26Å; L264-Y622 WeakPolarHBondContact O-CA 2.93Å; L264-I623 HydrophobicContact CB-CD1 4.38Å; L264-I623 HydrophobicContact CB-CG1 3.86Å; L264-I623 HydrophobicContact CD2-CD1 4.17Å; L264-I623 HydrophobicContact CG-CG1 4.37Å; L264-I623 PolarHBondContact N-O 3.15Å; L264-I623 PolarHBondContact O-N 2.88Å; L264-V625 HydrophobicContact CB-CG2 4.32Å; L264-W638 HydrophobicContact CD1-CH2 3.93Å; L264-W638 HydrophobicContact CD1-CZ2 3.31Å; L264-W638 HydrophobicContact CD2-CH2 3.94Å; L264-W638 HydrophobicContact CD2-CZ2 4.13Å; L264-W638 HydrophobicContact CG-CZ2 4.38Å
265	A	95.7	Very high	92.5	Very high	26 Å²	26	31.3 Å²	31.3	22%	0.215	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	142.3	-178.5	0	0	0	0	0	111.1	F479 T480 K621	A265-F479 CarbonylContact O-C 3.5Å; A265-F479 VanDerWaalsContact O-CA 3.3Å; A265-F479 WeakPolarHBondContact O-CA 3.01Å; A265-T480 PolarHBondContact N-O 2.88Å; A265-T480 PolarHBondContact O-N 3.19Å; A265-K621 CarbonylContact C-O 3.6Å; A265-K621 WeakPolarHBondContact CA-O 3.45Å
266	M	96.4	Very high	92.1	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.01	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	118.3	172.3	-178.2	-149.6	77.7	0	0	108.9	F347 E349 L477 K478 F479 K621	M266-F347 HydrophobicContact CB-CD1 3.48Å; M266-F347 VanDerWaalsContact CB-CD1 3.48Å; M266-F347 HydrophobicContact CB-CE1 3.39Å; M266-F347 HydrophobicContact CB-CG 4.12Å; M266-F347 HydrophobicContact CB-CZ 3.95Å; M266-F347 HydrophobicContact CG-CD1 4.26Å; M266-F347 HydrophobicContact SD-CB 4.05Å; M266-F347 HydrophobicContact SD-CD1 4Å; M266-F347 HydrophobicContact SD-CG 4.16Å; M266-E349 HydrophobicContact CE-CG 3.86Å; M266-E349 HydrophobicContact SD-CB 4.31Å; M266-E349 HydrophobicContact SD-CG 3.69Å; M266-L477 HydrophobicContact CE-CD2 4.4Å; M266-L477 HydrophobicContact CG-CB 4.16Å; M266-L477 HydrophobicContact CG-CD1 4.47Å; M266-L477 HydrophobicContact CG-CD2 4.41Å; M266-L477 HydrophobicContact SD-CD1 3.9Å; M266-L477 HydrophobicContact SD-CD2 4.08Å; M266-L477 HydrophobicContact SD-CG 4.42Å; M266-K478 CarbonylContact C-O 3.6Å; M266-K478 VanDerWaalsContact CA-O 3.28Å; M266-K478 WeakPolarHBondContact CA-O 2.99Å; M266-F479 HydrophobicContact CB-CD1 3.96Å; M266-F479 HydrophobicContact CB-CE1 3.69Å; M266-F479 HydrophobicContact CG-CD1 4.13Å; M266-F479 HydrophobicContact CG-CE1 3.55Å; M266-F479 HydrophobicContact CG-CZ 3.88Å; M266-F479 HydrophobicContact SD-CE1 4.36Å; M266-F479 HydrophobicContact SD-CZ 4.44Å; M266-K621 HydrophobicContact CB-CB 4.47Å; M266-K621 HydrophobicContact CE-CB 3.99Å; M266-K621 HydrophobicContact CE-CD 3.77Å; M266-K621 HydrophobicContact CE-CG 3.72Å; M266-K621 PolarHBondContact N-O 2.77Å; M266-K621 PolarHBondContact O-N 3.13Å
267	H	94.5	Very high	91.5	Very high	56 Å²	56	35.6 Å²	35.6	26%	0.259	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	121.9	174.7	-179.8	92.1	0	0	0	109.9	Y269 K478 E620	H267-Y269 AromaticContact CD2-CD2 3.96Å; H267-Y269 AromaticContact CD2-CE2 3.58Å; H267-Y269 AromaticContact CD2-CZ 3.63Å; H267-Y269 AromaticContact NE2-CE1 3.93Å; H267-Y269 AromaticContact NE2-CZ 3.91Å; H267-K478 HydrophobicContact CB-CB 4.39Å; H267-K478 PolarHBondContact N-O 2.93Å; H267-K478 PolarHBondContact O-N 3.4Å; H267-E620 HydrophobicContact CB-CG 4.48Å; H267-E620 IonicContact CE1-OE1 3.41Å; H267-E620 IonicContact CG-OE1 2.92Å; H267-E620 IonicContact ND1-OE1 3.48Å; H267-E620 PolarHBondContact ND1-OE1 3.03Å
268	P	92.9	Very high	90.8	Very high	13 Å²	13	39.6 Å²	39.6	8%	0.084	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	128	179.4	33.5	-32.2	0	0	0	112.1	L270 L477 E619	P268-L270 HydrophobicContact CB-CD2 4.08Å; P268-L477 HydrophobicContact CB-CD2 3.75Å; P268-E619 VanDerWaalsContact CD-O 3.28Å; P268-E619 WeakPolarHBondContact CD-O 3.35Å; P268-E619 HydrophobicContact CG-CB 3.97Å; P268-E619 VanDerWaalsContact CG-O 3.32Å; P268-E619 WeakPolarHBondContact CG-O 3.32Å
269	Y	91	Very high	89.9	Confident	62 Å²	62	42 Å²	42	24%	0.243	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	104.4	161.8	-63.6	-88.1	0	0	0	108.8	H267 R272 L327 Y335 K475 T476 K478	H267-Y269 AromaticContact CD2-CD2 3.96Å; H267-Y269 AromaticContact CD2-CE2 3.58Å; H267-Y269 AromaticContact CD2-CZ 3.63Å; H267-Y269 AromaticContact NE2-CE1 3.93Å; H267-Y269 AromaticContact NE2-CZ 3.91Å; Y269-R272 VanDerWaalsContact CB-CD 3.44Å; Y269-L327 HydrophobicContact CD1-CD2 4.14Å; Y269-L327 HydrophobicContact CD2-CD1 3.98Å; Y269-L327 HydrophobicContact CD2-CD2 4.3Å; Y269-L327 HydrophobicContact CE1-CD2 3.74Å; Y269-L327 HydrophobicContact CE2-CD1 4.18Å; Y269-L327 HydrophobicContact CE2-CD2 3.91Å; Y269-L327 HydrophobicContact CG-CD1 4.31Å; Y269-L327 HydrophobicContact CG-CD2 4.4Å; Y269-Y335 HydrophobicContact CE2-CE1 4.03Å; Y269-K475 CarbonylContact O-C 3.55Å; Y269-K475 WeakPolarHBondContact O-CA 3.48Å; Y269-T476 PolarHBondContact N-O 3.33Å; Y269-T476 PolarHBondContact O-N 3.32Å; Y269-K478 HydrophobicContact CD2-CB 4.47Å; Y269-K478 HydrophobicContact CE2-CB 3.91Å; Y269-K478 HydrophobicContact CE2-CD 4.26Å
270	L	86.6	Confident	88.8	Confident	76 Å²	76	44.5 Å²	44.5	40%	0.398	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	151.9	-177.1	-55.1	-179.7	0	0	0	111.5	P268 R272 K475	P268-L270 HydrophobicContact CB-CD2 4.08Å; L270-R272 VanDerWaalsContact C-N 3.25Å; L270-R272 PolarHBondContact O-N 3.37Å; L270-R272 VanDerWaalsContact O-N 3.09Å; L270-K475 HydrophobicContact CD2-CD 3.72Å; L270-K475 HydrophobicContact CD2-CG 3.79Å
271	D	81.3	Confident	87.5	Confident	71 Å²	71	39.5 Å²	39.5	38%	0.38	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	48.5	40.8	171.3	-62.5	-42.9	0	0	0	115.1	H273 Q473	D271-H273 PolarHBondContact O-CD2 3.17Å; D271-H273 PolarHBondContact O-NE2 3.32Å; D271-Q473 HydrophobicContact CB-CG 4.42Å; D271-Q473 PolarHBondContact OD1-NE2 3.03Å
272	R	86.4	Confident	86.1	Confident	3 Å²	3	44 Å²	44	1%	0.011	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	131.7	175.2	-75.3	-172.7	63.2	99.5	-3.7	110.3	Y269 L270 I306 N307 S325 L327 Q473 G474 T476	Y269-R272 VanDerWaalsContact CB-CD 3.44Å; L270-R272 VanDerWaalsContact C-N 3.25Å; L270-R272 PolarHBondContact O-N 3.37Å; L270-R272 VanDerWaalsContact O-N 3.09Å; R272-I306 PolarHBondContact NH2-O 3.35Å; R272-N307 PolarHBondContact NH2-OD1 3.43Å; R272-S325 PolarHBondContact NH1-O 2.91Å; R272-S325 PolarHBondContact NH2-O 3.11Å; R272-L327 VanDerWaalsContact CZ-CD1 3.4Å; R272-L327 VanDerWaalsContact NH1-CG 3.28Å; R272-Q473 WeakPolarHBondContact O-CA 3.48Å; R272-G474 PolarHBondContact N-O 3.48Å; R272-G474 PolarHBondContact O-N 2.91Å; R272-G474 VanDerWaalsContact O-N 3.1Å; R272-T476 WeakPolarHBondContact CD-OG1 3.37Å
273	H	85.6	Confident	84.3	Confident	19 Å²	19	47.7 Å²	47.7	9%	0.088	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	105.6	-179.2	-60.2	-92.2	0	0	0	109.7	D271 I320 A324 S356 L472 Q473	D271-H273 PolarHBondContact O-CD2 3.17Å; D271-H273 PolarHBondContact O-NE2 3.32Å; H273-I320 HydrophobicContact CB-CG2 3.9Å; H273-A324 WeakPolarHBondContact O-CB 3.23Å; H273-S356 PolarHBondContact CE1-OG 2.76Å; H273-S356 PolarHBondContact ND1-OG 3.19Å; H273-L472 WeakPolarHBondContact CA-O 3.26Å; H273-Q473 PolarHBondContact CE1-OE1 3.49Å
274	T	86.8	Confident	82.3	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	158.4	-177.4	53.2	0	0	0	0	112	R304 S305 G308 C310 L472	T274-R304 VanDerWaalsContact OG1-CD 3.26Å; T274-R304 WeakPolarHBondContact OG1-CD 3.49Å; T274-R304 WeakPolarHBondContact OG1-CG 3.47Å; T274-R304 PolarHBondContact OG1-NH1 3.25Å; T274-S305 WeakPolarHBondContact CB-O 3.31Å; T274-S305 PolarHBondContact OG1-O 3.18Å; T274-G308 CarbonylContact C-O 3.55Å; T274-G308 WeakPolarHBondContact CA-O 3.31Å; T274-G308 WeakPolarHBondContact CB-O 3.34Å; T274-C310 VanDerWaalsContact C-SG 3.53Å; T274-L472 PolarHBondContact N-O 3.24Å; T274-L472 PolarHBondContact O-N 3.21Å
275	T	85.7	Confident	80.1	Confident	6 Å²	6	55.6 Å²	55.6	4%	0.037	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	145.1	177.4	56	0	0	0	0	110.6	S305 G308 Q309 E469 I470	T275-S305 WeakPolarHBondContact O-CB 3.28Å; T275-S305 PolarHBondContact O-N 2.75Å; T275-G308 PolarHBondContact N-O 2.99Å; T275-G308 VanDerWaalsContact OG1-CA 3.31Å; T275-G308 WeakPolarHBondContact OG1-CA 3.44Å; T275-Q309 VanDerWaalsContact CG2-C 3.5Å; T275-Q309 WeakPolarHBondContact CG2-O 3.27Å; T275-E469 VanDerWaalsContact CB-OE1 3.29Å; T275-E469 WeakPolarHBondContact CB-OE1 3.42Å; T275-E469 HydrophobicContact CG2-CG 4.2Å; T275-E469 WeakPolarHBondContact CG2-OE1 3.42Å; T275-I470 CarbonylContact C-O 3.31Å; T275-I470 WeakPolarHBondContact CA-O 3.35Å
276	A	86.5	Confident	77.7	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135.3	171.4	0	0	0	0	0	110.2	D303 R304 E469 I470 L472	A276-D303 CarbonylContact C-O 3.53Å; A276-D303 WeakPolarHBondContact CA-O 3.38Å; A276-R304 HydrophobicContact CB-CB 4.03Å; A276-R304 HydrophobicContact CB-CG 4.36Å; A276-E469 WeakPolarHBondContact O-CA 3.22Å; A276-I470 HydrophobicContact CB-CG1 4.13Å; A276-I470 PolarHBondContact N-O 2.91Å; A276-I470 PolarHBondContact O-N 3.2Å; A276-L472 HydrophobicContact CB-CB 4.25Å; A276-L472 HydrophobicContact CB-CD1 3.39Å; A276-L472 HydrophobicContact CB-CG 3.6Å
277	R	84.3	Confident	75.1	Confident	163 Å²	163	67.6 Å²	67.6	62%	0.615	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	139.7	-176.6	-70	-176.5	179.3	171.9	-0.5	110.8	H279 Y302 D303	R277-H279 PolarHBondContact O-CD2 3.44Å; R277-H279 PolarHBondContact O-N 2.96Å; R277-Y302 CarbonylContact O-C 3.55Å; R277-Y302 WeakPolarHBondContact O-CA 3.35Å; R277-D303 PolarHBondContact N-O 3.02Å; R277-D303 PolarHBondContact O-N 3.21Å
278	R	81	Confident	72.8	Confident	84 Å²	84	66.6 Å²	66.6	32%	0.317	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	125.2	178.9	-173	174	170	-101.5	-0.1	110.7	I300 Y302 A467 T468	R278-I300 HydrophobicContact CG-CG2 3.56Å; R278-I300 VanDerWaalsContact NE-CG2 3.34Å; R278-Y302 HydrophobicContact CB-CD1 4.12Å; R278-Y302 HydrophobicContact CB-CE1 3.74Å; R278-Y302 HydrophobicContact CG-CE1 4.26Å; R278-A467 WeakPolarHBondContact CD-O 3.25Å; R278-T468 PolarHBondContact N-O 2.89Å
279	H	77.3	Confident	70.8	Confident	61 Å²	61	76.2 Å²	76.2	28%	0.282	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	135.9	171.7	-77.6	-82.8	0	0	0	110.2	R277 I300 F301 D303	R277-H279 PolarHBondContact O-CD2 3.44Å; R277-H279 PolarHBondContact O-N 2.96Å; H279-I300 WeakPolarHBondContact O-CA 3.33Å; H279-F301 HydrophobicContact CB-CD1 4.01Å; H279-F301 HydrophobicContact CB-CE1 3.39Å; H279-F301 HydrophobicContact CB-CE2 3.98Å; H279-F301 HydrophobicContact CB-CZ 3.35Å; H279-F301 AromaticContact CG-CZ 3.97Å; H279-F301 PolarHBondContact N-O 2.89Å; H279-F301 PolarHBondContact O-N 2.92Å; H279-D303 VanDerWaalsContact CD2-CB 3.49Å; H279-D303 WeakPolarHBondContact CD2-CB 3.29Å
280	V	73.7	Confident	69.1	Low	62 Å²	62	76.3 Å²	76.3	38%	0.376	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	123	176.4	-174.5	0	0	0	0	108.3	Q282 I300	V280-Q282 PolarHBondContact O-N 2.96Å; V280-I300 HydrophobicContact CG2-CG1 4.32Å
281	C	67.8	Low	67.8	Low	8 Å²	8	74.7 Å²	74.7	5%	0.054	38%	0.375	C	S	.	.			trans	-74.1	116.4	178.9	-70.7	0	0	0	0	111.2	C291 G298 Y299 F301	C281-C291 WeakPolarHBondContact CA-SG 3.3Å; C281-C291 HydrophobicContact CB-CB 4Å; C281-C291 WeakPolarHBondContact CB-SG 3.42Å; C281-C291 WeakPolarHBondContact SG-CB 3.37Å; C281-C291 CovalentContact SG-SG 2.05Å; C281-C291 PolarHBondContact SG-SG 2.73Å; C281-G298 PolarHBondContact O-N 3.44Å; C281-Y299 PolarHBondContact N-O 3.09Å; C281-F301 VanDerWaalsContact SG-CE1 3.57Å
282	Q	66.1	Low	66.6	Low	128 Å²	128	73.8 Å²	73.8	60%	0.598	37%	0.373	S	S	*	.			trans	-102.3	139	178.8	-67.9	-173.5	-11.4	0	0	111	V280 N284 N285	V280-Q282 PolarHBondContact O-N 2.96Å; Q282-N284 VanDerWaalsContact C-N 3.26Å; Q282-N284 PolarHBondContact O-N 3.28Å; Q282-N285 PolarHBondContact O-N 3.28Å
283	P	58.2	Low	65.3	Low	81 Å²	81	78.7 Å²	78.7	53%	0.526	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-32.7	-177.8	19.7	-29.7	0	0	0	113.4
284	N	54.1	Low	63.9	Low	156 Å²	156	85 Å²	85	83%	0.834	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-2.5	-172.4	-65	-6.7	0	0	0	113.9	Q282	Q282-N284 VanDerWaalsContact C-N 3.26Å; Q282-N284 PolarHBondContact O-N 3.28Å
285	N	49.9	Very low	62.6	Low	90 Å²	90	89.7 Å²	89.7	48%	0.481	47%	0.467	S	S	.	.			trans	-117.1	55.7	-178	-145	-4.4	0	0	0	110.5	Q282 N287 S288	Q282-N285 PolarHBondContact O-N 3.28Å; N285-N287 PolarHBondContact O-N 2.77Å; N285-S288 VanDerWaalsContact O-CB 3.3Å; N285-S288 WeakPolarHBondContact O-CB 3.38Å; N285-S288 PolarHBondContact O-N 3.42Å
286	V	44.9	Very low	61.4	Low	131 Å²	131	93.3 Å²	93.3	79%	0.794	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-19.4	176.3	-169.6	0	0	0	0	111.8
287	N	43	Very low	60.3	Low	148 Å²	148	97.5 Å²	97.5	79%	0.791	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-2.6	176.4	-74.8	-15.4	0	0	0	114.8	N285 R289	N285-N287 PolarHBondContact O-N 2.77Å; N287-R289 VanDerWaalsContact C-N 3.26Å; N287-R289 PolarHBondContact O-N 3.42Å
288	S	45.3	Very low	59.5	Low	36 Å²	36	92 Å²	92	25%	0.252	51%	0.514	S	S	.	.			trans	-66	94.4	165.3	171.2	0	0	0	0	107.1	N285 L290 C291	N285-S288 VanDerWaalsContact O-CB 3.3Å; N285-S288 WeakPolarHBondContact O-CB 3.38Å; N285-S288 PolarHBondContact O-N 3.42Å; S288-L290 PolarHBondContact O-N 3.01Å; S288-C291 PolarHBondContact O-N 2.8Å
289	R	51.4	Low	58.9	Low	214 Å²	214	92.9 Å²	92.9	81%	0.808	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47	-7.4	176.8	-70.5	-179.6	-179.5	179.6	-0.5	114.9	N287	N287-R289 VanDerWaalsContact C-N 3.26Å; N287-R289 PolarHBondContact O-N 3.42Å
290	L	56.1	Low	58.5	Low	65 Å²	65	93.2 Å²	93.2	34%	0.34	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-14.1	-169.9	-58.6	170.6	0	0	0	113.7	S288 P292 F301	S288-L290 PolarHBondContact O-N 3.01Å; L290-P292 VanDerWaalsContact O-CD 3.23Å; L290-P292 WeakPolarHBondContact O-CD 3.38Å; L290-F301 HydrophobicContact CB-CE2 4.47Å; L290-F301 HydrophobicContact CB-CZ 3.82Å; L290-F301 WeakPolarHBondContact O-CE2 3.44Å; L290-F301 WeakPolarHBondContact O-CZ 3.37Å
291	C	58.1	Low	58.5	Low	41 Å²	41	91.6 Å²	91.6	28%	0.277	51%	0.509	S	S	.	.	S	Bend	trans	-90.3	107.7	176.2	-77	0	0	0	0	110.5	C281 S288	C281-C291 WeakPolarHBondContact CA-SG 3.3Å; C281-C291 HydrophobicContact CB-CB 4Å; C281-C291 WeakPolarHBondContact CB-SG 3.42Å; C281-C291 WeakPolarHBondContact SG-CB 3.37Å; C281-C291 CovalentContact SG-SG 2.05Å; C281-C291 PolarHBondContact SG-SG 2.73Å; S288-C291 PolarHBondContact O-N 2.8Å
292	P	57	Low	59.1	Low	53 Å²	53	92.9 Å²	92.9	34%	0.344	51%	0.513	S	S	.	.			trans	-64.2	146.5	179	-13.8	29.5	0	0	0	109.7	L290 N294 Y295	L290-P292 VanDerWaalsContact O-CD 3.23Å; L290-P292 WeakPolarHBondContact O-CD 3.38Å; P292-N294 PolarHBondContact O-N 2.99Å; P292-Y295 HydrophobicContact CB-CD2 3.6Å; P292-Y295 HydrophobicContact CB-CE2 3.75Å; P292-Y295 VanDerWaalsContact CD-CD2 3.45Å; P292-Y295 HydrophobicContact CG-CD2 3.57Å; P292-Y295 HydrophobicContact CG-CE2 3.49Å; P292-Y295 VanDerWaalsContact CG-CE2 3.49Å; P292-Y295 PolarHBondContact O-N 3.18Å; P292-Y295 VanDerWaalsContact O-N 3.07Å
293	A	58.3	Low	59.9	Low	105 Å²	105	89 Å²	89	87%	0.868	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-18.6	-171.2	0	0	0	0	0	114.9
294	N	57.1	Low	61.2	Low	153 Å²	153	85.2 Å²	85.2	82%	0.818	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-2.6	-176.6	-61.2	-4.9	0	0	0	113.8	P292	P292-N294 PolarHBondContact O-N 2.99Å
295	Y	58.2	Low	62.9	Low	98 Å²	98	80.2 Å²	80.2	38%	0.384	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-93.4	128.4	-174.7	-75.2	-87.6	0	0	0	112.2	P292 Y299	P292-Y295 HydrophobicContact CB-CD2 3.6Å; P292-Y295 HydrophobicContact CB-CE2 3.75Å; P292-Y295 VanDerWaalsContact CD-CD2 3.45Å; P292-Y295 HydrophobicContact CG-CD2 3.57Å; P292-Y295 HydrophobicContact CG-CE2 3.49Å; P292-Y295 VanDerWaalsContact CG-CE2 3.49Å; P292-Y295 PolarHBondContact O-N 3.18Å; P292-Y295 VanDerWaalsContact O-N 3.07Å; Y295-Y299 AromaticContact CD1-CD1 3.12Å; Y295-Y299 HydrophobicContact CD1-CD1 3.12Å; Y295-Y299 HydrophobicContact CD1-CD2 4.02Å; Y295-Y299 AromaticContact CD1-CE1 3.32Å; Y295-Y299 HydrophobicContact CD1-CE1 3.32Å; Y295-Y299 HydrophobicContact CD1-CE2 4.16Å; Y295-Y299 AromaticContact CD1-CG 3.5Å; Y295-Y299 HydrophobicContact CD1-CG 3.5Å; Y295-Y299 AromaticContact CD1-CZ 3.84Å; Y295-Y299 AromaticContact CE1-CD1 3.51Å; Y295-Y299 HydrophobicContact CE1-CD1 3.51Å; Y295-Y299 AromaticContact CE1-CE1 3.15Å; Y295-Y299 HydrophobicContact CE1-CE1 3.15Å; Y295-Y299 HydrophobicContact CE1-CE2 4.29Å; Y295-Y299 HydrophobicContact CE1-CG 4.23Å; Y295-Y299 AromaticContact CE1-CZ 3.58Å; Y295-Y299 HydrophobicContact CG-CD1 4.18Å; Y295-Y299 HydrophobicContact CG-CG 4.45Å
296	P	61.2	Low	64.7	Low	83 Å²	83	78.4 Å²	78.4	54%	0.539	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-67.5	157.5	178.3	26.1	-31	0	0	0	111.7	G298 Y299	P296-G298 PolarHBondContact O-N 3.42Å; P296-Y299 HydrophobicContact CG-CD2 4.08Å; P296-Y299 WeakPolarHBondContact O-CB 3.27Å; P296-Y299 PolarHBondContact O-N 3.45Å; P296-Y299 VanDerWaalsContact O-N 3.08Å
297	S	64.1	Low	66.7	Low	87 Å²	87	74.1 Å²	74.1	61%	0.608	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	134.2	174.4	-70.2	0	0	0	0	110.8	Y299	S297-Y299 VanDerWaalsContact C-N 3.31Å
298	G	66.5	Low	68.7	Low	48 Å²	48	67.9 Å²	67.9	50%	0.495	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	-5	-176.1	0	0	0	0	0	114.8	C281 P296	C281-G298 PolarHBondContact O-N 3.44Å; P296-G298 PolarHBondContact O-N 3.42Å
299	Y	68.6	Low	70.3	Confident	102 Å²	102	73.5 Å²	73.5	40%	0.4	40%	0.404	S	S	.	.			trans	-64.4	139.2	176.8	-163.3	-84.1	0	0	0	111.4	C281 Y295 P296 S297 F301	C281-Y299 PolarHBondContact N-O 3.09Å; Y295-Y299 AromaticContact CD1-CD1 3.12Å; Y295-Y299 HydrophobicContact CD1-CD1 3.12Å; Y295-Y299 HydrophobicContact CD1-CD2 4.02Å; Y295-Y299 AromaticContact CD1-CE1 3.32Å; Y295-Y299 HydrophobicContact CD1-CE1 3.32Å; Y295-Y299 HydrophobicContact CD1-CE2 4.16Å; Y295-Y299 AromaticContact CD1-CG 3.5Å; Y295-Y299 HydrophobicContact CD1-CG 3.5Å; Y295-Y299 AromaticContact CD1-CZ 3.84Å; Y295-Y299 AromaticContact CE1-CD1 3.51Å; Y295-Y299 HydrophobicContact CE1-CD1 3.51Å; Y295-Y299 AromaticContact CE1-CE1 3.15Å; Y295-Y299 HydrophobicContact CE1-CE1 3.15Å; Y295-Y299 HydrophobicContact CE1-CE2 4.29Å; Y295-Y299 HydrophobicContact CE1-CG 4.23Å; Y295-Y299 AromaticContact CE1-CZ 3.58Å; Y295-Y299 HydrophobicContact CG-CD1 4.18Å; Y295-Y299 HydrophobicContact CG-CG 4.45Å; P296-Y299 HydrophobicContact CG-CD2 4.08Å; P296-Y299 WeakPolarHBondContact O-CB 3.27Å; P296-Y299 PolarHBondContact O-N 3.45Å; P296-Y299 VanDerWaalsContact O-N 3.08Å; S297-Y299 VanDerWaalsContact C-N 3.31Å; Y299-F301 HydrophobicContact CD1-CB 4.47Å; Y299-F301 HydrophobicContact CE1-CB 4.42Å
300	I	69	Low	71.5	Confident	68 Å²	68	64.2 Å²	64.2	35%	0.349	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	122.5	-179.7	-57.6	164.2	0	0	0	108.1	R278 H279 V280	R278-I300 HydrophobicContact CG-CG2 3.56Å; R278-I300 VanDerWaalsContact NE-CG2 3.34Å; H279-I300 WeakPolarHBondContact O-CA 3.33Å; V280-I300 HydrophobicContact CG2-CG1 4.32Å
301	F	74.6	Confident	71.8	Confident	29 Å²	29	65.9 Å²	65.9	13%	0.127	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	162.6	169.2	75.9	-81	0	0	0	110.2	H279 C281 L290 Y299 D303	H279-F301 HydrophobicContact CB-CD1 4.01Å; H279-F301 HydrophobicContact CB-CE1 3.39Å; H279-F301 HydrophobicContact CB-CE2 3.98Å; H279-F301 HydrophobicContact CB-CZ 3.35Å; H279-F301 AromaticContact CG-CZ 3.97Å; H279-F301 PolarHBondContact N-O 2.89Å; H279-F301 PolarHBondContact O-N 2.92Å; C281-F301 VanDerWaalsContact SG-CE1 3.57Å; L290-F301 HydrophobicContact CB-CE2 4.47Å; L290-F301 HydrophobicContact CB-CZ 3.82Å; L290-F301 WeakPolarHBondContact O-CE2 3.44Å; L290-F301 WeakPolarHBondContact O-CZ 3.37Å; Y299-F301 HydrophobicContact CD1-CB 4.47Å; Y299-F301 HydrophobicContact CE1-CB 4.42Å; F301-D303 HydrophobicContact CE2-CB 4.07Å
302	Y	79.2	Confident	71.7	Confident	34 Å²	34	66.1 Å²	66.1	13%	0.133	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	121.5	177.3	-71.6	-90.9	0	0	0	109.5	R277 R278 S462 A467 I470	R277-Y302 CarbonylContact O-C 3.55Å; R277-Y302 WeakPolarHBondContact O-CA 3.35Å; R278-Y302 HydrophobicContact CB-CD1 4.12Å; R278-Y302 HydrophobicContact CB-CE1 3.74Å; R278-Y302 HydrophobicContact CG-CE1 4.26Å; Y302-S462 WeakPolarHBondContact CE2-O 3.3Å; Y302-S462 PolarHBondContact OH-O 3.2Å; Y302-A467 WeakPolarHBondContact CE1-O 3.42Å; Y302-A467 PolarHBondContact OH-O 3.07Å; Y302-I470 HydrophobicContact CD1-CD1 3.54Å; Y302-I470 HydrophobicContact CD1-CG1 3.58Å; Y302-I470 HydrophobicContact CD2-CD1 3.81Å; Y302-I470 HydrophobicContact CE1-CB 4.49Å; Y302-I470 HydrophobicContact CE1-CD1 3.72Å; Y302-I470 HydrophobicContact CE1-CG1 3.8Å; Y302-I470 HydrophobicContact CE1-CG2 3.98Å; Y302-I470 HydrophobicContact CE2-CD1 3.99Å; Y302-I470 HydrophobicContact CG-CD1 3.58Å; Y302-I470 HydrophobicContact CG-CG1 4.08Å
303	D	82.6	Confident	71.1	Confident	46 Å²	46	70.9 Å²	70.9	25%	0.246	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	111.5	175.2	-173.8	15	0	0	0	109.4	A276 R277 H279 F301	A276-D303 CarbonylContact C-O 3.53Å; A276-D303 WeakPolarHBondContact CA-O 3.38Å; R277-D303 PolarHBondContact N-O 3.02Å; R277-D303 PolarHBondContact O-N 3.21Å; H279-D303 VanDerWaalsContact CD2-CB 3.49Å; H279-D303 WeakPolarHBondContact CD2-CB 3.29Å; F301-D303 HydrophobicContact CE2-CB 4.07Å
304	R	87.1	Confident	70.7	Confident	3 Å²	3	73.1 Å²	73.1	1%	0.011	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	124.2	-177.7	-171.7	171.3	59.4	94	0.6	111	T274 A276 T337 E353 L472 K475 T476	T274-R304 VanDerWaalsContact OG1-CD 3.26Å; T274-R304 WeakPolarHBondContact OG1-CD 3.49Å; T274-R304 WeakPolarHBondContact OG1-CG 3.47Å; T274-R304 PolarHBondContact OG1-NH1 3.25Å; A276-R304 HydrophobicContact CB-CB 4.03Å; A276-R304 HydrophobicContact CB-CG 4.36Å; R304-T337 PolarHBondContact O-OG1 3.21Å; R304-E353 IonicContact CZ-OE1 2.75Å; R304-E353 VanDerWaalsContact CZ-OE1 3.28Å; R304-E353 IonicContact NE-OE1 2.71Å; R304-E353 PolarHBondContact NE-OE1 3.26Å; R304-E353 IonicContact NH2-OE1 3.17Å; R304-E353 PolarHBondContact NH2-OE1 3.5Å; R304-L472 HydrophobicContact CB-CD1 4.34Å; R304-L472 HydrophobicContact CG-CB 4.22Å; R304-K475 PolarHBondContact NH2-O 3.19Å; R304-T476 PolarHBondContact NH1-OG1 3.47Å
305	S	88	Confident	70.3	Confident	50 Å²	50	74.2 Å²	74.2	35%	0.35	40%	0.4	S	S	.	.			trans	-67.3	147.4	174.3	-176.4	0	0	0	0	111.6	T274 T275 N307 G308	T274-S305 WeakPolarHBondContact CB-O 3.31Å; T274-S305 PolarHBondContact OG1-O 3.18Å; T275-S305 WeakPolarHBondContact O-CB 3.28Å; T275-S305 PolarHBondContact O-N 2.75Å; S305-N307 PolarHBondContact OG-N 3.04Å; S305-G308 WeakPolarHBondContact OG-CA 3.44Å; S305-G308 PolarHBondContact OG-N 3.48Å
306	I	88.1	Confident	69.8	Low	53 Å²	53	73.1 Å²	73.1	27%	0.272	40%	0.401	S	S	.	.	S	Bend	trans	-70.1	-37.4	174.9	-63.4	157.2	0	0	0	111.3	R272 L327 Y335 T337	R272-I306 PolarHBondContact NH2-O 3.35Å; I306-L327 HydrophobicContact CG2-CB 4.14Å; I306-L327 HydrophobicContact CG2-CD1 4.06Å; I306-Y335 HydrophobicContact CG2-CD2 4.38Å; I306-Y335 HydrophobicContact CG2-CG 4.18Å; I306-T337 HydrophobicContact CG1-CG2 4.36Å
307	N	88.1	Confident	69.2	Low	40 Å²	40	70.9 Å²	70.9	21%	0.214	39%	0.39	C	S	.	.	S	Bend	trans	-131	0.3	-170	-71	-37.1	0	0	0	113.8	R272 S305 Q309 Y326 L327	R272-N307 PolarHBondContact NH2-OD1 3.43Å; S305-N307 PolarHBondContact OG-N 3.04Å; N307-Q309 PolarHBondContact O-N 3.46Å; N307-Q309 VanDerWaalsContact O-N 3.09Å; N307-Y326 HydrophobicContact CB-CD2 3.86Å; N307-Y326 HydrophobicContact CB-CE2 4.03Å; N307-Y326 WeakPolarHBondContact ND2-CE2 3.45Å; N307-L327 PolarHBondContact ND2-O 2.91Å; N307-L327 PolarHBondContact OD1-N 3.1Å
308	G	84.4	Confident	68.4	Low	17 Å²	17	73.4 Å²	73.4	18%	0.175	40%	0.395	C	S	.	.			trans	-62.2	114.2	179.5	0	0	0	0	0	110.1	T274 T275 S305 C310	T274-G308 CarbonylContact C-O 3.55Å; T274-G308 WeakPolarHBondContact CA-O 3.31Å; T274-G308 WeakPolarHBondContact CB-O 3.34Å; T275-G308 PolarHBondContact N-O 2.99Å; T275-G308 VanDerWaalsContact OG1-CA 3.31Å; T275-G308 WeakPolarHBondContact OG1-CA 3.44Å; S305-G308 WeakPolarHBondContact OG-CA 3.44Å; S305-G308 PolarHBondContact OG-N 3.48Å; G308-C310 PolarHBondContact O-N 3.41Å
309	Q	78.4	Confident	67.5	Low	155 Å²	155	78.2 Å²	78.2	72%	0.724	41%	0.409	S	S	*	.			trans	-72.9	126.5	-179	-71.6	-174.8	-16.4	0	0	109.4	T275 N307 T311	T275-Q309 VanDerWaalsContact CG2-C 3.5Å; T275-Q309 WeakPolarHBondContact CG2-O 3.27Å; N307-Q309 PolarHBondContact O-N 3.46Å; N307-Q309 VanDerWaalsContact O-N 3.09Å; Q309-T311 PolarHBondContact O-N 3.45Å
310	C	76	Confident	66.6	Low	18 Å²	18	74.8 Å²	74.8	12%	0.122	40%	0.397	C	S	.	.			trans	-63.9	110.8	169	-83.6	0	0	0	0	110.2	T274 G308 Q312 Y357 C471	T274-C310 VanDerWaalsContact C-SG 3.53Å; G308-C310 PolarHBondContact O-N 3.41Å; C310-Q312 PolarHBondContact O-N 3.16Å; C310-Q312 VanDerWaalsContact O-N 3.08Å; C310-Y357 HydrophobicContact CB-CE1 4.26Å; C310-Y357 HydrophobicContact CB-CE2 4.27Å; C310-Y357 WeakPolarHBondContact CB-OH 3.49Å; C310-Y357 PolarHBondContact O-OH 2.75Å; C310-C471 VanDerWaalsContact CA-SG 3.53Å; C310-C471 HydrophobicContact CB-CB 4.13Å; C310-C471 WeakPolarHBondContact CB-SG 3.44Å; C310-C471 VanDerWaalsContact SG-CA 3.51Å; C310-C471 WeakPolarHBondContact SG-CB 3.17Å; C310-C471 CovalentContact SG-SG 2.03Å; C310-C471 PolarHBondContact SG-SG 2.9Å
311	T	62.6	Low	65.7	Low	101 Å²	101	74.9 Å²	74.9	62%	0.62	40%	0.403	S	S	*	.			trans	-66.4	106.9	177.7	54.4	0	0	0	0	109.3	Q309	Q309-T311 PolarHBondContact O-N 3.45Å
312	Q	57	Low	64.5	Low	45 Å²	45	79.8 Å²	79.8	21%	0.21	43%	0.431	C	S	.	.			trans	-112.8	139.1	173.4	-105.1	-177.4	10.8	0	0	111.2	C310 L314 A317 Y357	C310-Q312 PolarHBondContact O-N 3.16Å; C310-Q312 VanDerWaalsContact O-N 3.08Å; Q312-L314 PolarHBondContact O-N 2.93Å; Q312-A317 HydrophobicContact CB-CB 4.44Å; Q312-Y357 VanDerWaalsContact CD-CZ 3.4Å; Q312-Y357 VanDerWaalsContact CD-OH 3.26Å; Q312-Y357 HydrophobicContact CG-CD2 4.24Å; Q312-Y357 HydrophobicContact CG-CE2 3.41Å; Q312-Y357 VanDerWaalsContact CG-CE2 3.41Å; Q312-Y357 VanDerWaalsContact CG-OH 3.25Å; Q312-Y357 WeakPolarHBondContact CG-OH 3.26Å; Q312-Y357 VanDerWaalsContact NE2-CE1 3.28Å; Q312-Y357 PolarHBondContact NE2-OH 3.48Å
313	N	45	Very low	63.7	Low	153 Å²	153	83.4 Å²	83.4	82%	0.818	45%	0.447	S	S	*	.			trans	-63.6	89.8	154.2	-77.1	-29.7	0	0	0	109.1	H315	N313-H315 PolarHBondContact O-N 3.49Å
314	L	47.9	Very low	62.8	Low	153 Å²	153	82.2 Å²	82.2	80%	0.801	44%	0.444	S	S	*	.	S	Bend	trans	49.7	9.2	135.7	-118.7	85.6	0	0	0	125.7	Q312	Q312-L314 PolarHBondContact O-N 2.93Å
315	H	50.1	Low	62.3	Low	175 Å²	175	85 Å²	85	81%	0.81	46%	0.464	S	S	*	.	S	Bend	trans	-124.8	-39.4	171.3	-103.5	22.6	0	0	0	116.9	N313	N313-H315 PolarHBondContact O-N 3.49Å
316	N	48.3	Very low	62.1	Low	76 Å²	76	90.2 Å²	90.2	41%	0.406	48%	0.477	S	S	.	.	S	Bend	trans	-88.2	-7	176.5	-69.2	-25.6	0	0	0	113.5	I318 L319 I320	N316-I318 VanDerWaalsContact C-N 3.33Å; N316-I318 PolarHBondContact O-N 3.14Å; N316-L319 PolarHBondContact O-N 3.49Å; N316-I320 HydrophobicContact CB-CD1 4.32Å; N316-I320 WeakPolarHBondContact O-CG1 3.43Å
317	A	47.8	Very low	62.1	Low	36 Å²	36	88.1 Å²	88.1	30%	0.298	47%	0.467	S	S	.	.	H	α-helix	trans	-65.1	-31.1	-173.2	0	0	0	0	0	113.6	Q312 L319 I320 S321	Q312-A317 HydrophobicContact CB-CB 4.44Å; A317-L319 VanDerWaalsContact C-N 3.26Å; A317-L319 PolarHBondContact O-N 3.44Å; A317-I320 PolarHBondContact O-N 2.99Å; A317-S321 PolarHBondContact O-N 2.83Å; A317-S321 PolarHBondContact O-OG 2.96Å
318	I	48	Very low	62.1	Low	140 Å²	140	89 Å²	89	72%	0.718	48%	0.475	S	S	*	.	H	α-helix	trans	-61.1	-36.9	-180	-62	172	0	0	0	111.1	N316 S321	N316-I318 VanDerWaalsContact C-N 3.33Å; N316-I318 PolarHBondContact O-N 3.14Å; I318-S321 PolarHBondContact O-OG 2.84Å
319	L	47.1	Very low	62.2	Low	148 Å²	148	93.3 Å²	93.3	78%	0.775	50%	0.499	S	S	*	.	H	α-helix	trans	-79.1	-17.9	177.6	-76.7	160.9	0	0	0	113.3	N316 A317	N316-L319 PolarHBondContact O-N 3.49Å; A317-L319 VanDerWaalsContact C-N 3.26Å; A317-L319 PolarHBondContact O-N 3.44Å
320	I	50.4	Low	62.6	Low	31 Å²	31	88.8 Å²	88.8	16%	0.159	48%	0.478	C	S	.	.	H	α-helix	trans	-101.7	-30.9	-173.4	-59.5	170	0	0	0	111.6	H273 N316 A317 D322 K323 A324 Y357	H273-I320 HydrophobicContact CB-CG2 3.9Å; N316-I320 HydrophobicContact CB-CD1 4.32Å; N316-I320 WeakPolarHBondContact O-CG1 3.43Å; A317-I320 PolarHBondContact O-N 2.99Å; I320-D322 PolarHBondContact O-N 3.34Å; I320-K323 PolarHBondContact O-N 3.4Å; I320-A324 PolarHBondContact O-N 3.29Å; I320-Y357 HydrophobicContact CD1-CD1 4.13Å; I320-Y357 HydrophobicContact CD1-CE1 3.84Å; I320-Y357 HydrophobicContact CG2-CE1 4.42Å
321	S	49.5	Very low	63.2	Low	69 Å²	69	93.5 Å²	93.5	48%	0.483	50%	0.502	S	S	.	.	H	α-helix	trans	-55.9	-35.1	-179.2	55.7	0	0	0	0	112.5	A317 I318 K323 A324	A317-S321 PolarHBondContact O-N 2.83Å; A317-S321 PolarHBondContact O-OG 2.96Å; I318-S321 PolarHBondContact O-OG 2.84Å; S321-K323 VanDerWaalsContact C-N 3.28Å; S321-K323 PolarHBondContact O-N 2.9Å; S321-A324 PolarHBondContact O-N 3.27Å; S321-A324 VanDerWaalsContact O-N 3.17Å
322	D	49.7	Very low	64.7	Low	133 Å²	133	89 Å²	89	71%	0.711	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-63.8	-33.3	179.4	-72.1	-2.3	0	0	0	112.4	I320	I320-D322 PolarHBondContact O-N 3.34Å
323	K	61.3	Low	66.5	Low	109 Å²	109	87 Å²	87	47%	0.474	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-85.1	-12.9	177.7	-66.7	-166.6	177.4	-169.5	0	114	I320 S321	I320-K323 PolarHBondContact O-N 3.4Å; S321-K323 VanDerWaalsContact C-N 3.28Å; S321-K323 PolarHBondContact O-N 2.9Å
324	A	64.5	Low	68.8	Low	21 Å²	21	80.2 Å²	80.2	17%	0.174	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-102	19.7	177.5	0	0	0	0	0	112.8	H273 I320 S321 Y326	H273-A324 WeakPolarHBondContact O-CB 3.23Å; I320-A324 PolarHBondContact O-N 3.29Å; S321-A324 PolarHBondContact O-N 3.27Å; S321-A324 VanDerWaalsContact O-N 3.17Å; A324-Y326 PolarHBondContact O-N 3.16Å
325	S	75.2	Confident	71	Confident	63 Å²	63	74.1 Å²	74.1	44%	0.441	39%	0.394	S	S	.	.			trans	-45.7	133.2	-178.8	56.6	0	0	0	0	112.2	R272 L327	R272-S325 PolarHBondContact NH1-O 2.91Å; R272-S325 PolarHBondContact NH2-O 3.11Å; S325-L327 PolarHBondContact O-N 3.02Å
326	Y	84.5	Confident	73.1	Confident	159 Å²	159	65.8 Å²	65.8	62%	0.624	36%	0.356	S	S	*	.			trans	-61	125.4	-176.4	179.2	-98.1	0	0	0	110.7	N307 A324 P328	N307-Y326 HydrophobicContact CB-CD2 3.86Å; N307-Y326 HydrophobicContact CB-CE2 4.03Å; N307-Y326 WeakPolarHBondContact ND2-CE2 3.45Å; A324-Y326 PolarHBondContact O-N 3.16Å; Y326-P328 HydrophobicContact CD1-CB 4.31Å; Y326-P328 HydrophobicContact CE1-CB 3.89Å; Y326-P328 WeakPolarHBondContact O-CD 3.28Å
327	L	88.7	Confident	75	Confident	8 Å²	8	62.8 Å²	62.8	4%	0.042	34%	0.34	C	S	.	.			trans	-94.3	106.7	174	-63.6	177.6	0	0	0	108.7	Y269 R272 I306 N307 S325 Y335 T476	Y269-L327 HydrophobicContact CD1-CD2 4.14Å; Y269-L327 HydrophobicContact CD2-CD1 3.98Å; Y269-L327 HydrophobicContact CD2-CD2 4.3Å; Y269-L327 HydrophobicContact CE1-CD2 3.74Å; Y269-L327 HydrophobicContact CE2-CD1 4.18Å; Y269-L327 HydrophobicContact CE2-CD2 3.91Å; Y269-L327 HydrophobicContact CG-CD1 4.31Å; Y269-L327 HydrophobicContact CG-CD2 4.4Å; R272-L327 VanDerWaalsContact CZ-CD1 3.4Å; R272-L327 VanDerWaalsContact NH1-CG 3.28Å; I306-L327 HydrophobicContact CG2-CB 4.14Å; I306-L327 HydrophobicContact CG2-CD1 4.06Å; N307-L327 PolarHBondContact ND2-O 2.91Å; N307-L327 PolarHBondContact OD1-N 3.1Å; S325-L327 PolarHBondContact O-N 3.02Å; L327-Y335 HydrophobicContact CB-CE1 3.93Å; L327-Y335 HydrophobicContact CB-CE2 4.26Å; L327-Y335 HydrophobicContact CD1-CD1 3.81Å; L327-Y335 HydrophobicContact CD1-CE1 3.69Å; L327-Y335 HydrophobicContact CD2-CE1 4.38Å; L327-Y335 HydrophobicContact CG-CE1 4.2Å; L327-T476 HydrophobicContact CD1-CG2 4.23Å
328	P	87.6	Confident	76.8	Confident	59 Å²	59	63.9 Å²	63.9	38%	0.383	34%	0.341	S	S	.	.			trans	-70.9	147.6	-177	29.5	-34.9	0	0	0	111.2	Y326 Y335	Y326-P328 HydrophobicContact CD1-CB 4.31Å; Y326-P328 HydrophobicContact CE1-CB 3.89Å; Y326-P328 WeakPolarHBondContact O-CD 3.28Å; P328-Y335 PolarHBondContact O-OH 3.23Å
329	P	86.7	Confident	78.6	Confident	107 Å²	107	59.9 Å²	59.9	70%	0.695	32%	0.321	S	S	*	.			trans	-61.4	140	169.9	28	-33.8	0	0	0	109.9
330	Q	87.8	Confident	80.5	Confident	61 Å²	61	53.2 Å²	53.2	29%	0.285	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-132	140.9	174.1	-39.2	-174	-24.9	0	0	109.5	N332 S333	Q330-N332 PolarHBondContact O-N 2.86Å; Q330-S333 VanDerWaalsContact CB-OG 3.32Å; Q330-S333 WeakPolarHBondContact CB-OG 3.27Å; Q330-S333 PolarHBondContact O-N 3.46Å; Q330-S333 VanDerWaalsContact O-N 3.11Å; Q330-S333 PolarHBondContact OE1-OG 3.48Å
331	L	87.6	Confident	82.4	Confident	116 Å²	116	53.9 Å²	53.9	61%	0.607	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-37.5	-177.1	-69.4	171.6	0	0	0	113.2	T635 G639	L331-T635 CarbonylContact C-O 3.46Å; L331-G639 VanDerWaalsContact O-CA 3.23Å; L331-G639 WeakPolarHBondContact O-CA 3.38Å; L331-G639 PolarHBondContact O-N 3.48Å
332	N	93.4	Very high	84.5	Confident	7 Å²	7	50.6 Å²	50.6	4%	0.037	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	16.9	-178.1	71.4	-51.2	0	0	0	113.8	I229 R235 Q330 T480 L481 N482 T635 W638	I229-N332 HydrophobicContact CD1-CB 3.78Å; R235-N332 PolarHBondContact NH1-OD1 2.8Å; Q330-N332 PolarHBondContact O-N 2.86Å; N332-T480 WeakPolarHBondContact ND2-CG2 3.23Å; N332-T480 WeakPolarHBondContact O-CA 3.49Å; N332-L481 PolarHBondContact ND2-O 3.47Å; N332-L481 PolarHBondContact O-N 3.45Å; N332-N482 PolarHBondContact ND2-OD1 2.74Å; N332-T635 HydrophobicContact CB-CG2 3.88Å; N332-W638 VanDerWaalsContact C-CD1 3.46Å
333	S	94.6	Very high	86.5	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.021	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	146.6	174.4	75.3	0	0	0	0	114.1	Q330 K478 F479	Q330-S333 VanDerWaalsContact CB-OG 3.32Å; Q330-S333 WeakPolarHBondContact CB-OG 3.27Å; Q330-S333 PolarHBondContact O-N 3.46Å; Q330-S333 VanDerWaalsContact O-N 3.11Å; Q330-S333 PolarHBondContact OE1-OG 3.48Å; S333-K478 WeakPolarHBondContact OG-CE 3.4Å; S333-F479 WeakPolarHBondContact CA-O 3.28Å; S333-F479 WeakPolarHBondContact CB-O 3.48Å
334	F	94.8	Very high	87.9	Confident	11 Å²	11	41.8 Å²	41.8	5%	0.048	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	170.7	167.2	69.2	-90.3	0	0	0	110.5	C336 L342 K478 F479 W638 Q641	F334-C336 VanDerWaalsContact CE2-SG 3.58Å; F334-L342 HydrophobicContact CE2-CD2 4.13Å; F334-L342 HydrophobicContact CZ-CD2 3.63Å; F334-K478 WeakPolarHBondContact O-CA 3.46Å; F334-F479 HydrophobicContact CE1-CB 4.17Å; F334-F479 HydrophobicContact CE2-CB 4.46Å; F334-F479 HydrophobicContact CE2-CD2 4.06Å; F334-F479 HydrophobicContact CZ-CB 4.13Å; F334-F479 HydrophobicContact CZ-CD2 4.33Å; F334-F479 HydrophobicContact CZ-CG 4.46Å; F334-F479 PolarHBondContact N-O 2.91Å; F334-F479 VanDerWaalsContact N-O 3.16Å; F334-F479 PolarHBondContact O-N 3.14Å; F334-W638 AromaticContact CD1-CD1 3.92Å; F334-W638 HydrophobicContact CD1-CD2 4.44Å; F334-W638 AromaticContact CD1-CE2 3.9Å; F334-W638 HydrophobicContact CD1-CG 4.49Å; F334-W638 HydrophobicContact CD1-CZ2 4.33Å; F334-W638 AromaticContact CD1-NE1 3.56Å; F334-W638 WeakPolarHBondContact CD1-O 3.37Å; F334-W638 HydrophobicContact CE1-CD2 4.12Å; F334-W638 AromaticContact CE1-CE2 3.43Å; F334-W638 VanDerWaalsContact CE1-CE2 3.43Å; F334-W638 HydrophobicContact CE1-CH2 4.16Å; F334-W638 AromaticContact CE1-CZ2 3.44Å; F334-W638 HydrophobicContact CE1-CZ2 3.44Å; F334-W638 VanDerWaalsContact CE1-CZ2 3.44Å; F334-W638 AromaticContact CE1-NE1 3.56Å; F334-W638 HydrophobicContact CZ-CZ2 4.16Å; F334-Q641 HydrophobicContact CD1-CB 3.94Å; F334-Q641 HydrophobicContact CE1-CB 3.74Å; F334-Q641 HydrophobicContact CZ-CB 4.33Å
335	Y	94.4	Very high	89.1	Confident	24 Å²	24	48.4 Å²	48.4	9%	0.094	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	148.1	-173	-57.5	-90.2	0	0	0	111.7	Y269 I306 L327 P328 T476 L477 K478	Y269-Y335 HydrophobicContact CE2-CE1 4.03Å; I306-Y335 HydrophobicContact CG2-CD2 4.38Å; I306-Y335 HydrophobicContact CG2-CG 4.18Å; L327-Y335 HydrophobicContact CB-CE1 3.93Å; L327-Y335 HydrophobicContact CB-CE2 4.26Å; L327-Y335 HydrophobicContact CD1-CD1 3.81Å; L327-Y335 HydrophobicContact CD1-CE1 3.69Å; L327-Y335 HydrophobicContact CD2-CE1 4.38Å; L327-Y335 HydrophobicContact CG-CE1 4.2Å; P328-Y335 PolarHBondContact O-OH 3.23Å; Y335-T476 HydrophobicContact CD1-CG2 4.38Å; Y335-L477 CarbonylContact C-O 3.56Å; Y335-L477 VanDerWaalsContact CA-O 3.28Å; Y335-L477 WeakPolarHBondContact CA-O 3.48Å; Y335-K478 HydrophobicContact CD1-CB 3.68Å; Y335-K478 HydrophobicContact CD1-CG 3.94Å; Y335-K478 HydrophobicContact CE1-CB 3.6Å; Y335-K478 HydrophobicContact CE1-CD 3.76Å; Y335-K478 HydrophobicContact CE1-CG 3.52Å
336	C	92.8	Very high	89.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	131.5	177.4	-70.1	0	0	0	0	112.6	F334 V343 I351 T476 L477 F479 C643	F334-C336 VanDerWaalsContact CE2-SG 3.58Å; C336-V343 HydrophobicContact CB-CG2 4.38Å; C336-I351 HydrophobicContact CB-CD1 4.44Å; C336-T476 WeakPolarHBondContact O-CA 3.32Å; C336-L477 PolarHBondContact N-O 3.36Å; C336-L477 PolarHBondContact O-N 3.48Å; C336-F479 HydrophobicContact CB-CD2 4.39Å; C336-F479 HydrophobicContact CB-CE2 3.88Å; C336-C643 WeakPolarHBondContact CA-SG 3.01Å; C336-C643 HydrophobicContact CB-CB 4.07Å; C336-C643 WeakPolarHBondContact CB-SG 3.36Å; C336-C643 WeakPolarHBondContact SG-CA 3.49Å; C336-C643 WeakPolarHBondContact SG-CB 2.97Å; C336-C643 CovalentContact SG-SG 2.02Å; C336-C643 PolarHBondContact SG-SG 3Å
337	T	89.5	Confident	90.4	Very high	13 Å²	13	38.6 Å²	38.6	8%	0.08	21%	0.206	C	C	.	.			trans	-112.5	-3.1	171.3	52.2	0	0	0	0	111.8	R304 I306 I351 T476	R304-T337 PolarHBondContact O-OG1 3.21Å; I306-T337 HydrophobicContact CG1-CG2 4.36Å; T337-I351 WeakPolarHBondContact O-CG2 3.28Å; T337-T476 HydrophobicContact CG2-CG2 4.04Å
338	I	85	Confident	90.5	Very high	60 Å²	60	44 Å²	44	31%	0.308	23%	0.231	S	C	.	.	S	Bend	trans	-121.9	150.2	-177.4	62.9	169.5	0	0	0	112	C643	I338-C643 HydrophobicContact CD1-CB 4.33Å; I338-C643 HydrophobicContact CG1-CB 4Å
339	N	85.8	Confident	90.6	Very high	55 Å²	55	42.7 Å²	42.7	29%	0.294	22%	0.22	S	C	.	.			trans	-66	136.5	170.5	-70.5	-48.3	0	0	0	110.5	N344 I351	N339-N344 WeakPolarHBondContact CB-OD1 2.99Å; N339-N344 PolarHBondContact OD1-OD1 3.08Å; N339-I351 PolarHBondContact ND2-O 2.9Å; N339-I351 PolarHBondContact OD1-N 3.16Å
340	S	87.8	Confident	90.7	Very high	8 Å²	8	40.8 Å²	40.8	6%	0.056	20%	0.204	C	C	.	.			trans	-151.2	169.4	180	81.4	0	0	0	0	110.8	L342 V343 N344 C643	S340-L342 PolarHBondContact O-N 2.9Å; S340-L342 PolarHBondContact OG-N 3.09Å; S340-V343 PolarHBondContact O-N 2.85Å; S340-V343 PolarHBondContact OG-N 2.82Å; S340-N344 PolarHBondContact O-N 2.66Å; S340-N344 PolarHBondContact O-OD1 2.71Å; S340-C643 WeakPolarHBondContact CB-O 3.37Å; S340-C643 PolarHBondContact OG-O 3.02Å
341	P	89.4	Confident	90.6	Very high	45 Å²	45	38 Å²	38	29%	0.292	19%	0.191	S	C	.	.	I	π-helix	trans	-54.8	-35.8	174	-26.7	36.2	0	0	0	113	K345 L346 I647	P341-K345 HydrophobicContact CB-CD 4.44Å; P341-K345 WeakPolarHBondContact O-CA 3.42Å; P341-K345 VanDerWaalsContact O-CB 3.25Å; P341-K345 WeakPolarHBondContact O-CB 3.34Å; P341-K345 PolarHBondContact O-N 2.84Å; P341-L346 PolarHBondContact O-N 2.69Å; P341-L346 VanDerWaalsContact O-N 3.13Å; P341-I647 HydrophobicContact CB-CD1 3.65Å; P341-I647 HydrophobicContact CB-CG1 4.02Å; P341-I647 HydrophobicContact CB-CG2 4.35Å
342	L	93.5	Very high	90.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.172	C	C	.	.	I	π-helix	trans	-61	-48.9	174	176.7	64.4	0	0	0	111.5	L264 F334 S340 L346 F347 F479 I645 I647	L264-L342 HydrophobicContact CD2-CD1 4.19Å; F334-L342 HydrophobicContact CE2-CD2 4.13Å; F334-L342 HydrophobicContact CZ-CD2 3.63Å; S340-L342 PolarHBondContact O-N 2.9Å; S340-L342 PolarHBondContact OG-N 3.09Å; L342-L346 HydrophobicContact CD1-CB 4.41Å; L342-L346 HydrophobicContact CD1-CD2 3.6Å; L342-L346 VanDerWaalsContact O-CB 3.32Å; L342-L346 WeakPolarHBondContact O-CB 3.35Å; L342-F347 HydrophobicContact CD1-CD2 4.09Å; L342-F347 HydrophobicContact CD1-CE2 4.04Å; L342-F347 PolarHBondContact O-N 2.88Å; L342-F347 VanDerWaalsContact O-N 3.14Å; L342-F479 HydrophobicContact CD1-CD1 4.39Å; L342-F479 HydrophobicContact CD1-CE1 4.29Å; L342-F479 HydrophobicContact CD2-CD1 3.91Å; L342-F479 HydrophobicContact CD2-CD2 3.74Å; L342-F479 HydrophobicContact CD2-CE1 4Å; L342-F479 HydrophobicContact CD2-CE2 3.84Å; L342-F479 HydrophobicContact CD2-CG 3.77Å; L342-F479 HydrophobicContact CD2-CZ 3.97Å; L342-F479 HydrophobicContact CG-CD1 4.17Å; L342-F479 HydrophobicContact CG-CE1 3.86Å; L342-F479 HydrophobicContact CG-CE2 4.28Å; L342-F479 HydrophobicContact CG-CZ 3.92Å; L342-I645 HydrophobicContact CB-CG2 3.98Å; L342-I645 HydrophobicContact CD1-CG2 4.45Å; L342-I645 HydrophobicContact CD2-CG2 3.96Å; L342-I645 HydrophobicContact CG-CG2 4.36Å; L342-I647 HydrophobicContact CB-CG2 4.19Å
343	V	92.6	Very high	89.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.182	C	C	.	.	I	π-helix	trans	-69.2	-52.6	-177.8	178.9	0	0	0	0	110.9	C336 S340 F347 Q348 E349 I351 L477 F479	C336-V343 HydrophobicContact CB-CG2 4.38Å; S340-V343 PolarHBondContact O-N 2.85Å; S340-V343 PolarHBondContact OG-N 2.82Å; V343-F347 CarbonylContact O-C 3.57Å; V343-F347 PolarHBondContact O-N 2.86Å; V343-Q348 PolarHBondContact O-N 3.47Å; V343-Q348 VanDerWaalsContact O-N 3.15Å; V343-E349 HydrophobicContact CG1-CB 3.85Å; V343-E349 PolarHBondContact O-N 2.89Å; V343-I351 HydrophobicContact CG1-CD1 4.42Å; V343-I351 HydrophobicContact CG1-CG1 4.29Å; V343-I351 HydrophobicContact CG2-CD1 4.41Å; V343-L477 HydrophobicContact CB-CD1 4.45Å; V343-L477 HydrophobicContact CG1-CD1 3.62Å; V343-L477 HydrophobicContact CG2-CD1 4.06Å; V343-F479 HydrophobicContact CG2-CE2 4.05Å; V343-F479 HydrophobicContact CG2-CZ 3.89Å
344	N	90.7	Very high	89	Confident	58 Å²	58	39.6 Å²	39.6	31%	0.31	20%	0.203	S	C	.	.	I	π-helix	trans	-87.3	-41.3	-165.8	-62.3	35.1	0	0	0	112.5	N339 S340 Q348 E349 N350	N339-N344 WeakPolarHBondContact CB-OD1 2.99Å; N339-N344 PolarHBondContact OD1-OD1 3.08Å; S340-N344 PolarHBondContact O-N 2.66Å; S340-N344 PolarHBondContact O-OD1 2.71Å; N344-Q348 WeakPolarHBondContact O-CA 3.41Å; N344-E349 WeakPolarHBondContact CA-O 3.32Å; N344-E349 PolarHBondContact OD1-O 3.27Å; N344-N350 PolarHBondContact ND2-OD1 2.87Å; N344-N350 VanDerWaalsContact ND2-OD1 3.13Å
345	K	89.1	Confident	88.2	Confident	159 Å²	159	40.1 Å²	40.1	69%	0.691	21%	0.205	S	C	*	.	I	π-helix	trans	-88	-44.6	-177.2	-60.1	-173.8	175	-175.4	0	111.7	P341 I647	P341-K345 HydrophobicContact CB-CD 4.44Å; P341-K345 WeakPolarHBondContact O-CA 3.42Å; P341-K345 VanDerWaalsContact O-CB 3.25Å; P341-K345 WeakPolarHBondContact O-CB 3.34Å; P341-K345 PolarHBondContact O-N 2.84Å; K345-I647 HydrophobicContact CB-CD1 4.01Å; K345-I647 HydrophobicContact CD-CD1 4.24Å
346	L	91.9	Very high	87.3	Confident	16 Å²	16	39.5 Å²	39.5	8%	0.084	21%	0.205	C	C	.	.	I	π-helix	trans	-83.6	-43.8	-174.4	-163.7	68.5	0	0	0	112.5	L264 P341 L342 P612 I623 I650	L264-L346 HydrophobicContact CD2-CD2 4.23Å; P341-L346 PolarHBondContact O-N 2.69Å; P341-L346 VanDerWaalsContact O-N 3.13Å; L342-L346 HydrophobicContact CD1-CB 4.41Å; L342-L346 HydrophobicContact CD1-CD2 3.6Å; L342-L346 VanDerWaalsContact O-CB 3.32Å; L342-L346 WeakPolarHBondContact O-CB 3.35Å; L346-P612 HydrophobicContact CD1-CG 4.14Å; L346-I623 HydrophobicContact CD1-CD1 3.92Å; L346-I623 HydrophobicContact CD2-CD1 3.4Å; L346-I623 HydrophobicContact CG-CD1 3.51Å; L346-I650 HydrophobicContact CD2-CD1 4.11Å; L346-I650 HydrophobicContact CD2-CG2 4.22Å
347	F	94	Very high	86.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-100.6	-3.8	-178	-83	-88.5	0	0	0	115.2	L264 M266 L342 V343 E349 F479 L614 K621 I623	L264-F347 HydrophobicContact CD2-CE2 4.01Å; L264-F347 HydrophobicContact CD2-CZ 4.41Å; L264-F347 HydrophobicContact CG-CE2 3.98Å; L264-F347 HydrophobicContact CG-CZ 3.91Å; L264-F347 WeakPolarHBondContact O-CZ 3.26Å; M266-F347 HydrophobicContact CB-CD1 3.48Å; M266-F347 VanDerWaalsContact CB-CD1 3.48Å; M266-F347 HydrophobicContact CB-CE1 3.39Å; M266-F347 HydrophobicContact CB-CG 4.12Å; M266-F347 HydrophobicContact CB-CZ 3.95Å; M266-F347 HydrophobicContact CG-CD1 4.26Å; M266-F347 HydrophobicContact SD-CB 4.05Å; M266-F347 HydrophobicContact SD-CD1 4Å; M266-F347 HydrophobicContact SD-CG 4.16Å; L342-F347 HydrophobicContact CD1-CD2 4.09Å; L342-F347 HydrophobicContact CD1-CE2 4.04Å; L342-F347 PolarHBondContact O-N 2.88Å; L342-F347 VanDerWaalsContact O-N 3.14Å; V343-F347 CarbonylContact O-C 3.57Å; V343-F347 PolarHBondContact O-N 2.86Å; F347-E349 PolarHBondContact O-N 3.3Å; F347-F479 HydrophobicContact CD2-CD1 4.22Å; F347-F479 AromaticContact CD2-CE1 3.51Å; F347-F479 HydrophobicContact CD2-CE1 3.51Å; F347-F479 HydrophobicContact CD2-CZ 4.46Å; F347-F479 AromaticContact CE2-CD1 3.89Å; F347-F479 HydrophobicContact CE2-CD1 3.89Å; F347-F479 AromaticContact CE2-CE1 3.66Å; F347-F479 HydrophobicContact CE2-CE1 3.66Å; F347-F479 AromaticContact CG-CE1 3.98Å; F347-F479 HydrophobicContact CG-CE1 3.98Å; F347-F479 HydrophobicContact CZ-CD1 4.31Å; F347-F479 HydrophobicContact CZ-CE1 4.26Å; F347-L614 HydrophobicContact CD1-CD1 3.78Å; F347-L614 HydrophobicContact CE1-CD1 4.19Å; F347-L614 HydrophobicContact CG-CD1 4.49Å; F347-L614 WeakPolarHBondContact O-CD2 3.35Å; F347-K621 HydrophobicContact CD1-CB 3.78Å; F347-K621 HydrophobicContact CD1-CD 4.41Å; F347-K621 HydrophobicContact CE1-CB 4Å; F347-K621 PolarHBondContact O-NZ 2.8Å; F347-I623 HydrophobicContact CE2-CD1 3.97Å; F347-I623 HydrophobicContact CE2-CG1 4.34Å; F347-I623 HydrophobicContact CZ-CD1 4.08Å; F347-I623 HydrophobicContact CZ-CG1 3.93Å
348	Q	91.1	Very high	85.3	Confident	123 Å²	123	40 Å²	40	58%	0.575	21%	0.205	S	C	*	.			trans	49.1	44.4	-179.4	-56.8	175	4.8	0	0	111.4	V343 N344 L614 K621	V343-Q348 PolarHBondContact O-N 3.47Å; V343-Q348 VanDerWaalsContact O-N 3.15Å; N344-Q348 WeakPolarHBondContact O-CA 3.41Å; Q348-L614 HydrophobicContact CB-CD2 4.23Å; Q348-L614 HydrophobicContact CG-CD2 4.41Å; Q348-K621 PolarHBondContact O-NZ 2.99Å
349	E	90.1	Very high	84.6	Confident	31 Å²	31	44.6 Å²	44.6	15%	0.145	22%	0.223	C	C	.	.			trans	-113.6	162.5	175.5	-87.7	-56.6	150.5	0	0	110.9	M266 V343 N344 F347 L477 K621	M266-E349 HydrophobicContact CE-CG 3.86Å; M266-E349 HydrophobicContact SD-CB 4.31Å; M266-E349 HydrophobicContact SD-CG 3.69Å; V343-E349 HydrophobicContact CG1-CB 3.85Å; V343-E349 PolarHBondContact O-N 2.89Å; N344-E349 WeakPolarHBondContact CA-O 3.32Å; N344-E349 PolarHBondContact OD1-O 3.27Å; F347-E349 PolarHBondContact O-N 3.3Å; E349-L477 HydrophobicContact CB-CD1 4.3Å; E349-K621 HydrophobicContact CG-CD 4.28Å; E349-K621 WeakPolarHBondContact OE1-CE 3.44Å; E349-K621 IonicContact OE1-NZ 2.92Å; E349-K621 PolarHBondContact OE1-NZ 2.69Å
350	N	88.1	Confident	84.1	Confident	66 Å²	66	43.8 Å²	43.8	35%	0.353	22%	0.219	S	C	.	.			trans	-136	133	170.5	-69.4	-60.9	0	0	0	109.7	N344	N344-N350 PolarHBondContact ND2-OD1 2.87Å; N344-N350 VanDerWaalsContact ND2-OD1 3.13Å
351	I	85.8	Confident	83.7	Confident	4 Å²	4	50.4 Å²	50.4	2%	0.021	25%	0.251	C	S	.	.			trans	-92.3	122.1	169.9	-59.4	170.1	0	0	0	107.7	C336 T337 N339 V343 E353 N424 L477	C336-I351 HydrophobicContact CB-CD1 4.44Å; T337-I351 WeakPolarHBondContact O-CG2 3.28Å; N339-I351 PolarHBondContact ND2-O 2.9Å; N339-I351 PolarHBondContact OD1-N 3.16Å; V343-I351 HydrophobicContact CG1-CD1 4.42Å; V343-I351 HydrophobicContact CG1-CG1 4.29Å; V343-I351 HydrophobicContact CG2-CD1 4.41Å; I351-E353 HydrophobicContact CG2-CG 4.02Å; I351-N424 PolarHBondContact O-ND2 3.2Å; I351-L477 HydrophobicContact CD1-CD1 3.84Å; I351-L477 HydrophobicContact CD1-CG 4Å; I351-L477 HydrophobicContact CG1-CD1 3.86Å; I351-L477 HydrophobicContact CG1-CG 4.14Å
352	I	80.7	Confident	83.5	Confident	39 Å²	39	51.1 Å²	51.1	20%	0.2	25%	0.25	C	S	.	.			trans	-117.6	133.5	173.6	-58	174.4	0	0	0	106.1	L420 V423 N424	I352-L420 WeakPolarHBondContact CD1-O 3.38Å; I352-V423 HydrophobicContact CD1-CB 4.41Å; I352-V423 HydrophobicContact CG2-CB 4.21Å; I352-N424 HydrophobicContact CG1-CB 4.5Å
353	E	81.9	Confident	83.2	Confident	55 Å²	55	51.1 Å²	51.1	26%	0.257	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	148.2	-178.7	-53.6	-164.9	142.1	0	0	109.5	R304 I351 Q473	R304-E353 IonicContact CZ-OE1 2.75Å; R304-E353 VanDerWaalsContact CZ-OE1 3.28Å; R304-E353 IonicContact NE-OE1 2.71Å; R304-E353 PolarHBondContact NE-OE1 3.26Å; R304-E353 IonicContact NH2-OE1 3.17Å; R304-E353 PolarHBondContact NH2-OE1 3.5Å; I351-E353 HydrophobicContact CG2-CG 4.02Å; E353-Q473 WeakPolarHBondContact CA-O 3.37Å
354	S	80.4	Confident	82.7	Confident	64 Å²	64	51.6 Å²	51.6	45%	0.448	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	151.7	177.1	62.1	0	0	0	0	109.5	S356 L472 Q473	S354-S356 PolarHBondContact O-N 2.91Å; S354-S356 VanDerWaalsContact O-N 3.15Å; S354-L472 CarbonylContact O-C 3.55Å; S354-L472 WeakPolarHBondContact O-CA 3.44Å; S354-Q473 PolarHBondContact N-O 2.64Å; S354-Q473 PolarHBondContact O-N 2.81Å
355	Q	78.5	Confident	82.4	Confident	23 Å²	23	52 Å²	52	11%	0.107	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	121.7	174.5	-168.9	165.6	6.9	0	0	109.1	L358 R367 Y460 S462 C471 L472	Q355-L358 HydrophobicContact CG-CD2 4.31Å; Q355-R367 PolarHBondContact O-NH1 2.99Å; Q355-Y460 PolarHBondContact NE2-O 3.13Å; Q355-S462 VanDerWaalsContact OE1-N 3.13Å; Q355-C471 CarbonylContact C-O 3.5Å; Q355-C471 WeakPolarHBondContact CG-O 3.3Å; Q355-L472 HydrophobicContact CB-CD2 4.32Å
356	S	74.4	Confident	82.4	Confident	11 Å²	11	45.8 Å²	45.8	8%	0.077	23%	0.231	C	C	.	.			trans	-72	-59.3	-172.7	173.8	0	0	0	0	112	H273 S354 R367 C471	H273-S356 PolarHBondContact CE1-OG 2.76Å; H273-S356 PolarHBondContact ND1-OG 3.19Å; S354-S356 PolarHBondContact O-N 2.91Å; S354-S356 VanDerWaalsContact O-N 3.15Å; S356-R367 PolarHBondContact O-NH1 3.48Å; S356-R367 PolarHBondContact O-NH2 3.32Å; S356-C471 PolarHBondContact N-O 3.07Å
357	Y	72.5	Confident	82.1	Confident	15 Å²	15	45.5 Å²	45.5	6%	0.059	23%	0.228	C	C	.	.			trans	-151.7	159.8	176.4	55	-101.5	0	0	0	110.8	C310 Q312 I320 D364 C471	C310-Y357 HydrophobicContact CB-CE1 4.26Å; C310-Y357 HydrophobicContact CB-CE2 4.27Å; C310-Y357 WeakPolarHBondContact CB-OH 3.49Å; C310-Y357 PolarHBondContact O-OH 2.75Å; Q312-Y357 VanDerWaalsContact CD-CZ 3.4Å; Q312-Y357 VanDerWaalsContact CD-OH 3.26Å; Q312-Y357 HydrophobicContact CG-CD2 4.24Å; Q312-Y357 HydrophobicContact CG-CE2 3.41Å; Q312-Y357 VanDerWaalsContact CG-CE2 3.41Å; Q312-Y357 VanDerWaalsContact CG-OH 3.25Å; Q312-Y357 WeakPolarHBondContact CG-OH 3.26Å; Q312-Y357 VanDerWaalsContact NE2-CE1 3.28Å; Q312-Y357 PolarHBondContact NE2-OH 3.48Å; I320-Y357 HydrophobicContact CD1-CD1 4.13Å; I320-Y357 HydrophobicContact CD1-CE1 3.84Å; I320-Y357 HydrophobicContact CG2-CE1 4.42Å; Y357-D364 VanDerWaalsContact CA-OD1 3.24Å; Y357-D364 WeakPolarHBondContact CA-OD1 3.43Å; Y357-D364 WeakPolarHBondContact CB-OD1 3.32Å; Y357-C471 HydrophobicContact CD2-CB 4.31Å; Y357-C471 HydrophobicContact CE1-CB 4.45Å; Y357-C471 HydrophobicContact CE2-CB 4.07Å
358	L	67.5	Low	81.7	Confident	7 Å²	7	51.4 Å²	51.4	4%	0.037	25%	0.251	C	S	.	.			trans	-90.2	150.3	172.7	-53	-174.6	0	0	0	110.3	Q355 D360 C363 D364 R367 Y452 Y460 T461	Q355-L358 HydrophobicContact CG-CD2 4.31Å; L358-D360 PolarHBondContact O-N 3.2Å; L358-C363 HydrophobicContact CB-CB 4.39Å; L358-C363 HydrophobicContact CD1-CB 3.64Å; L358-D364 HydrophobicContact CB-CB 4.15Å; L358-D364 PolarHBondContact N-OD1 3.11Å; L358-R367 HydrophobicContact CD1-CB 4.2Å; L358-Y452 HydrophobicContact CD1-CD2 4.03Å; L358-Y452 HydrophobicContact CD1-CE2 3.87Å; L358-Y460 WeakPolarHBondContact CD2-O 3.41Å; L358-T461 HydrophobicContact CD1-CG2 4.39Å; L358-T461 HydrophobicContact CD2-CG2 4.17Å
359	K	70.1	Confident	81.5	Confident	157 Å²	157	49.2 Å²	49.2	68%	0.683	24%	0.242	S	C	*	.	S	Bend	trans	-63	-34.4	178.5	-170.7	177.5	-179.6	178.2	0	111.9	Y460	K359-Y460 HydrophobicContact CB-CD1 3.75Å; K359-Y460 HydrophobicContact CB-CE1 4.18Å; K359-Y460 HydrophobicContact CD-CE1 4.47Å
360	D	76.5	Confident	81.4	Confident	38 Å²	38	47.8 Å²	47.8	20%	0.203	24%	0.235	C	C	.	.	S	Bend	trans	-88.3	127.1	175.6	-179.7	88.1	0	0	0	111.3	L358 H362 C363 D364 Y460	L358-D360 PolarHBondContact O-N 3.2Å; D360-H362 PolarHBondContact O-N 3.49Å; D360-H362 WeakPolarHBondContact OD2-CA 3.44Å; D360-H362 WeakPolarHBondContact OD2-CB 3.43Å; D360-H362 PolarHBondContact OD2-N 2.91Å; D360-C363 HydrophobicContact CB-CB 4.04Å; D360-C363 PolarHBondContact O-N 2.92Å; D360-C363 PolarHBondContact OD2-N 2.89Å; D360-C363 PolarHBondContact OD2-SG 3.06Å; D360-C363 VanDerWaalsContact OD2-SG 3.35Å; D360-D364 WeakPolarHBondContact O-CB 3.36Å; D360-D364 PolarHBondContact O-N 2.86Å; D360-Y460 HydrophobicContact CB-CD2 3.77Å; D360-Y460 HydrophobicContact CB-CE1 4.41Å; D360-Y460 HydrophobicContact CB-CE2 3.48Å; D360-Y460 VanDerWaalsContact CB-CE2 3.48Å; D360-Y460 HydrophobicContact CB-CG 4.35Å
361	M	78.4	Confident	81.3	Confident	147 Å²	147	47.8 Å²	47.8	72%	0.724	23%	0.233	S	C	*	.	H	α-helix	trans	-65.3	-38	-175.7	-175.6	-179.4	76.8	0	0	112.8	D364 T365	M361-D364 PolarHBondContact O-N 2.66Å; M361-T365 PolarHBondContact O-N 2.68Å; M361-T365 PolarHBondContact O-OG1 3.23Å
362	H	86.1	Confident	81.3	Confident	61 Å²	61	51 Å²	51	28%	0.282	25%	0.253	S	S	.	.	H	α-helix	trans	-66	-49.7	178.4	167.2	82.8	0	0	0	109.6	D360 D364 T365 Q366 D451	D360-H362 PolarHBondContact O-N 3.49Å; D360-H362 WeakPolarHBondContact OD2-CA 3.44Å; D360-H362 WeakPolarHBondContact OD2-CB 3.43Å; D360-H362 PolarHBondContact OD2-N 2.91Å; H362-D364 VanDerWaalsContact C-N 3.31Å; H362-D364 PolarHBondContact O-N 2.84Å; H362-T365 WeakPolarHBondContact O-CB 3.27Å; H362-T365 PolarHBondContact O-N 3.35Å; H362-T365 VanDerWaalsContact O-N 3.1Å; H362-Q366 PolarHBondContact CE1-NE2 2.88Å; H362-Q366 WeakPolarHBondContact O-CG 3.34Å; H362-Q366 PolarHBondContact O-N 3.05Å; H362-D451 IonicContact NE2-OD2 3.31Å
363	C	86.2	Confident	81.5	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.4	-39.2	176.3	-67	0	0	0	0	112.7	L358 D360 T365 Q366 R367 C457 Y460	L358-C363 HydrophobicContact CB-CB 4.39Å; L358-C363 HydrophobicContact CD1-CB 3.64Å; D360-C363 HydrophobicContact CB-CB 4.04Å; D360-C363 PolarHBondContact O-N 2.92Å; D360-C363 PolarHBondContact OD2-N 2.89Å; D360-C363 PolarHBondContact OD2-SG 3.06Å; D360-C363 VanDerWaalsContact OD2-SG 3.35Å; C363-T365 VanDerWaalsContact C-N 3.29Å; C363-T365 PolarHBondContact O-N 3.47Å; C363-Q366 PolarHBondContact O-N 2.85Å; C363-R367 VanDerWaalsContact O-CB 3.29Å; C363-R367 WeakPolarHBondContact O-CB 3.48Å; C363-R367 PolarHBondContact O-N 2.75Å; C363-C457 WeakPolarHBondContact CA-SG 3.39Å; C363-C457 HydrophobicContact CB-CB 3.56Å; C363-C457 WeakPolarHBondContact CB-SG 3.42Å; C363-C457 WeakPolarHBondContact SG-CA 3.42Å; C363-C457 WeakPolarHBondContact SG-CB 3.34Å; C363-C457 CovalentContact SG-SG 2.04Å; C363-C457 PolarHBondContact SG-SG 3.03Å; C363-Y460 HydrophobicContact CB-CD2 4.46Å
364	D	82.1	Confident	81.7	Confident	10 Å²	10	49.9 Å²	49.9	5%	0.053	25%	0.252	C	S	.	.	H	α-helix	trans	-62.5	-39.1	176	-167.4	56.9	0	0	0	111.9	Y357 L358 D360 M361 H362 R367 R368	Y357-D364 VanDerWaalsContact CA-OD1 3.24Å; Y357-D364 WeakPolarHBondContact CA-OD1 3.43Å; Y357-D364 WeakPolarHBondContact CB-OD1 3.32Å; L358-D364 HydrophobicContact CB-CB 4.15Å; L358-D364 PolarHBondContact N-OD1 3.11Å; D360-D364 WeakPolarHBondContact O-CB 3.36Å; D360-D364 PolarHBondContact O-N 2.86Å; M361-D364 PolarHBondContact O-N 2.66Å; H362-D364 VanDerWaalsContact C-N 3.31Å; H362-D364 PolarHBondContact O-N 2.84Å; D364-R367 WeakPolarHBondContact O-CB 3.41Å; D364-R367 IonicContact OD1-CZ 2.92Å; D364-R367 IonicContact OD1-NE 3.93Å; D364-R367 PolarHBondContact OD1-NE 2.92Å; D364-R367 VanDerWaalsContact OD1-NE 3.1Å; D364-R367 IonicContact OD1-NH2 3.9Å; D364-R367 PolarHBondContact OD1-NH2 2.93Å; D364-R367 IonicContact OD2-NH2 3.85Å; D364-R368 WeakPolarHBondContact O-CG 3.29Å; D364-R368 PolarHBondContact O-N 2.87Å; D364-R368 IonicContact OD2-CZ 3.99Å; D364-R368 IonicContact OD2-NE 2.99Å; D364-R368 PolarHBondContact OD2-NE 2.79Å; D364-R368 IonicContact OD2-NH2 2.9Å; D364-R368 PolarHBondContact OD2-NH2 2.76Å
365	T	85.3	Confident	81.7	Confident	66 Å²	66	53.8 Å²	53.8	41%	0.405	26%	0.26	S	S	.	.	H	α-helix	trans	-64.9	-49.3	176.3	-56.3	0	0	0	0	110.9	M361 H362 C363 R367 R368 I369	M361-T365 PolarHBondContact O-N 2.68Å; M361-T365 PolarHBondContact O-OG1 3.23Å; H362-T365 WeakPolarHBondContact O-CB 3.27Å; H362-T365 PolarHBondContact O-N 3.35Å; H362-T365 VanDerWaalsContact O-N 3.1Å; C363-T365 VanDerWaalsContact C-N 3.29Å; C363-T365 PolarHBondContact O-N 3.47Å; T365-R367 VanDerWaalsContact C-N 3.31Å; T365-R367 PolarHBondContact O-N 3.33Å; T365-R368 PolarHBondContact O-N 3.47Å; T365-R368 VanDerWaalsContact O-N 3.17Å; T365-I369 HydrophobicContact CG2-CD1 4.14Å; T365-I369 WeakPolarHBondContact O-CG1 3.49Å; T365-I369 PolarHBondContact O-N 3.01Å; T365-I369 VanDerWaalsContact O-N 3.12Å
366	Q	88.3	Confident	81.8	Confident	28 Å²	28	58 Å²	58	13%	0.131	28%	0.28	C	S	.	.	H	α-helix	trans	-60.8	-40.8	178.1	-61.7	-49.4	-21.8	0	0	112	H362 C363 R368 I369 C370 S448 D451	H362-Q366 PolarHBondContact CE1-NE2 2.88Å; H362-Q366 WeakPolarHBondContact O-CG 3.34Å; H362-Q366 PolarHBondContact O-N 3.05Å; C363-Q366 PolarHBondContact O-N 2.85Å; Q366-R368 PolarHBondContact O-N 2.87Å; Q366-I369 PolarHBondContact O-N 2.92Å; Q366-C370 VanDerWaalsContact O-CB 3.3Å; Q366-C370 WeakPolarHBondContact O-CB 3.21Å; Q366-C370 PolarHBondContact O-N 3.4Å; Q366-S448 PolarHBondContact OE1-OG 3.23Å; Q366-D451 HydrophobicContact CB-CB 4.29Å; Q366-D451 HydrophobicContact CG-CB 3.88Å
367	R	86.5	Confident	82	Confident	10 Å²	10	59.2 Å²	59.2	4%	0.038	29%	0.289	C	S	.	.	H	α-helix	trans	-57	-49.1	173.3	179.5	-169.4	67.8	136	11.4	112	Q355 S356 L358 C363 D364 T365 I369 C370 Q371 Y452	Q355-R367 PolarHBondContact O-NH1 2.99Å; S356-R367 PolarHBondContact O-NH1 3.48Å; S356-R367 PolarHBondContact O-NH2 3.32Å; L358-R367 HydrophobicContact CD1-CB 4.2Å; C363-R367 VanDerWaalsContact O-CB 3.29Å; C363-R367 WeakPolarHBondContact O-CB 3.48Å; C363-R367 PolarHBondContact O-N 2.75Å; D364-R367 WeakPolarHBondContact O-CB 3.41Å; D364-R367 IonicContact OD1-CZ 2.92Å; D364-R367 IonicContact OD1-NE 3.93Å; D364-R367 PolarHBondContact OD1-NE 2.92Å; D364-R367 VanDerWaalsContact OD1-NE 3.1Å; D364-R367 IonicContact OD1-NH2 3.9Å; D364-R367 PolarHBondContact OD1-NH2 2.93Å; D364-R367 IonicContact OD2-NH2 3.85Å; T365-R367 VanDerWaalsContact C-N 3.31Å; T365-R367 PolarHBondContact O-N 3.33Å; R367-I369 VanDerWaalsContact C-N 3.35Å; R367-I369 PolarHBondContact O-N 3.28Å; R367-C370 PolarHBondContact O-N 2.93Å; R367-Q371 HydrophobicContact CG-CG 4.25Å; R367-Q371 WeakPolarHBondContact O-CB 3.01Å; R367-Q371 WeakPolarHBondContact O-CG 3.41Å; R367-Q371 PolarHBondContact O-N 2.78Å; R367-Y452 HydrophobicContact CB-CD2 3.52Å; R367-Y452 HydrophobicContact CB-CE2 3.67Å; R367-Y452 HydrophobicContact CB-CG 4.05Å; R367-Y452 HydrophobicContact CG-CD2 3.93Å; R367-Y452 HydrophobicContact CG-CE1 4.26Å; R367-Y452 HydrophobicContact CG-CE2 3.54Å; R367-Y452 HydrophobicContact CG-CG 4.45Å
368	R	84.6	Confident	82.1	Confident	125 Å²	125	60.3 Å²	60.3	47%	0.472	30%	0.298	S	S	.	.	H	α-helix	trans	-60.8	-44.2	-178.9	-71.5	175.9	-161.9	-166.3	3.5	111.4	D364 T365 Q366 T372	D364-R368 WeakPolarHBondContact O-CG 3.29Å; D364-R368 PolarHBondContact O-N 2.87Å; D364-R368 IonicContact OD2-CZ 3.99Å; D364-R368 IonicContact OD2-NE 2.99Å; D364-R368 PolarHBondContact OD2-NE 2.79Å; D364-R368 IonicContact OD2-NH2 2.9Å; D364-R368 PolarHBondContact OD2-NH2 2.76Å; T365-R368 PolarHBondContact O-N 3.47Å; T365-R368 VanDerWaalsContact O-N 3.17Å; Q366-R368 PolarHBondContact O-N 2.87Å; R368-T372 WeakPolarHBondContact O-CB 3.47Å; R368-T372 PolarHBondContact O-N 2.93Å; R368-T372 PolarHBondContact O-OG1 2.86Å
369	I	87.4	Confident	82.2	Confident	77 Å²	77	65.2 Å²	65.2	40%	0.395	32%	0.324	S	S	.	.	H	α-helix	trans	-62.7	-49	177.1	-61.9	167.8	0	0	0	110	T365 Q366 R367 Q371 T372 C373 S448	T365-I369 HydrophobicContact CG2-CD1 4.14Å; T365-I369 WeakPolarHBondContact O-CG1 3.49Å; T365-I369 PolarHBondContact O-N 3.01Å; T365-I369 VanDerWaalsContact O-N 3.12Å; Q366-I369 PolarHBondContact O-N 2.92Å; R367-I369 VanDerWaalsContact C-N 3.35Å; R367-I369 PolarHBondContact O-N 3.28Å; I369-Q371 PolarHBondContact O-N 2.89Å; I369-T372 WeakPolarHBondContact O-CB 3.5Å; I369-T372 PolarHBondContact O-N 2.9Å; I369-C373 PolarHBondContact O-N 2.82Å; I369-C373 VanDerWaalsContact O-N 3.09Å; I369-S448 WeakPolarHBondContact CG2-OG 3.26Å
370	C	88	Confident	81.8	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.5	-49.2	179.2	-179	0	0	0	0	112.7	Q366 R367 T372 C373 L374 C449 Y452	Q366-C370 VanDerWaalsContact O-CB 3.3Å; Q366-C370 WeakPolarHBondContact O-CB 3.21Å; Q366-C370 PolarHBondContact O-N 3.4Å; R367-C370 PolarHBondContact O-N 2.93Å; C370-T372 VanDerWaalsContact C-N 3.28Å; C370-T372 PolarHBondContact O-N 3.47Å; C370-C373 WeakPolarHBondContact O-CB 3.35Å; C370-C373 PolarHBondContact O-N 2.94Å; C370-L374 WeakPolarHBondContact O-CG 3.33Å; C370-L374 PolarHBondContact O-N 2.83Å; C370-C449 WeakPolarHBondContact CA-SG 3.38Å; C370-C449 HydrophobicContact CB-CB 3.94Å; C370-C449 WeakPolarHBondContact CB-SG 3.44Å; C370-C449 WeakPolarHBondContact SG-CA 3.34Å; C370-C449 WeakPolarHBondContact SG-CB 3.3Å; C370-C449 CovalentContact SG-SG 2.04Å; C370-C449 PolarHBondContact SG-SG 2.67Å; C370-Y452 HydrophobicContact CB-CD1 4.29Å
371	Q	85.7	Confident	80.9	Confident	66 Å²	66	64.8 Å²	64.8	31%	0.308	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-33.8	178.7	-74.1	-176.5	-11.9	0	0	112.5	R367 I369 L374 K375	R367-Q371 HydrophobicContact CG-CG 4.25Å; R367-Q371 WeakPolarHBondContact O-CB 3.01Å; R367-Q371 WeakPolarHBondContact O-CG 3.41Å; R367-Q371 PolarHBondContact O-N 2.78Å; I369-Q371 PolarHBondContact O-N 2.89Å; Q371-L374 PolarHBondContact O-N 2.84Å; Q371-K375 WeakPolarHBondContact O-CB 3.34Å; Q371-K375 WeakPolarHBondContact O-CG 3.35Å; Q371-K375 PolarHBondContact O-N 3.44Å
372	T	85.6	Confident	79.7	Confident	71 Å²	71	63.5 Å²	63.5	44%	0.436	32%	0.316	S	S	.	.	H	α-helix	trans	-64.5	-45	175.4	-58.6	0	0	0	0	110.6	R368 I369 C370 K375 Q376	R368-T372 WeakPolarHBondContact O-CB 3.47Å; R368-T372 PolarHBondContact O-N 2.93Å; R368-T372 PolarHBondContact O-OG1 2.86Å; I369-T372 WeakPolarHBondContact O-CB 3.5Å; I369-T372 PolarHBondContact O-N 2.9Å; C370-T372 VanDerWaalsContact C-N 3.28Å; C370-T372 PolarHBondContact O-N 3.47Å; T372-K375 PolarHBondContact O-N 3.3Å; T372-Q376 WeakPolarHBondContact O-CB 3.45Å; T372-Q376 WeakPolarHBondContact O-CG 3.35Å; T372-Q376 PolarHBondContact O-N 3.39Å
373	C	86.4	Confident	78.2	Confident	34 Å²	34	65 Å²	65	23%	0.23	33%	0.329	C	S	.	.	H	α-helix	trans	-58.7	-50.8	174.2	-173.7	0	0	0	0	111.4	I369 C370 K375 Q376 S377 C443	I369-C373 PolarHBondContact O-N 2.82Å; I369-C373 VanDerWaalsContact O-N 3.09Å; C370-C373 WeakPolarHBondContact O-CB 3.35Å; C370-C373 PolarHBondContact O-N 2.94Å; C373-K375 VanDerWaalsContact C-N 3.33Å; C373-K375 PolarHBondContact O-N 3.38Å; C373-Q376 PolarHBondContact O-N 2.81Å; C373-S377 WeakPolarHBondContact O-CB 3.39Å; C373-S377 PolarHBondContact O-N 2.89Å; C373-C443 HydrophobicContact CB-CB 3.81Å; C373-C443 WeakPolarHBondContact CB-SG 3Å; C373-C443 PolarHBondContact O-SG 2.88Å; C373-C443 VanDerWaalsContact SG-CA 3.57Å; C373-C443 WeakPolarHBondContact SG-CB 3.43Å; C373-C443 CovalentContact SG-SG 2.05Å; C373-C443 PolarHBondContact SG-SG 3.37Å
374	L	84.3	Confident	76.5	Confident	38 Å²	38	71 Å²	71	20%	0.199	36%	0.357	C	S	.	.	H	α-helix	trans	-58.2	-44.9	-178.3	-71.4	169.3	0	0	0	111.7	C370 Q371 C378 C443 Y444	C370-L374 WeakPolarHBondContact O-CG 3.33Å; C370-L374 PolarHBondContact O-N 2.83Å; Q371-L374 PolarHBondContact O-N 2.84Å; L374-C378 PolarHBondContact O-N 2.63Å; L374-C378 PolarHBondContact O-SG 3.19Å; L374-C443 HydrophobicContact CD2-CB 3.74Å; L374-C443 HydrophobicContact CG-CB 4.09Å; L374-C443 PolarHBondContact N-SG 3.28Å; L374-Y444 HydrophobicContact CD2-CD2 4.34Å; L374-Y444 HydrophobicContact CD2-CE2 3.89Å
375	K	81.4	Confident	74.9	Confident	145 Å²	145	74.9 Å²	74.9	63%	0.63	38%	0.378	S	S	*	.	H	α-helix	trans	-61.4	-48	176.2	-75	178.1	179.9	-178.9	0	111.8	Q371 T372 C373 C378 L379	Q371-K375 WeakPolarHBondContact O-CB 3.34Å; Q371-K375 WeakPolarHBondContact O-CG 3.35Å; Q371-K375 PolarHBondContact O-N 3.44Å; T372-K375 PolarHBondContact O-N 3.3Å; C373-K375 VanDerWaalsContact C-N 3.33Å; C373-K375 PolarHBondContact O-N 3.38Å; K375-C378 PolarHBondContact O-N 3.16Å; K375-L379 WeakPolarHBondContact O-CB 3.39Å; K375-L379 WeakPolarHBondContact O-CD1 3.43Å; K375-L379 PolarHBondContact O-N 3.25Å
376	Q	81.1	Confident	73.1	Confident	111 Å²	111	78 Å²	78	52%	0.519	39%	0.386	S	S	.	.	H	α-helix	trans	-65	-40.3	-179	-73.4	177.6	-6	0	0	112.7	T372 C373 C378 L379 K380	T372-Q376 WeakPolarHBondContact O-CB 3.45Å; T372-Q376 WeakPolarHBondContact O-CG 3.35Å; T372-Q376 PolarHBondContact O-N 3.39Å; C373-Q376 PolarHBondContact O-N 2.81Å; Q376-C378 VanDerWaalsContact C-N 3.32Å; Q376-C378 PolarHBondContact O-N 2.91Å; Q376-L379 PolarHBondContact O-N 3.13Å; Q376-K380 PolarHBondContact O-N 2.9Å
377	S	77.6	Confident	71.1	Confident	37 Å²	37	80 Å²	80	26%	0.259	40%	0.403	S	S	.	.	H	α-helix	trans	-63.5	-38.2	178.9	-173.4	0	0	0	0	112.1	C373 S381 G440	C373-S377 WeakPolarHBondContact O-CB 3.39Å; C373-S377 PolarHBondContact O-N 2.89Å; S377-S381 PolarHBondContact O-N 3.06Å; S377-G440 WeakPolarHBondContact OG-CA 3.41Å; S377-G440 PolarHBondContact OG-N 3.1Å
378	C	74.8	Confident	69.2	Low	38 Å²	38	85.3 Å²	85.3	26%	0.257	43%	0.428	S	S	.	.	H	α-helix	trans	-79.9	-21.3	177.7	-68.4	0	0	0	0	113.8	L374 K375 Q376 S381 C439	L374-C378 PolarHBondContact O-N 2.63Å; L374-C378 PolarHBondContact O-SG 3.19Å; K375-C378 PolarHBondContact O-N 3.16Å; Q376-C378 VanDerWaalsContact C-N 3.32Å; Q376-C378 PolarHBondContact O-N 2.91Å; C378-S381 PolarHBondContact O-OG 2.92Å; C378-S381 VanDerWaalsContact O-OG 3.1Å; C378-C439 HydrophobicContact CB-CB 3.84Å; C378-C439 WeakPolarHBondContact CB-SG 3.38Å; C378-C439 VanDerWaalsContact SG-C 3.56Å; C378-C439 WeakPolarHBondContact SG-CB 3.44Å; C378-C439 PolarHBondContact SG-O 2.98Å; C378-C439 VanDerWaalsContact SG-O 3.38Å; C378-C439 CovalentContact SG-SG 2.04Å; C378-C439 PolarHBondContact SG-SG 3.01Å
379	L	69.4	Low	67.3	Low	111 Å²	111	85.1 Å²	85.1	58%	0.581	43%	0.434	S	S	*	.	H	α-helix	trans	-73.3	-47.1	171.5	-100.4	139	0	0	0	110.9	K375 Q376 S381 K382 T383	K375-L379 WeakPolarHBondContact O-CB 3.39Å; K375-L379 WeakPolarHBondContact O-CD1 3.43Å; K375-L379 PolarHBondContact O-N 3.25Å; Q376-L379 PolarHBondContact O-N 3.13Å; L379-S381 VanDerWaalsContact C-N 3.34Å; L379-S381 PolarHBondContact O-N 2.7Å; L379-K382 PolarHBondContact O-N 2.95Å; L379-K382 VanDerWaalsContact O-N 3.14Å; L379-T383 PolarHBondContact O-N 3.08Å; L379-T383 PolarHBondContact O-OG1 3.16Å
380	K	62.1	Low	65.1	Low	143 Å²	143	86.3 Å²	86.3	62%	0.622	44%	0.441	S	S	*	.	H	α-helix	trans	-57.8	-44.3	179.3	-73.4	-175.5	179.2	-174.5	0	112.5	Q376 K382 T383 E384	Q376-K380 PolarHBondContact O-N 2.9Å; K380-K382 VanDerWaalsContact C-N 3.28Å; K380-K382 PolarHBondContact O-N 2.87Å; K380-T383 PolarHBondContact O-N 3.28Å; K380-E384 WeakPolarHBondContact O-CG 3.36Å; K380-E384 PolarHBondContact O-N 2.9Å
381	S	57.3	Low	63.1	Low	43 Å²	43	91.7 Å²	91.7	30%	0.301	47%	0.47	S	S	.	.	H	α-helix	trans	-61.5	-35.8	178.2	63.2	0	0	0	0	112.6	S377 C378 L379 L385	S377-S381 PolarHBondContact O-N 3.06Å; C378-S381 PolarHBondContact O-OG 2.92Å; C378-S381 VanDerWaalsContact O-OG 3.1Å; L379-S381 VanDerWaalsContact C-N 3.34Å; L379-S381 PolarHBondContact O-N 2.7Å; S381-L385 PolarHBondContact O-N 2.99Å; S381-L385 VanDerWaalsContact O-N 3.17Å
382	K	54.5	Low	61.3	Low	120 Å²	120	95.6 Å²	95.6	52%	0.522	49%	0.485	S	S	.	.	H	α-helix	trans	-71.6	-41.9	175.1	-77.9	-174.7	177.4	-179.5	0	112.7	L379 K380 E384 L385 F386	L379-K382 PolarHBondContact O-N 2.95Å; L379-K382 VanDerWaalsContact O-N 3.14Å; K380-K382 VanDerWaalsContact C-N 3.28Å; K380-K382 PolarHBondContact O-N 2.87Å; K382-E384 VanDerWaalsContact C-N 3.3Å; K382-E384 PolarHBondContact O-N 2.75Å; K382-L385 WeakPolarHBondContact O-CB 3.25Å; K382-L385 PolarHBondContact O-N 3.06Å; K382-F386 WeakPolarHBondContact O-CD2 3.21Å; K382-F386 PolarHBondContact O-N 3.14Å
383	T	52.9	Low	59.4	Low	91 Å²	91	98.7 Å²	98.7	56%	0.558	49%	0.493	S	S	*	.	H	α-helix	trans	-64.4	-38.9	179.8	-39.1	0	0	0	0	111.1	L379 K380 F386 S387	L379-T383 PolarHBondContact O-N 3.08Å; L379-T383 PolarHBondContact O-OG1 3.16Å; K380-T383 PolarHBondContact O-N 3.28Å; T383-F386 PolarHBondContact O-N 2.93Å; T383-S387 WeakPolarHBondContact O-CB 3.47Å; T383-S387 PolarHBondContact O-N 3.46Å
384	E	52.1	Low	57.3	Low	126 Å²	126	99.4 Å²	99.4	59%	0.589	50%	0.501	S	S	*	.	H	α-helix	trans	-60.3	-46.8	172.4	-73.7	169.7	-175.9	0	0	110.7	K380 K382 F386 S387 E388	K380-E384 WeakPolarHBondContact O-CG 3.36Å; K380-E384 PolarHBondContact O-N 2.9Å; K382-E384 VanDerWaalsContact C-N 3.3Å; K382-E384 PolarHBondContact O-N 2.75Å; E384-F386 PolarHBondContact O-N 2.92Å; E384-S387 PolarHBondContact O-N 2.03Å; E384-S387 PolarHBondContact O-OG 3.3Å; E384-E388 PolarHBondContact O-N 2.95Å
385	L	48.7	Very low	55.6	Low	92 Å²	92	103.4 Å²	103.4	48%	0.482	52%	0.519	S	S	.	.	H	α-helix	trans	-61.2	-42.4	177	-149.6	94.8	0	0	0	113.4	S381 K382 S387 E388 M389	S381-L385 PolarHBondContact O-N 2.99Å; S381-L385 VanDerWaalsContact O-N 3.17Å; K382-L385 WeakPolarHBondContact O-CB 3.25Å; K382-L385 PolarHBondContact O-N 3.06Å; L385-S387 VanDerWaalsContact C-N 3.35Å; L385-E388 PolarHBondContact O-N 2.85Å; L385-M389 PolarHBondContact O-N 2.8Å
386	F	46.4	Very low	53.8	Low	132 Å²	132	103.1 Å²	103.1	58%	0.579	52%	0.519	S	S	*	.	H	α-helix	trans	-67.7	-35.6	176.3	-89.4	-75	0	0	0	112.1	K382 T383 E384 M389 N390	K382-F386 WeakPolarHBondContact O-CD2 3.21Å; K382-F386 PolarHBondContact O-N 3.14Å; T383-F386 PolarHBondContact O-N 2.93Å; E384-F386 PolarHBondContact O-N 2.92Å; F386-M389 PolarHBondContact O-N 3.26Å; F386-N390 WeakPolarHBondContact O-CB 3.12Å; F386-N390 PolarHBondContact O-N 3.17Å; F386-N390 PolarHBondContact O-ND2 2.98Å
387	S	46.6	Very low	51.9	Low	70 Å²	70	102.6 Å²	102.6	49%	0.49	52%	0.52	S	S	.	.	H	α-helix	trans	-64.7	-41	175.4	76.9	0	0	0	0	111.4	T383 E384 L385 L391	T383-S387 WeakPolarHBondContact O-CB 3.47Å; T383-S387 PolarHBondContact O-N 3.46Å; E384-S387 PolarHBondContact O-N 2.03Å; E384-S387 PolarHBondContact O-OG 3.3Å; L385-S387 VanDerWaalsContact C-N 3.35Å; S387-L391 WeakPolarHBondContact O-CB 3.17Å; S387-L391 PolarHBondContact O-N 3.27Å
388	E	46.7	Very low	50.2	Low	122 Å²	122	108.3 Å²	108.3	57%	0.57	55%	0.547	S	S	*	.	H	α-helix	trans	-68.6	-41.2	176.2	-74.5	-169.7	162.6	0	0	112.7	E384 L385 L391 K392	E384-E388 PolarHBondContact O-N 2.95Å; L385-E388 PolarHBondContact O-N 2.85Å; E388-L391 PolarHBondContact O-N 3.35Å; E388-K392 PolarHBondContact O-N 2.82Å
389	M	44.3	Very low	48.8	Very low	121 Å²	121	114 Å²	114	60%	0.596	57%	0.574	S	S	*	*	H	α-helix	trans	-64.7	-42.4	176.2	-94.7	-170.3	70.7	0	0	112.1	L385 F386 K392 K393	L385-M389 PolarHBondContact O-N 2.8Å; F386-M389 PolarHBondContact O-N 3.26Å; M389-K392 PolarHBondContact O-N 3.36Å; M389-K393 WeakPolarHBondContact O-CB 3.21Å; M389-K393 PolarHBondContact O-N 2.86Å
390	N	41.4	Very low	47.2	Very low	102 Å²	102	111.6 Å²	111.6	55%	0.545	57%	0.567	S	S	.	*	H	α-helix	trans	-69.3	-34.8	177.4	-75.7	-24.2	0	0	0	111.8	F386 K393 A394	F386-N390 WeakPolarHBondContact O-CB 3.12Å; F386-N390 PolarHBondContact O-N 3.17Å; F386-N390 PolarHBondContact O-ND2 2.98Å; N390-K393 PolarHBondContact O-N 2.87Å; N390-A394 WeakPolarHBondContact O-CB 3.04Å; N390-A394 PolarHBondContact O-N 3.1Å
391	L	44.9	Very low	45.7	Very low	113 Å²	113	111.6 Å²	111.6	59%	0.592	57%	0.574	S	S	*	*	H	α-helix	trans	-65	-42.7	173.9	-158	82.4	0	0	0	111.3	S387 E388 A394 Q395	S387-L391 WeakPolarHBondContact O-CB 3.17Å; S387-L391 PolarHBondContact O-N 3.27Å; E388-L391 PolarHBondContact O-N 3.35Å; L391-A394 PolarHBondContact O-N 3.08Å; L391-Q395 WeakPolarHBondContact O-CB 3.46Å; L391-Q395 WeakPolarHBondContact O-CG 3.35Å; L391-Q395 PolarHBondContact O-N 3.19Å
392	K	49.9	Very low	44.4	Very low	147 Å²	147	119.6 Å²	119.6	64%	0.639	61%	0.606	S	S	*	*	H	α-helix	trans	-67	-38.2	175.3	-76.2	-178.1	179.5	173.2	0	112.5	E388 M389 Q395 H396	E388-K392 PolarHBondContact O-N 2.82Å; M389-K392 PolarHBondContact O-N 3.36Å; K392-Q395 PolarHBondContact O-N 2.93Å; K392-H396 WeakPolarHBondContact O-CB 3.39Å; K392-H396 PolarHBondContact O-N 3.33Å
393	K	44.7	Very low	43.1	Very low	137 Å²	137	116.7 Å²	116.7	60%	0.596	61%	0.61	S	S	*	*	H	α-helix	trans	-72.5	-35.4	177.7	-147.3	177.3	-172	-175.8	0	112.1	M389 N390 H396 N397	M389-K393 WeakPolarHBondContact O-CB 3.21Å; M389-K393 PolarHBondContact O-N 2.86Å; N390-K393 PolarHBondContact O-N 2.87Å; K393-H396 PolarHBondContact O-N 2.71Å; K393-N397 WeakPolarHBondContact O-CB 3.46Å; K393-N397 PolarHBondContact O-N 3.3Å
394	A	42.8	Very low	42	Very low	49 Å²	49	121.8 Å²	121.8	41%	0.405	63%	0.627	S	S	.	*	H	α-helix	trans	-65.4	-41.7	171.4	0	0	0	0	0	111.4	N390 L391 H396 N397 L398	N390-A394 WeakPolarHBondContact O-CB 3.04Å; N390-A394 PolarHBondContact O-N 3.1Å; L391-A394 PolarHBondContact O-N 3.08Å; A394-H396 VanDerWaalsContact C-N 3.32Å; A394-H396 PolarHBondContact O-N 2.91Å; A394-N397 PolarHBondContact O-N 3.43Å; A394-L398 WeakPolarHBondContact O-CB 3.36Å; A394-L398 WeakPolarHBondContact O-CD1 3Å; A394-L398 PolarHBondContact O-N 3.08Å
395	Q	48.2	Very low	41.1	Very low	121 Å²	121	123.3 Å²	123.3	57%	0.565	64%	0.638	S	S	*	*	H	α-helix	trans	-64	-36.4	173	-79.6	178.9	-25.1	0	0	112.4	L391 K392	L391-Q395 WeakPolarHBondContact O-CB 3.46Å; L391-Q395 WeakPolarHBondContact O-CG 3.35Å; L391-Q395 PolarHBondContact O-N 3.19Å; K392-Q395 PolarHBondContact O-N 2.93Å
396	H	44.1	Very low	40.1	Very low	139 Å²	139	127.8 Å²	127.8	64%	0.644	66%	0.656	S	S	*	*	H	α-helix	trans	-77.8	-30.6	179.7	-147.2	-61	0	0	0	113.4	K392 K393 A394 L399	K392-H396 WeakPolarHBondContact O-CB 3.39Å; K392-H396 PolarHBondContact O-N 3.33Å; K393-H396 PolarHBondContact O-N 2.71Å; A394-H396 VanDerWaalsContact C-N 3.32Å; A394-H396 PolarHBondContact O-N 2.91Å; H396-L399 PolarHBondContact O-N 2.72Å
397	N	40.9	Very low	39.3	Very low	101 Å²	101	128.2 Å²	128.2	54%	0.54	66%	0.664	S	S	.	*	H	α-helix	trans	-78.5	-29.7	174.7	-75	-3.4	0	0	0	112.3	K393 A394 L399 S400	K393-N397 WeakPolarHBondContact O-CB 3.46Å; K393-N397 PolarHBondContact O-N 3.3Å; A394-N397 PolarHBondContact O-N 3.43Å; N397-L399 PolarHBondContact O-N 3.27Å; N397-S400 CarbonylContact O-C 3.45Å; N397-S400 PolarHBondContact O-N 2.85Å; N397-S400 VanDerWaalsContact O-N 3.09Å
398	L	41.9	Very low	38.5	Very low	156 Å²	156	132.4 Å²	132.4	82%	0.817	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-18.8	171.4	-89.1	157.7	0	0	0	113.1	A394	A394-L398 WeakPolarHBondContact O-CB 3.36Å; A394-L398 WeakPolarHBondContact O-CD1 3Å; A394-L398 PolarHBondContact O-N 3.08Å
399	L	45.5	Very low	37.7	Very low	159 Å²	159	135.2 Å²	135.2	83%	0.832	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-1.8	174.4	-80.1	157.6	0	0	0	113.7	H396 N397	H396-L399 PolarHBondContact O-N 2.72Å; N397-L399 PolarHBondContact O-N 3.27Å
400	S	35.2	Very low	37	Very low	60 Å²	60	136.7 Å²	136.7	42%	0.42	71%	0.705	S	S	.	*	S	Bend	trans	-141.8	90.2	-175.2	170	0	0	0	0	110.7	N397	N397-S400 CarbonylContact O-C 3.45Å; N397-S400 PolarHBondContact O-N 2.85Å; N397-S400 VanDerWaalsContact O-N 3.09Å
401	N	30.7	Very low	36.4	Very low	143 Å²	143	140.1 Å²	140.1	77%	0.765	72%	0.715	S	S	*	*			trans	113.5	96.8	160.8	-59.3	-17	0	0	0	115.3	G403	N401-G403 PolarHBondContact O-N 3.15Å
402	H	29.7	Very low	35.8	Very low	211 Å²	211	141.5 Å²	141.5	98%	0.977	72%	0.723	S	S	*	*			trans	-60	106.7	139.9	-86.9	-45.2	0	0	0	108.3
403	G	28.3	Very low	35	Very low	59 Å²	59	143 Å²	143	61%	0.608	73%	0.732	S	S	*	*	S	Bend	trans	165.4	90.5	174.9	0	0	0	0	0	112.3	N401	N401-G403 PolarHBondContact O-N 3.15Å
404	E	29.6	Very low	34.3	Very low	197 Å²	197	144.4 Å²	144.4	92%	0.921	74%	0.741	S	S	*	*			trans	33.2	100.8	154.5	-62.7	179.7	171.4	0	0	118.3
405	I	31.8	Very low	33.7	Very low	159 Å²	159	147.4 Å²	147.4	82%	0.815	75%	0.749	S	S	*	*			trans	-94.2	103.2	168.4	-62.9	171.6	0	0	0	107.7
406	E	28.7	Very low	32.9	Very low	186 Å²	186	149.5 Å²	149.5	87%	0.869	76%	0.757	S	S	*	*			trans	-73.1	127.4	163.5	-82.7	-173.3	151.4	0	0	110	N408	E406-N408 PolarHBondContact O-N 3.13Å
407	N	30.6	Very low	32.1	Very low	140 Å²	140	151.6 Å²	151.6	75%	0.749	76%	0.76	S	S	*	*			trans	-68.8	116.5	179.6	-67.4	-42.7	0	0	0	110.8
408	N	29	Very low	31.5	Very low	159 Å²	159	148.7 Å²	148.7	85%	0.85	75%	0.754	S	S	*	*			trans	-130.2	88.5	159.5	-133	-8.5	0	0	0	109.7	E406 D410	E406-N408 PolarHBondContact O-N 3.13Å; N408-D410 PolarHBondContact O-N 3.43Å
409	H	29.2	Very low	30.9	Very low	180 Å²	180	146.2 Å²	146.2	83%	0.833	74%	0.741	S	S	*	*			trans	-76.9	96.6	171.7	-94.1	-69.1	0	0	0	109.1
410	D	30.2	Very low	30.2	Very low	152 Å²	152	144.6 Å²	144.6	81%	0.813	73%	0.733	S	S	*	*			trans	-152	70.8	157.5	-140.3	1.9	0	0	0	110.9	N408	N408-D410 PolarHBondContact O-N 3.43Å
411	F	28.4	Very low	29.8	Very low	174 Å²	174	146 Å²	146	76%	0.763	74%	0.735	S	S	*	*			trans	-133	90.1	173.5	-98	-82.9	0	0	0	107.4
412	N	33.8	Very low	29.6	Very low	142 Å²	142	147.6 Å²	147.6	76%	0.759	73%	0.73	S	S	*	*	S	Bend	trans	-156.4	-2.9	161.4	-98.2	-25.5	0	0	0	117.7
413	E	31.4	Very low	29.7	Very low	178 Å²	178	141 Å²	141	83%	0.832	71%	0.705	S	S	*	*	S	Bend	trans	-98.8	-24.8	178.4	-75.9	-164.1	148.7	0	0	115.8	I415	E413-I415 PolarHBondContact O-N 2.85Å
414	E	30.7	Very low	29.9	Very low	168 Å²	168	141.7 Å²	141.7	79%	0.785	70%	0.695	S	S	*	*	H	α-helix	trans	-75.4	-20.1	-176.5	-85.2	-167.1	145.8	0	0	114.9	F416 G418	E414-F416 VanDerWaalsContact C-N 3.33Å; E414-F416 PolarHBondContact O-N 3.07Å; E414-G418 PolarHBondContact O-N 3.33Å
415	I	30.9	Very low	29.9	Very low	111 Å²	111	135 Å²	135	57%	0.569	67%	0.668	S	S	*	*	H	α-helix	trans	-72.8	-25.9	-174.8	-63	177.4	0	0	0	112.1	E413 N419	E413-I415 PolarHBondContact O-N 2.85Å; I415-N419 PolarHBondContact O-ND2 3.19Å
416	F	30.3	Very low	30.1	Very low	166 Å²	166	131.1 Å²	131.1	73%	0.728	65%	0.647	S	S	*	*	H	α-helix	trans	-77.2	-35.9	-174.7	-152.6	-98	0	0	0	112.8	E414	E414-F416 VanDerWaalsContact C-N 3.33Å; E414-F416 PolarHBondContact O-N 3.07Å
417	Y	27.9	Very low	30.4	Very low	183 Å²	183	129 Å²	129	72%	0.718	64%	0.638	S	S	*	*	H	α-helix	trans	-89.7	-26.8	-178.5	-73.3	-77.2	0	0	0	114	N419	Y417-N419 PolarHBondContact O-N 2.99Å
418	G	29	Very low	30.6	Very low	39 Å²	39	129.7 Å²	129.7	40%	0.402	64%	0.636	S	S	.	*	H	α-helix	trans	-63.2	-25	178.6	0	0	0	0	0	114.4	E414	E414-G418 PolarHBondContact O-N 3.33Å
419	N	28.7	Very low	30.7	Very low	104 Å²	104	125.7 Å²	125.7	56%	0.556	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-18.4	-173	-77.6	-48.6	0	0	0	115.1	I415 Y417	I415-N419 PolarHBondContact O-ND2 3.19Å; Y417-N419 PolarHBondContact O-N 2.99Å
420	L	29.6	Very low	31	Very low	126 Å²	126	122.3 Å²	122.3	66%	0.66	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-77.7	-22.2	172.2	-103.2	111.9	0	0	0	112.8	I352 R422	I352-L420 WeakPolarHBondContact CD1-O 3.38Å; L420-R422 VanDerWaalsContact C-N 3.3Å; L420-R422 PolarHBondContact O-N 3.32Å
421	L	27.7	Very low	31.3	Very low	89 Å²	89	125.7 Å²	125.7	47%	0.466	60%	0.604	S	S	.	*	G	3₁₀ helix	trans	-77.4	-6.5	-173.3	-81.3	161.1	0	0	0	114.9
422	R	26.4	Very low	31.6	Very low	176 Å²	176	125 Å²	125	66%	0.664	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-106.3	2.5	-174	-83.3	-174.1	169.7	-175.5	-2.6	116.1	L420 N424 T425 I426	L420-R422 VanDerWaalsContact C-N 3.3Å; L420-R422 PolarHBondContact O-N 3.32Å; R422-N424 VanDerWaalsContact C-N 3.35Å; R422-N424 PolarHBondContact O-N 2.91Å; R422-T425 CarbonylContact O-C 3.57Å; R422-T425 PolarHBondContact O-N 3.35Å; R422-T425 PolarHBondContact O-OG1 2.88Å; R422-I426 VanDerWaalsContact O-CG1 3.3Å; R422-I426 WeakPolarHBondContact O-CG1 3.47Å; R422-I426 PolarHBondContact O-N 3.2Å
423	V	32	Very low	31.7	Very low	74 Å²	74	121.1 Å²	121.1	45%	0.448	59%	0.59	S	S	.	*	H	α-helix	trans	-67.6	-29.5	-173.4	-171.7	0	0	0	0	113.9	I352 I426	I352-V423 HydrophobicContact CD1-CB 4.41Å; I352-V423 HydrophobicContact CG2-CB 4.21Å; V423-I426 WeakPolarHBondContact O-CB 3.49Å; V423-I426 PolarHBondContact O-N 2.85Å
424	N	31.8	Very low	31.9	Very low	73 Å²	73	120.6 Å²	120.6	39%	0.39	59%	0.593	S	S	.	*	H	α-helix	trans	-79.7	-27.3	174.1	-79.6	-1	0	0	0	113.5	I351 I352 R422	I351-N424 PolarHBondContact O-ND2 3.2Å; I352-N424 HydrophobicContact CG1-CB 4.5Å; R422-N424 VanDerWaalsContact C-N 3.35Å; R422-N424 PolarHBondContact O-N 2.91Å
425	T	30.5	Very low	32.4	Very low	57 Å²	57	118 Å²	118	35%	0.35	59%	0.585	S	S	.	*	H	α-helix	trans	-75.8	-15.5	166.7	45.2	0	0	0	0	111.4	R422 Q428 N429	R422-T425 CarbonylContact O-C 3.57Å; R422-T425 PolarHBondContact O-N 3.35Å; R422-T425 PolarHBondContact O-OG1 2.88Å; T425-Q428 PolarHBondContact O-N 3.09Å; T425-N429 WeakPolarHBondContact O-CA 3.46Å; T425-N429 WeakPolarHBondContact O-CB 3.28Å; T425-N429 PolarHBondContact O-N 2.91Å; T425-N429 PolarHBondContact O-ND2 3.45Å
426	I	35.2	Very low	33.1	Very low	76 Å²	76	118.1 Å²	118.1	39%	0.39	59%	0.593	S	S	.	*	H	α-helix	trans	-65.2	-41.1	172.5	-73.4	170	0	0	0	110.6	R422 V423 Q428 I430	R422-I426 VanDerWaalsContact O-CG1 3.3Å; R422-I426 WeakPolarHBondContact O-CG1 3.47Å; R422-I426 PolarHBondContact O-N 3.2Å; V423-I426 WeakPolarHBondContact O-CB 3.49Å; V423-I426 PolarHBondContact O-N 2.85Å; I426-Q428 PolarHBondContact O-N 3.01Å; I426-I430 HydrophobicContact CG2-CD1 3.35Å; I426-I430 HydrophobicContact CG2-CG1 3.81Å; I426-I430 WeakPolarHBondContact O-CA 3.28Å; I426-I430 WeakPolarHBondContact O-CB 3.35Å; I426-I430 VanDerWaalsContact O-CD1 3.26Å; I426-I430 WeakPolarHBondContact O-CD1 3.2Å; I426-I430 WeakPolarHBondContact O-CG1 3.38Å; I426-I430 PolarHBondContact O-N 3.18Å
427	E	35.3	Very low	34.3	Very low	143 Å²	143	116.9 Å²	116.9	67%	0.668	59%	0.594	S	S	*	*	H	α-helix	trans	-67	-33.8	177.4	-80.5	-170.6	163.3	0	0	113.9	W431	E427-W431 VanDerWaalsContact O-CD1 3.28Å
428	Q	35.3	Very low	36	Very low	153 Å²	153	112.5 Å²	112.5	72%	0.715	59%	0.589	S	S	*	*	H	α-helix	trans	-86	-32.1	176.3	-75	-171.1	-27.1	0	0	113.6	T425 I426 W431	T425-Q428 PolarHBondContact O-N 3.09Å; I426-Q428 PolarHBondContact O-N 3.01Å; Q428-W431 PolarHBondContact O-N 3.36Å
429	N	30.8	Very low	38	Very low	75 Å²	75	113.3 Å²	113.3	40%	0.401	59%	0.588	S	S	.	*	H	α-helix	trans	-81.8	-18.6	176.3	-62.8	-9.7	0	0	0	112.2	T425 W431 Q432 A433	T425-N429 WeakPolarHBondContact O-CA 3.46Å; T425-N429 WeakPolarHBondContact O-CB 3.28Å; T425-N429 PolarHBondContact O-N 2.91Å; T425-N429 PolarHBondContact O-ND2 3.45Å; N429-W431 PolarHBondContact O-N 3.36Å; N429-Q432 PolarHBondContact O-N 3.27Å; N429-Q432 VanDerWaalsContact O-N 3.07Å; N429-A433 WeakPolarHBondContact O-CB 3.48Å; N429-A433 PolarHBondContact O-N 3.03Å
430	I	35.8	Very low	40.2	Very low	110 Å²	110	108.5 Å²	108.5	56%	0.564	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-30.7	169.2	-82.1	164.1	0	0	0	110.1	I426	I426-I430 HydrophobicContact CG2-CD1 3.35Å; I426-I430 HydrophobicContact CG2-CG1 3.81Å; I426-I430 WeakPolarHBondContact O-CA 3.28Å; I426-I430 WeakPolarHBondContact O-CB 3.35Å; I426-I430 VanDerWaalsContact O-CD1 3.26Å; I426-I430 WeakPolarHBondContact O-CD1 3.2Å; I426-I430 WeakPolarHBondContact O-CG1 3.38Å; I426-I430 PolarHBondContact O-N 3.18Å
431	W	35.7	Very low	42.6	Very low	223 Å²	223	107.9 Å²	107.9	85%	0.845	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-14.9	176.7	-66.5	96.5	0	0	0	114.4	E427 Q428 N429	E427-W431 VanDerWaalsContact O-CD1 3.28Å; Q428-W431 PolarHBondContact O-N 3.36Å; N429-W431 PolarHBondContact O-N 3.36Å
432	Q	34.2	Very low	45.2	Very low	159 Å²	159	112.4 Å²	112.4	74%	0.743	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	-15.1	179.9	-73.4	-170.7	-10.3	0	0	114.2	N429 N434	N429-Q432 PolarHBondContact O-N 3.27Å; N429-Q432 VanDerWaalsContact O-N 3.07Å; Q432-N434 PolarHBondContact O-N 3.29Å
433	A	35.9	Very low	48	Very low	60 Å²	60	104.1 Å²	104.1	50%	0.496	54%	0.544	S	S	.	.			trans	-74	94.2	168.7	0	0	0	0	0	108.3	N429 D435	N429-A433 WeakPolarHBondContact O-CB 3.48Å; N429-A433 PolarHBondContact O-N 3.03Å; A433-D435 HydrophobicContact CB-CB 4.43Å; A433-D435 PolarHBondContact O-N 2.76Å
434	N	37.1	Very low	50.6	Low	167 Å²	167	105.9 Å²	105.9	89%	0.893	54%	0.543	S	S	*	.			trans	-67.2	41.3	160.3	-78	-24.6	0	0	0	111.3	Q432	Q432-N434 PolarHBondContact O-N 3.29Å
435	D	41	Very low	53.1	Low	115 Å²	115	106.6 Å²	106.6	62%	0.615	55%	0.553	S	S	*	*			trans	-105.2	110.2	176.6	-143.3	-12.7	0	0	0	107.3	A433 D437	A433-D435 HydrophobicContact CB-CB 4.43Å; A433-D435 PolarHBondContact O-N 2.76Å; D435-D437 VanDerWaalsContact C-N 3.28Å; D435-D437 PolarHBondContact O-N 2.97Å
436	P	46.1	Very low	55.9	Low	113 Å²	113	106.3 Å²	106.3	73%	0.734	55%	0.55	S	S	*	*			trans	-78.1	-0.6	-158	29.8	-34.5	0	0	0	115.3	C438	P436-C438 PolarHBondContact O-N 3.4Å
437	D	53.6	Low	58.5	Low	140 Å²	140	107 Å²	107	75%	0.749	56%	0.56	S	S	*	*			trans	-94.4	88.8	179	-75	-15.5	0	0	0	110.8	D435 C439	D435-D437 VanDerWaalsContact C-N 3.28Å; D435-D437 PolarHBondContact O-N 2.97Å; D437-C439 PolarHBondContact O-N 3.36Å
438	C	65.1	Low	61.1	Low	91 Å²	91	100.9 Å²	100.9	62%	0.615	53%	0.532	S	S	*	.			trans	-54	88.7	163.3	-74.8	0	0	0	0	109.8	P436 G440 I441	P436-C438 PolarHBondContact O-N 3.4Å; C438-G440 PolarHBondContact O-N 3.04Å; C438-I441 HydrophobicContact CB-CD1 3.38Å; C438-I441 HydrophobicContact CB-CG1 3.72Å; C438-I441 WeakPolarHBondContact O-CG1 3.25Å; C438-I441 PolarHBondContact O-N 3.31Å
439	C	71.2	Confident	63.7	Low	56 Å²	56	93.6 Å²	93.6	38%	0.378	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	131.8	-178.7	67.1	0	0	0	0	109.5	C378 D437	C378-C439 HydrophobicContact CB-CB 3.84Å; C378-C439 WeakPolarHBondContact CB-SG 3.38Å; C378-C439 VanDerWaalsContact SG-C 3.56Å; C378-C439 WeakPolarHBondContact SG-CB 3.44Å; C378-C439 PolarHBondContact SG-O 2.98Å; C378-C439 VanDerWaalsContact SG-O 3.38Å; C378-C439 CovalentContact SG-SG 2.04Å; C378-C439 PolarHBondContact SG-SG 3.01Å; D437-C439 PolarHBondContact O-N 3.36Å
440	G	74.7	Confident	66.5	Low	2 Å²	2	95.1 Å²	95.1	2%	0.021	51%	0.506	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.5	1.7	179.9	0	0	0	0	0	116.6	S377 C438 K442 C443 Y444	S377-G440 WeakPolarHBondContact OG-CA 3.41Å; S377-G440 PolarHBondContact OG-N 3.1Å; C438-G440 PolarHBondContact O-N 3.04Å; G440-K442 PolarHBondContact O-N 3.46Å; G440-C443 WeakPolarHBondContact O-CA 3.28Å; G440-C443 VanDerWaalsContact O-CB 3.28Å; G440-C443 WeakPolarHBondContact O-CB 3.45Å; G440-C443 PolarHBondContact O-N 3.17Å; G440-Y444 WeakPolarHBondContact O-CD2 3.48Å
441	I	79.7	Confident	69.1	Low	113 Å²	113	93.4 Å²	93.4	58%	0.579	50%	0.498	S	S	*	.	H	α-helix	trans	-50.2	-43.7	172.6	-71.9	169.7	0	0	0	111.1	C438 C443 Y444	C438-I441 HydrophobicContact CB-CD1 3.38Å; C438-I441 HydrophobicContact CB-CG1 3.72Å; C438-I441 WeakPolarHBondContact O-CG1 3.25Å; C438-I441 PolarHBondContact O-N 3.31Å; I441-C443 PolarHBondContact O-N 3.38Å; I441-C443 VanDerWaalsContact O-N 3.15Å; I441-Y444 WeakPolarHBondContact O-CB 3.42Å; I441-Y444 PolarHBondContact O-N 3.24Å
442	K	81.7	Confident	71.5	Confident	184 Å²	184	83.6 Å²	83.6	80%	0.8	46%	0.461	S	S	*	.	H	α-helix	trans	-61.6	-21.9	178.3	-63.2	-179.1	-177.8	175.7	0	113.7	G440 S445	G440-K442 PolarHBondContact O-N 3.46Å; K442-S445 PolarHBondContact O-OG 3.37Å
443	C	86.4	Confident	74	Confident	3 Å²	3	78.7 Å²	78.7	2%	0.02	44%	0.437	C	S	.	.	H	α-helix	trans	-75.9	-27.1	175.5	-66.4	0	0	0	0	112	C373 L374 G440 I441 S445 N446 C449	C373-C443 HydrophobicContact CB-CB 3.81Å; C373-C443 WeakPolarHBondContact CB-SG 3Å; C373-C443 PolarHBondContact O-SG 2.88Å; C373-C443 VanDerWaalsContact SG-CA 3.57Å; C373-C443 WeakPolarHBondContact SG-CB 3.43Å; C373-C443 CovalentContact SG-SG 2.05Å; C373-C443 PolarHBondContact SG-SG 3.37Å; L374-C443 HydrophobicContact CD2-CB 3.74Å; L374-C443 HydrophobicContact CG-CB 4.09Å; L374-C443 PolarHBondContact N-SG 3.28Å; G440-C443 WeakPolarHBondContact O-CA 3.28Å; G440-C443 VanDerWaalsContact O-CB 3.28Å; G440-C443 WeakPolarHBondContact O-CB 3.45Å; G440-C443 PolarHBondContact O-N 3.17Å; I441-C443 PolarHBondContact O-N 3.38Å; I441-C443 VanDerWaalsContact O-N 3.15Å; C443-S445 PolarHBondContact O-N 3.1Å; C443-N446 WeakPolarHBondContact O-CB 3.33Å; C443-N446 PolarHBondContact O-N 3.5Å; C443-C449 WeakPolarHBondContact O-CB 3.28Å; C443-C449 PolarHBondContact O-SG 3.1Å
444	Y	84.9	Confident	76.4	Confident	110 Å²	110	76.9 Å²	76.9	43%	0.431	43%	0.425	S	S	.	.	H	α-helix	trans	-67.2	-22	-179.6	-75.8	-87.3	0	0	0	113.3	L374 G440 I441 N446 L450 F453	L374-Y444 HydrophobicContact CD2-CD2 4.34Å; L374-Y444 HydrophobicContact CD2-CE2 3.89Å; G440-Y444 WeakPolarHBondContact O-CD2 3.48Å; I441-Y444 WeakPolarHBondContact O-CB 3.42Å; I441-Y444 PolarHBondContact O-N 3.24Å; Y444-N446 VanDerWaalsContact C-N 3.33Å; Y444-L450 WeakPolarHBondContact O-CD2 3.32Å; Y444-F453 AromaticContact CD1-CD2 3.82Å; Y444-F453 HydrophobicContact CD1-CD2 3.82Å; Y444-F453 AromaticContact CD1-CE2 3.6Å; Y444-F453 HydrophobicContact CD1-CE2 3.6Å; Y444-F453 HydrophobicContact CD1-CZ 4.49Å; Y444-F453 AromaticContact CE1-CD2 3.82Å; Y444-F453 HydrophobicContact CE1-CD2 3.82Å; Y444-F453 AromaticContact CE1-CE2 3.28Å; Y444-F453 HydrophobicContact CE1-CE2 3.28Å; Y444-F453 AromaticContact CE1-CZ 3.74Å; Y444-F453 HydrophobicContact CE1-CZ 3.74Å
445	S	85.3	Confident	78.6	Confident	88 Å²	88	73.6 Å²	73.6	62%	0.615	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-4.6	171.4	57.4	0	0	0	0	113.8	K442 C443	K442-S445 PolarHBondContact O-OG 3.37Å; C443-S445 PolarHBondContact O-N 3.1Å
446	N	88.3	Confident	80.6	Confident	52 Å²	52	75.2 Å²	75.2	28%	0.278	41%	0.412	S	S	.	.	S	Bend	trans	-67.4	132	173.8	-174.3	-45.2	0	0	0	109.5	C443 Y444 S448 C449 L450	C443-N446 WeakPolarHBondContact O-CB 3.33Å; C443-N446 PolarHBondContact O-N 3.5Å; Y444-N446 VanDerWaalsContact C-N 3.33Å; N446-S448 PolarHBondContact O-N 2.87Å; N446-S448 VanDerWaalsContact O-N 3.1Å; N446-S448 PolarHBondContact OD1-N 3.16Å; N446-C449 HydrophobicContact CB-CB 4.43Å; N446-C449 WeakPolarHBondContact O-CA 3.44Å; N446-C449 PolarHBondContact O-N 3.05Å; N446-L450 PolarHBondContact O-N 2.75Å
447	P	90	Very high	82.5	Confident	91 Å²	91	69.9 Å²	69.9	59%	0.591	38%	0.378	S	S	*	.	H	α-helix	trans	-48.7	-39.1	177.7	-29.5	35	0	0	0	113.9	C449 L450 D451	P447-C449 PolarHBondContact O-N 3.3Å; P447-L450 PolarHBondContact O-N 2.97Å; P447-D451 PolarHBondContact O-N 3.11Å
448	S	91.2	Very high	83.8	Confident	14 Å²	14	66.8 Å²	66.8	10%	0.098	36%	0.358	C	S	.	.	H	α-helix	trans	-66.7	-35.1	177.3	-64.8	0	0	0	0	113.5	Q366 I369 N446 Y452	Q366-S448 PolarHBondContact OE1-OG 3.23Å; I369-S448 WeakPolarHBondContact CG2-OG 3.26Å; N446-S448 PolarHBondContact O-N 2.87Å; N446-S448 VanDerWaalsContact O-N 3.1Å; N446-S448 PolarHBondContact OD1-N 3.16Å; S448-Y452 VanDerWaalsContact O-CB 3.27Å; S448-Y452 WeakPolarHBondContact O-CB 3.34Å; S448-Y452 PolarHBondContact O-N 3.02Å
449	C	90.1	Very high	84.4	Confident	0 Å²	0	65 Å²	65	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-73.2	-38.8	173.6	-75.1	0	0	0	0	111.4	C370 C443 N446 P447 D451 Y452 F453	C370-C449 WeakPolarHBondContact CA-SG 3.38Å; C370-C449 HydrophobicContact CB-CB 3.94Å; C370-C449 WeakPolarHBondContact CB-SG 3.44Å; C370-C449 WeakPolarHBondContact SG-CA 3.34Å; C370-C449 WeakPolarHBondContact SG-CB 3.3Å; C370-C449 CovalentContact SG-SG 2.04Å; C370-C449 PolarHBondContact SG-SG 2.67Å; C443-C449 WeakPolarHBondContact O-CB 3.28Å; C443-C449 PolarHBondContact O-SG 3.1Å; N446-C449 HydrophobicContact CB-CB 4.43Å; N446-C449 WeakPolarHBondContact O-CA 3.44Å; N446-C449 PolarHBondContact O-N 3.05Å; P447-C449 PolarHBondContact O-N 3.3Å; C449-D451 VanDerWaalsContact C-N 3.34Å; C449-D451 PolarHBondContact O-N 3.44Å; C449-Y452 PolarHBondContact O-N 2.97Å; C449-F453 HydrophobicContact CB-CD2 4.19Å; C449-F453 HydrophobicContact CB-CE2 4.22Å; C449-F453 WeakPolarHBondContact O-CB 3.35Å; C449-F453 WeakPolarHBondContact O-CD2 3.48Å; C449-F453 PolarHBondContact O-N 2.8Å
450	L	89.1	Confident	84.5	Confident	106 Å²	106	66.3 Å²	66.3	56%	0.555	34%	0.343	S	S	*	.	H	α-helix	trans	-60.1	-43.8	174.8	-68.6	173.5	0	0	0	111.5	Y444 N446 P447 G454	Y444-L450 WeakPolarHBondContact O-CD2 3.32Å; N446-L450 PolarHBondContact O-N 2.75Å; P447-L450 PolarHBondContact O-N 2.97Å; L450-G454 WeakPolarHBondContact O-CA 3.35Å; L450-G454 PolarHBondContact O-N 2.88Å
451	D	89.1	Confident	84.4	Confident	74 Å²	74	66.4 Å²	66.4	40%	0.396	34%	0.342	S	S	.	.	H	α-helix	trans	-66.6	-45.5	175.9	-80.8	-11.1	0	0	0	111.9	H362 Q366 P447 C449 F453 G454 C457	H362-D451 IonicContact NE2-OD2 3.31Å; Q366-D451 HydrophobicContact CB-CB 4.29Å; Q366-D451 HydrophobicContact CG-CB 3.88Å; P447-D451 PolarHBondContact O-N 3.11Å; C449-D451 VanDerWaalsContact C-N 3.34Å; C449-D451 PolarHBondContact O-N 3.44Å; D451-F453 PolarHBondContact O-N 3.36Å; D451-G454 PolarHBondContact O-N 2.61Å; D451-G454 VanDerWaalsContact O-N 3.1Å; D451-C457 VanDerWaalsContact O-CB 3.32Å; D451-C457 WeakPolarHBondContact O-CB 3.31Å; D451-C457 PolarHBondContact O-SG 3.35Å; D451-C457 VanDerWaalsContact O-SG 3.41Å
452	Y	87.7	Confident	84	Confident	18 Å²	18	63.5 Å²	63.5	7%	0.071	33%	0.333	C	S	.	.	H	α-helix	trans	-61.6	-42.7	179.6	170.2	-122.9	0	0	0	112.6	L358 R367 C370 S448 C449 G454 C457 T461	L358-Y452 HydrophobicContact CD1-CD2 4.03Å; L358-Y452 HydrophobicContact CD1-CE2 3.87Å; R367-Y452 HydrophobicContact CB-CD2 3.52Å; R367-Y452 HydrophobicContact CB-CE2 3.67Å; R367-Y452 HydrophobicContact CB-CG 4.05Å; R367-Y452 HydrophobicContact CG-CD2 3.93Å; R367-Y452 HydrophobicContact CG-CE1 4.26Å; R367-Y452 HydrophobicContact CG-CE2 3.54Å; R367-Y452 HydrophobicContact CG-CG 4.45Å; C370-Y452 HydrophobicContact CB-CD1 4.29Å; S448-Y452 VanDerWaalsContact O-CB 3.27Å; S448-Y452 WeakPolarHBondContact O-CB 3.34Å; S448-Y452 PolarHBondContact O-N 3.02Å; C449-Y452 PolarHBondContact O-N 2.97Å; Y452-G454 VanDerWaalsContact C-N 3.29Å; Y452-C457 WeakPolarHBondContact O-CB 3.47Å; Y452-T461 HydrophobicContact CD2-CG2 4.43Å; Y452-T461 HydrophobicContact CE2-CG2 3.6Å
453	F	85.7	Confident	83.4	Confident	55 Å²	55	61.9 Å²	61.9	24%	0.241	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-1.5	175.6	-63	-56.7	0	0	0	113.2	Y444 C449 D451 R463	Y444-F453 AromaticContact CD1-CD2 3.82Å; Y444-F453 HydrophobicContact CD1-CD2 3.82Å; Y444-F453 AromaticContact CD1-CE2 3.6Å; Y444-F453 HydrophobicContact CD1-CE2 3.6Å; Y444-F453 HydrophobicContact CD1-CZ 4.49Å; Y444-F453 AromaticContact CE1-CD2 3.82Å; Y444-F453 HydrophobicContact CE1-CD2 3.82Å; Y444-F453 AromaticContact CE1-CE2 3.28Å; Y444-F453 HydrophobicContact CE1-CE2 3.28Å; Y444-F453 AromaticContact CE1-CZ 3.74Å; Y444-F453 HydrophobicContact CE1-CZ 3.74Å; C449-F453 HydrophobicContact CB-CD2 4.19Å; C449-F453 HydrophobicContact CB-CE2 4.22Å; C449-F453 WeakPolarHBondContact O-CB 3.35Å; C449-F453 WeakPolarHBondContact O-CD2 3.48Å; C449-F453 PolarHBondContact O-N 2.8Å; D451-F453 PolarHBondContact O-N 3.36Å; F453-R463 VanDerWaalsContact CD1-NH1 3.25Å
454	G	86.2	Confident	82.7	Confident	23 Å²	23	63.8 Å²	63.8	24%	0.237	33%	0.33	C	S	.	.	S	Bend	trans	-75.1	157.6	176.3	0	0	0	0	0	112	L450 D451 Y452 R456 C457 E458	L450-G454 WeakPolarHBondContact O-CA 3.35Å; L450-G454 PolarHBondContact O-N 2.88Å; D451-G454 PolarHBondContact O-N 2.61Å; D451-G454 VanDerWaalsContact O-N 3.1Å; Y452-G454 VanDerWaalsContact C-N 3.29Å; G454-R456 PolarHBondContact O-N 2.92Å; G454-C457 PolarHBondContact O-N 2.95Å; G454-E458 WeakPolarHBondContact O-CB 3.33Å; G454-E458 PolarHBondContact O-N 3.04Å
455	S	83.8	Confident	81.9	Confident	98 Å²	98	61.9 Å²	61.9	69%	0.685	33%	0.332	S	S	*	.	H	α-helix	trans	-53.2	-33.7	-176.3	58.1	0	0	0	0	113.7	T459	S455-T459 WeakPolarHBondContact O-CG2 3.48Å
456	R	83.9	Confident	81.2	Confident	149 Å²	149	63.5 Å²	63.5	56%	0.562	33%	0.334	S	S	*	.	H	α-helix	trans	-58.9	-51.7	176.3	-178.7	-179.4	176.5	-180	0.3	111.8	G454 T459	G454-R456 PolarHBondContact O-N 2.92Å; R456-T459 PolarHBondContact O-OG1 3.18Å
457	C	84.4	Confident	80.4	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.007	33%	0.325	C	S	.	.	H	α-helix	trans	-87.5	-28.3	-174.2	-66	0	0	0	0	113.1	C363 D451 Y452 G454 T459 Y460 T461	C363-C457 WeakPolarHBondContact CA-SG 3.39Å; C363-C457 HydrophobicContact CB-CB 3.56Å; C363-C457 WeakPolarHBondContact CB-SG 3.42Å; C363-C457 WeakPolarHBondContact SG-CA 3.42Å; C363-C457 WeakPolarHBondContact SG-CB 3.34Å; C363-C457 CovalentContact SG-SG 2.04Å; C363-C457 PolarHBondContact SG-SG 3.03Å; D451-C457 VanDerWaalsContact O-CB 3.32Å; D451-C457 WeakPolarHBondContact O-CB 3.31Å; D451-C457 PolarHBondContact O-SG 3.35Å; D451-C457 VanDerWaalsContact O-SG 3.41Å; Y452-C457 WeakPolarHBondContact O-CB 3.47Å; G454-C457 PolarHBondContact O-N 2.95Å; C457-T459 PolarHBondContact O-N 3.3Å; C457-Y460 PolarHBondContact O-N 2.7Å; C457-T461 WeakPolarHBondContact O-CG2 3.32Å
458	E	81.8	Confident	79.8	Confident	74 Å²	74	62.1 Å²	62.1	35%	0.346	33%	0.327	S	S	.	.	H	α-helix	trans	-52.4	-40.1	176.7	-171.4	179.2	-166.7	0	0	111.5	G454 Y460 T461 H464	G454-E458 WeakPolarHBondContact O-CB 3.33Å; G454-E458 PolarHBondContact O-N 3.04Å; E458-Y460 PolarHBondContact O-N 3.43Å; E458-T461 WeakPolarHBondContact O-CB 3.47Å; E458-T461 PolarHBondContact O-N 3.4Å; E458-T461 PolarHBondContact O-OG1 2.05Å; E458-H464 HydrophobicContact CG-CB 4.43Å; E458-H464 VanDerWaalsContact O-CB 3.26Å; E458-H464 WeakPolarHBondContact O-CB 3.28Å
459	T	76.7	Confident	79.3	Confident	54 Å²	54	65.5 Å²	65.5	33%	0.331	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-24.5	178.8	58.9	0	0	0	0	115	S455 R456 C457	S455-T459 WeakPolarHBondContact O-CG2 3.48Å; R456-T459 PolarHBondContact O-OG1 3.18Å; C457-T459 PolarHBondContact O-N 3.3Å
460	Y	73	Confident	78.8	Confident	84 Å²	84	66 Å²	66	33%	0.329	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-5.6	178.6	-55.3	-68.7	0	0	0	113.5	Q355 L358 K359 D360 C363 C457 E458	Q355-Y460 PolarHBondContact NE2-O 3.13Å; L358-Y460 WeakPolarHBondContact CD2-O 3.41Å; K359-Y460 HydrophobicContact CB-CD1 3.75Å; K359-Y460 HydrophobicContact CB-CE1 4.18Å; K359-Y460 HydrophobicContact CD-CE1 4.47Å; D360-Y460 HydrophobicContact CB-CD2 3.77Å; D360-Y460 HydrophobicContact CB-CE1 4.41Å; D360-Y460 HydrophobicContact CB-CE2 3.48Å; D360-Y460 VanDerWaalsContact CB-CE2 3.48Å; D360-Y460 HydrophobicContact CB-CG 4.35Å; C363-Y460 HydrophobicContact CB-CD2 4.46Å; C457-Y460 PolarHBondContact O-N 2.7Å; E458-Y460 PolarHBondContact O-N 3.43Å
461	T	74.5	Confident	78.5	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.018	32%	0.322	C	S	.	.	S	Bend	trans	-89.3	160.9	-178.9	72.1	0	0	0	0	111.7	L358 Y452 C457 E458 R463 H464	L358-T461 HydrophobicContact CD1-CG2 4.39Å; L358-T461 HydrophobicContact CD2-CG2 4.17Å; Y452-T461 HydrophobicContact CD2-CG2 4.43Å; Y452-T461 HydrophobicContact CE2-CG2 3.6Å; C457-T461 WeakPolarHBondContact O-CG2 3.32Å; E458-T461 WeakPolarHBondContact O-CB 3.47Å; E458-T461 PolarHBondContact O-N 3.4Å; E458-T461 PolarHBondContact O-OG1 2.05Å; T461-R463 PolarHBondContact O-N 3.27Å; T461-R463 VanDerWaalsContact O-N 3.08Å; T461-R463 PolarHBondContact OG1-N 2.79Å; T461-H464 PolarHBondContact O-N 3.08Å
462	S	70.6	Confident	78.3	Confident	53 Å²	53	58.8 Å²	58.8	37%	0.371	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-15.5	171.6	58.9	0	0	0	0	114.2	Y302 Q355	Y302-S462 WeakPolarHBondContact CE2-O 3.3Å; Y302-S462 PolarHBondContact OH-O 3.2Å; Q355-S462 VanDerWaalsContact OE1-N 3.13Å
463	R	68.9	Low	78.2	Confident	150 Å²	150	60.2 Å²	60.2	57%	0.566	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-21.3	-177.2	-59.9	-178.2	178.7	-178.4	0	113.4	F453 T461	F453-R463 VanDerWaalsContact CD1-NH1 3.25Å; T461-R463 PolarHBondContact O-N 3.27Å; T461-R463 VanDerWaalsContact O-N 3.08Å; T461-R463 PolarHBondContact OG1-N 2.79Å
464	H	71.4	Confident	78.3	Confident	43 Å²	43	57.8 Å²	57.8	20%	0.199	31%	0.305	C	S	.	.	S	Bend	trans	-80.4	135.4	-176.7	-166.2	64.9	0	0	0	112.2	E458 T461 N466 A467	E458-H464 HydrophobicContact CG-CB 4.43Å; E458-H464 VanDerWaalsContact O-CB 3.26Å; E458-H464 WeakPolarHBondContact O-CB 3.28Å; T461-H464 PolarHBondContact O-N 3.08Å; H464-N466 VanDerWaalsContact C-N 3.25Å; H464-N466 PolarHBondContact O-N 2.83Å; H464-A467 HydrophobicContact CB-CB 4.5Å; H464-A467 PolarHBondContact O-N 2.97Å
465	S	69	Low	78.4	Confident	69 Å²	69	59.8 Å²	59.8	48%	0.483	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-28.4	-175.7	52.2	0	0	0	0	114
466	N	70.8	Confident	78.8	Confident	122 Å²	122	55.1 Å²	55.1	65%	0.652	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-3.7	-177.1	-63.5	-25	0	0	0	114.2	H464 T468	H464-N466 VanDerWaalsContact C-N 3.25Å; H464-N466 PolarHBondContact O-N 2.83Å; N466-T468 PolarHBondContact O-N 3.4Å
467	A	71.3	Confident	79.3	Confident	11 Å²	11	48 Å²	48	9%	0.091	25%	0.248	C	C	.	.			trans	-72.5	95.6	178.8	0	0	0	0	0	110.1	R278 Y302 H464 I470	R278-A467 WeakPolarHBondContact CD-O 3.25Å; Y302-A467 WeakPolarHBondContact CE1-O 3.42Å; Y302-A467 PolarHBondContact OH-O 3.07Å; H464-A467 HydrophobicContact CB-CB 4.5Å; H464-A467 PolarHBondContact O-N 2.97Å; A467-I470 HydrophobicContact CB-CG2 4.07Å
468	T	77.1	Confident	79.8	Confident	103 Å²	103	49.2 Å²	49.2	63%	0.632	25%	0.252	S	S	*	.			trans	-77.3	-30.9	-179.3	54.5	0	0	0	0	112.9	R278 N466	R278-T468 PolarHBondContact N-O 2.89Å; N466-T468 PolarHBondContact O-N 3.4Å
469	E	79.8	Confident	80.5	Confident	86 Å²	86	45.7 Å²	45.7	40%	0.402	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	129.9	-178.2	-175.4	166	-134.8	0	0	110	T275 A276	T275-E469 VanDerWaalsContact CB-OE1 3.29Å; T275-E469 WeakPolarHBondContact CB-OE1 3.42Å; T275-E469 HydrophobicContact CG2-CG 4.2Å; T275-E469 WeakPolarHBondContact CG2-OE1 3.42Å; A276-E469 WeakPolarHBondContact O-CA 3.22Å
470	I	80.4	Confident	81.4	Confident	11 Å²	11	44 Å²	44	6%	0.056	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	168.9	178.6	63.3	174.1	0	0	0	110.1	T275 A276 Y302 A467 L472	T275-I470 CarbonylContact C-O 3.31Å; T275-I470 WeakPolarHBondContact CA-O 3.35Å; A276-I470 HydrophobicContact CB-CG1 4.13Å; A276-I470 PolarHBondContact N-O 2.91Å; A276-I470 PolarHBondContact O-N 3.2Å; Y302-I470 HydrophobicContact CD1-CD1 3.54Å; Y302-I470 HydrophobicContact CD1-CG1 3.58Å; Y302-I470 HydrophobicContact CD2-CD1 3.81Å; Y302-I470 HydrophobicContact CE1-CB 4.49Å; Y302-I470 HydrophobicContact CE1-CD1 3.72Å; Y302-I470 HydrophobicContact CE1-CG1 3.8Å; Y302-I470 HydrophobicContact CE1-CG2 3.98Å; Y302-I470 HydrophobicContact CE2-CD1 3.99Å; Y302-I470 HydrophobicContact CG-CD1 3.58Å; Y302-I470 HydrophobicContact CG-CG1 4.08Å; A467-I470 HydrophobicContact CB-CG2 4.07Å; I470-L472 HydrophobicContact CD1-CD1 4.49Å; I470-L472 HydrophobicContact CD1-CD2 3.61Å; I470-L472 HydrophobicContact CD1-CG 4.04Å; I470-L472 HydrophobicContact CG1-CD2 4.18Å; I470-L472 HydrophobicContact CG1-CG 4.17Å
471	C	82.9	Confident	82.5	Confident	13 Å²	13	40 Å²	40	9%	0.088	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	121.2	173.9	-79.9	0	0	0	0	111.3	C310 Q355 S356 Y357	C310-C471 VanDerWaalsContact CA-SG 3.53Å; C310-C471 HydrophobicContact CB-CB 4.13Å; C310-C471 WeakPolarHBondContact CB-SG 3.44Å; C310-C471 VanDerWaalsContact SG-CA 3.51Å; C310-C471 WeakPolarHBondContact SG-CB 3.17Å; C310-C471 CovalentContact SG-SG 2.03Å; C310-C471 PolarHBondContact SG-SG 2.9Å; Q355-C471 CarbonylContact C-O 3.5Å; Q355-C471 WeakPolarHBondContact CG-O 3.3Å; S356-C471 PolarHBondContact N-O 3.07Å; Y357-C471 HydrophobicContact CD2-CB 4.31Å; Y357-C471 HydrophobicContact CE1-CB 4.45Å; Y357-C471 HydrophobicContact CE2-CB 4.07Å
472	L	85.3	Confident	83.5	Confident	14 Å²	14	41.8 Å²	41.8	7%	0.073	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	143.5	178.5	-67.9	-170.9	0	0	0	110.1	H273 T274 A276 R304 S354 Q355 I470	H273-L472 WeakPolarHBondContact CA-O 3.26Å; T274-L472 PolarHBondContact N-O 3.24Å; T274-L472 PolarHBondContact O-N 3.21Å; A276-L472 HydrophobicContact CB-CB 4.25Å; A276-L472 HydrophobicContact CB-CD1 3.39Å; A276-L472 HydrophobicContact CB-CG 3.6Å; R304-L472 HydrophobicContact CB-CD1 4.34Å; R304-L472 HydrophobicContact CG-CB 4.22Å; S354-L472 CarbonylContact O-C 3.55Å; S354-L472 WeakPolarHBondContact O-CA 3.44Å; Q355-L472 HydrophobicContact CB-CD2 4.32Å; I470-L472 HydrophobicContact CD1-CD1 4.49Å; I470-L472 HydrophobicContact CD1-CD2 3.61Å; I470-L472 HydrophobicContact CD1-CG 4.04Å; I470-L472 HydrophobicContact CG1-CD2 4.18Å; I470-L472 HydrophobicContact CG1-CG 4.17Å
473	Q	85	Confident	84.6	Confident	48 Å²	48	39.3 Å²	39.3	22%	0.224	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	129.2	171.1	177.7	-179.3	-11.9	0	0	108.1	D271 R272 H273 E353 S354	D271-Q473 HydrophobicContact CB-CG 4.42Å; D271-Q473 PolarHBondContact OD1-NE2 3.03Å; R272-Q473 WeakPolarHBondContact O-CA 3.48Å; H273-Q473 PolarHBondContact CE1-OE1 3.49Å; E353-Q473 WeakPolarHBondContact CA-O 3.37Å; S354-Q473 PolarHBondContact N-O 2.64Å; S354-Q473 PolarHBondContact O-N 2.81Å
474	G	86.8	Confident	85.9	Confident	4 Å²	4	34.5 Å²	34.5	4%	0.041	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	173	177.8	0	0	0	0	0	112.8	R272	R272-G474 PolarHBondContact N-O 3.48Å; R272-G474 PolarHBondContact O-N 2.91Å; R272-G474 VanDerWaalsContact O-N 3.1Å
475	K	89.6	Confident	86.9	Confident	65 Å²	65	32.8 Å²	32.8	28%	0.283	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	141.1	174.4	-59.5	-175.5	-175.4	179	0	110	Y269 L270 R304	Y269-K475 CarbonylContact O-C 3.55Å; Y269-K475 WeakPolarHBondContact O-CA 3.48Å; L270-K475 HydrophobicContact CD2-CD 3.72Å; L270-K475 HydrophobicContact CD2-CG 3.79Å; R304-K475 PolarHBondContact NH2-O 3.19Å
476	T	92	Very high	88	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	119.4	168.8	-51.5	0	0	0	0	108.2	Y269 R272 R304 L327 Y335 C336 T337	Y269-T476 PolarHBondContact N-O 3.33Å; Y269-T476 PolarHBondContact O-N 3.32Å; R272-T476 WeakPolarHBondContact CD-OG1 3.37Å; R304-T476 PolarHBondContact NH1-OG1 3.47Å; L327-T476 HydrophobicContact CD1-CG2 4.23Å; Y335-T476 HydrophobicContact CD1-CG2 4.38Å; C336-T476 WeakPolarHBondContact O-CA 3.32Å; T337-T476 HydrophobicContact CG2-CG2 4.04Å
477	L	94.1	Very high	89	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	126.6	-175.4	-56.2	-179.4	0	0	0	109.6	M266 P268 Y335 C336 V343 E349 I351 F479	M266-L477 HydrophobicContact CE-CD2 4.4Å; M266-L477 HydrophobicContact CG-CB 4.16Å; M266-L477 HydrophobicContact CG-CD1 4.47Å; M266-L477 HydrophobicContact CG-CD2 4.41Å; M266-L477 HydrophobicContact SD-CD1 3.9Å; M266-L477 HydrophobicContact SD-CD2 4.08Å; M266-L477 HydrophobicContact SD-CG 4.42Å; P268-L477 HydrophobicContact CB-CD2 3.75Å; Y335-L477 CarbonylContact C-O 3.56Å; Y335-L477 VanDerWaalsContact CA-O 3.28Å; Y335-L477 WeakPolarHBondContact CA-O 3.48Å; C336-L477 PolarHBondContact N-O 3.36Å; C336-L477 PolarHBondContact O-N 3.48Å; V343-L477 HydrophobicContact CB-CD1 4.45Å; V343-L477 HydrophobicContact CG1-CD1 3.62Å; V343-L477 HydrophobicContact CG2-CD1 4.06Å; E349-L477 HydrophobicContact CB-CD1 4.3Å; I351-L477 HydrophobicContact CD1-CD1 3.84Å; I351-L477 HydrophobicContact CD1-CG 4Å; I351-L477 HydrophobicContact CG1-CD1 3.86Å; I351-L477 HydrophobicContact CG1-CG 4.14Å; L477-F479 HydrophobicContact CB-CE2 3.86Å; L477-F479 HydrophobicContact CB-CZ 4.14Å; L477-F479 HydrophobicContact CD1-CZ 4.27Å
478	K	95.3	Very high	89.6	Confident	25 Å²	25	30.8 Å²	30.8	11%	0.109	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	122.8	173.2	-179	-172.3	-179	-172.3	0	109.6	M266 H267 Y269 S333 F334 Y335 T480	M266-K478 CarbonylContact C-O 3.6Å; M266-K478 VanDerWaalsContact CA-O 3.28Å; M266-K478 WeakPolarHBondContact CA-O 2.99Å; H267-K478 HydrophobicContact CB-CB 4.39Å; H267-K478 PolarHBondContact N-O 2.93Å; H267-K478 PolarHBondContact O-N 3.4Å; Y269-K478 HydrophobicContact CD2-CB 4.47Å; Y269-K478 HydrophobicContact CE2-CB 3.91Å; Y269-K478 HydrophobicContact CE2-CD 4.26Å; S333-K478 WeakPolarHBondContact OG-CE 3.4Å; F334-K478 WeakPolarHBondContact O-CA 3.46Å; Y335-K478 HydrophobicContact CD1-CB 3.68Å; Y335-K478 HydrophobicContact CD1-CG 3.94Å; Y335-K478 HydrophobicContact CE1-CB 3.6Å; Y335-K478 HydrophobicContact CE1-CD 3.76Å; Y335-K478 HydrophobicContact CE1-CG 3.52Å; K478-T480 WeakPolarHBondContact CE-OG1 3.26Å
479	F	96.6	Very high	89.9	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	116.3	175.3	-67.5	-79	0	0	0	110.2	L264 A265 M266 S333 F334 C336 L342 V343 F347 L477 W638	L264-F479 HydrophobicContact CD1-CB 4.32Å; A265-F479 CarbonylContact O-C 3.5Å; A265-F479 VanDerWaalsContact O-CA 3.3Å; A265-F479 WeakPolarHBondContact O-CA 3.01Å; M266-F479 HydrophobicContact CB-CD1 3.96Å; M266-F479 HydrophobicContact CB-CE1 3.69Å; M266-F479 HydrophobicContact CG-CD1 4.13Å; M266-F479 HydrophobicContact CG-CE1 3.55Å; M266-F479 HydrophobicContact CG-CZ 3.88Å; M266-F479 HydrophobicContact SD-CE1 4.36Å; M266-F479 HydrophobicContact SD-CZ 4.44Å; S333-F479 WeakPolarHBondContact CA-O 3.28Å; S333-F479 WeakPolarHBondContact CB-O 3.48Å; F334-F479 HydrophobicContact CE1-CB 4.17Å; F334-F479 HydrophobicContact CE2-CB 4.46Å; F334-F479 HydrophobicContact CE2-CD2 4.06Å; F334-F479 HydrophobicContact CZ-CB 4.13Å; F334-F479 HydrophobicContact CZ-CD2 4.33Å; F334-F479 HydrophobicContact CZ-CG 4.46Å; F334-F479 PolarHBondContact N-O 2.91Å; F334-F479 VanDerWaalsContact N-O 3.16Å; F334-F479 PolarHBondContact O-N 3.14Å; C336-F479 HydrophobicContact CB-CD2 4.39Å; C336-F479 HydrophobicContact CB-CE2 3.88Å; L342-F479 HydrophobicContact CD1-CD1 4.39Å; L342-F479 HydrophobicContact CD1-CE1 4.29Å; L342-F479 HydrophobicContact CD2-CD1 3.91Å; L342-F479 HydrophobicContact CD2-CD2 3.74Å; L342-F479 HydrophobicContact CD2-CE1 4Å; L342-F479 HydrophobicContact CD2-CE2 3.84Å; L342-F479 HydrophobicContact CD2-CG 3.77Å; L342-F479 HydrophobicContact CD2-CZ 3.97Å; L342-F479 HydrophobicContact CG-CD1 4.17Å; L342-F479 HydrophobicContact CG-CE1 3.86Å; L342-F479 HydrophobicContact CG-CE2 4.28Å; L342-F479 HydrophobicContact CG-CZ 3.92Å; V343-F479 HydrophobicContact CG2-CE2 4.05Å; V343-F479 HydrophobicContact CG2-CZ 3.89Å; F347-F479 HydrophobicContact CD2-CD1 4.22Å; F347-F479 AromaticContact CD2-CE1 3.51Å; F347-F479 HydrophobicContact CD2-CE1 3.51Å; F347-F479 HydrophobicContact CD2-CZ 4.46Å; F347-F479 AromaticContact CE2-CD1 3.89Å; F347-F479 HydrophobicContact CE2-CD1 3.89Å; F347-F479 AromaticContact CE2-CE1 3.66Å; F347-F479 HydrophobicContact CE2-CE1 3.66Å; F347-F479 AromaticContact CG-CE1 3.98Å; F347-F479 HydrophobicContact CG-CE1 3.98Å; F347-F479 HydrophobicContact CZ-CD1 4.31Å; F347-F479 HydrophobicContact CZ-CE1 4.26Å; L477-F479 HydrophobicContact CB-CE2 3.86Å; L477-F479 HydrophobicContact CB-CZ 4.14Å; L477-F479 HydrophobicContact CD1-CZ 4.27Å; F479-W638 HydrophobicContact CB-CZ2 4.27Å; F479-W638 PolarHBondContact O-NE1 3.17Å
480	T	95.4	Very high	90.1	Very high	19 Å²	19	29 Å²	29	12%	0.117	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.3	-177.1	-52	0	0	0	0	110.2	A265 N332 K478	A265-T480 PolarHBondContact N-O 2.88Å; A265-T480 PolarHBondContact O-N 3.19Å; N332-T480 WeakPolarHBondContact ND2-CG2 3.23Å; N332-T480 WeakPolarHBondContact O-CA 3.49Å; K478-T480 WeakPolarHBondContact CE-OG1 3.26Å
481	L	95.9	Very high	90.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	130.9	175.9	-171.6	69.9	0	0	0	109.9	Y262 L264 N332 F627 T635 W638	Y262-L481 HydrophobicContact CD1-CD1 3.91Å; Y262-L481 HydrophobicContact CD1-CD2 4.02Å; Y262-L481 HydrophobicContact CD1-CG 3.84Å; Y262-L481 HydrophobicContact CE1-CD2 4.23Å; Y262-L481 HydrophobicContact CE1-CG 4.48Å; Y262-L481 HydrophobicContact CG-CD1 4.06Å; Y262-L481 HydrophobicContact CG-CG 4.49Å; L264-L481 HydrophobicContact CB-CD1 4.35Å; N332-L481 PolarHBondContact ND2-O 3.47Å; N332-L481 PolarHBondContact O-N 3.45Å; L481-F627 HydrophobicContact CD1-CE2 4.13Å; L481-F627 HydrophobicContact CD1-CZ 3.72Å; L481-F627 HydrophobicContact CD2-CE2 4.06Å; L481-F627 HydrophobicContact CD2-CZ 4.18Å; L481-T635 WeakPolarHBondContact O-CG2 3.09Å; L481-W638 HydrophobicContact CB-CB 4.2Å; L481-W638 HydrophobicContact CB-CD2 3.68Å; L481-W638 HydrophobicContact CB-CE3 4.31Å; L481-W638 HydrophobicContact CB-CG 3.61Å; L481-W638 HydrophobicContact CD2-CB 4.22Å; L481-W638 HydrophobicContact CD2-CD2 3.99Å; L481-W638 HydrophobicContact CD2-CE3 3.82Å; L481-W638 HydrophobicContact CD2-CG 4.19Å; L481-W638 HydrophobicContact CG-CD2 4.36Å
482	N	94.4	Very high	91.3	Very high	40 Å²	40	28.5 Å²	28.5	21%	0.214	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	122.9	177.1	-69.3	-37.2	0	0	0	110.1	M239 Y262 Y263 N332	M239-N482 HydrophobicContact CE-CB 3.59Å; M239-N482 WeakPolarHBondContact CE-OD1 3.2Å; Y262-N482 WeakPolarHBondContact CA-O 3.35Å; Y263-N482 PolarHBondContact N-O 3.37Å; Y263-N482 PolarHBondContact O-N 2.85Å; N332-N482 PolarHBondContact ND2-OD1 2.74Å
483	P	95.5	Very high	91.8	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.013	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	150.1	175.3	30.8	-37.8	0	0	0	111	D226 I229 M239 W242 P259 Y262 F485 T635	D226-P483 HydrophobicContact CB-CB 4.25Å; D226-P483 HydrophobicContact CB-CG 3.99Å; I229-P483 HydrophobicContact CG2-CG 4.49Å; M239-P483 HydrophobicContact CE-CG 4.23Å; M239-P483 HydrophobicContact SD-CG 4.32Å; W242-P483 WeakPolarHBondContact CH2-O 3.2Å; W242-P483 VanDerWaalsContact CZ3-O 3.29Å; W242-P483 WeakPolarHBondContact CZ3-O 3.38Å; P259-P483 HydrophobicContact CB-CB 3.77Å; P259-P483 HydrophobicContact CG-CB 4.06Å; Y262-P483 HydrophobicContact CD1-CB 4.03Å; Y262-P483 HydrophobicContact CE1-CB 3.82Å; P483-F485 HydrophobicContact CB-CD2 4.31Å; P483-F485 HydrophobicContact CB-CE2 3.7Å; P483-F485 HydrophobicContact CB-CZ 4.15Å; P483-F485 HydrophobicContact CG-CE2 3.77Å; P483-F485 HydrophobicContact CG-CZ 4.48Å; P483-T635 VanDerWaalsContact CD-CG2 3.47Å; P483-T635 HydrophobicContact CG-CG2 4.32Å
484	E	94.6	Very high	92.3	Very high	48 Å²	48	26.7 Å²	26.7	22%	0.224	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	121.5	165.8	-171.4	179.8	-178.9	0	0	110.1	W242 P259 K260 Q261 Y263	W242-E484 HydrophobicContact CH2-CB 4.4Å; W242-E484 HydrophobicContact CH2-CG 4.18Å; W242-E484 HydrophobicContact CZ2-CG 4.13Å; P259-E484 CarbonylContact C-O 3.57Å; P259-E484 WeakPolarHBondContact CA-O 3.39Å; P259-E484 VanDerWaalsContact CB-O 3.26Å; P259-E484 WeakPolarHBondContact CB-O 3.48Å; K260-E484 PolarHBondContact N-O 3.09Å; Q261-E484 HydrophobicContact CG-CB 4.06Å; Q261-E484 WeakPolarHBondContact CG-OE2 3.17Å; Q261-E484 PolarHBondContact NE2-OE2 3.08Å; Q261-E484 PolarHBondContact O-N 3.31Å; Y263-E484 HydrophobicContact CD2-CB 4.25Å; Y263-E484 HydrophobicContact CE2-CB 3.76Å; Y263-E484 HydrophobicContact CE2-CG 4.08Å; Y263-E484 WeakPolarHBondContact CE2-OE2 3.31Å; Y263-E484 PolarHBondContact OH-OE2 2.69Å
485	F	94.1	Very high	92.8	Very high	8 Å²	8	27.1 Å²	27.1	4%	0.035	15%	0.148	C	C	.	.			trans	-103.8	143.2	176.8	-66.5	-81.9	0	0	0	111.3	D226 V230 W242 P257 P259 P483 F487	D226-F485 HydrophobicContact CB-CE2 4.34Å; D226-F485 HydrophobicContact CB-CZ 3.91Å; V230-F485 HydrophobicContact CG2-CD2 4.46Å; V230-F485 HydrophobicContact CG2-CE2 3.88Å; W242-F485 HydrophobicContact CD2-CB 4.12Å; W242-F485 HydrophobicContact CD2-CD2 4.17Å; W242-F485 AromaticContact CE3-CD2 3.88Å; W242-F485 HydrophobicContact CE3-CD2 3.88Å; W242-F485 HydrophobicContact CG-CB 4.31Å; W242-F485 HydrophobicContact CZ3-CD2 4.25Å; W242-F485 PolarHBondContact NE1-O 3.28Å; P257-F485 WeakPolarHBondContact O-CE1 3.36Å; P259-F485 HydrophobicContact CB-CD1 4Å; P259-F485 HydrophobicContact CB-CE1 3.81Å; P259-F485 HydrophobicContact CB-CE2 4.48Å; P259-F485 HydrophobicContact CB-CG 4.44Å; P259-F485 HydrophobicContact CB-CZ 4.07Å; P259-F485 HydrophobicContact CG-CE1 4.34Å; P259-F485 HydrophobicContact CG-CZ 4.46Å; P483-F485 HydrophobicContact CB-CD2 4.31Å; P483-F485 HydrophobicContact CB-CE2 3.7Å; P483-F485 HydrophobicContact CB-CZ 4.15Å; P483-F485 HydrophobicContact CG-CE2 3.77Å; P483-F485 HydrophobicContact CG-CZ 4.48Å; F485-F487 HydrophobicContact CB-CD1 4.24Å; F485-F487 HydrophobicContact CB-CD2 3.72Å; F485-F487 HydrophobicContact CB-CE1 3.96Å; F485-F487 HydrophobicContact CB-CE2 3.39Å; F485-F487 HydrophobicContact CB-CG 4.14Å; F485-F487 HydrophobicContact CB-CZ 3.54Å; F485-F487 AromaticContact CD1-CE1 3.67Å; F485-F487 HydrophobicContact CD1-CE1 3.67Å; F485-F487 AromaticContact CD1-CE2 3.81Å; F485-F487 HydrophobicContact CD1-CE2 3.81Å; F485-F487 AromaticContact CD1-CZ 3.14Å; F485-F487 HydrophobicContact CD1-CZ 3.14Å; F485-F487 HydrophobicContact CD2-CE2 4.09Å; F485-F487 HydrophobicContact CD2-CZ 4.23Å; F485-F487 AromaticContact CE1-CZ 3.82Å; F485-F487 HydrophobicContact CE1-CZ 3.82Å; F485-F487 HydrophobicContact CG-CD2 4.33Å; F485-F487 HydrophobicContact CG-CE1 4.1Å; F485-F487 AromaticContact CG-CE2 3.5Å; F485-F487 HydrophobicContact CG-CE2 3.5Å; F485-F487 VanDerWaalsContact CG-CE2 3.5Å; F485-F487 AromaticContact CG-CZ 3.37Å; F485-F487 HydrophobicContact CG-CZ 3.37Å
486	D	90.7	Very high	93.1	Very high	67 Å²	67	24 Å²	24	36%	0.358	13%	0.134	S	C	.	.			trans	-107.3	99.7	164.3	-171.6	-8.9	0	0	0	107.8	K260 T488 T491	K260-D486 HydrophobicContact CD-CB 4.38Å; D486-T488 WeakPolarHBondContact OD1-CB 3.23Å; D486-T488 WeakPolarHBondContact OD1-CG2 3.47Å; D486-T488 PolarHBondContact OD1-N 3.15Å; D486-T488 PolarHBondContact OD1-OG1 2.78Å; D486-T491 PolarHBondContact O-OG1 2.9Å; D486-T491 PolarHBondContact OD1-OG1 3.23Å
487	F	91.4	Very high	93.2	Very high	14 Å²	14	27.7 Å²	27.7	6%	0.061	15%	0.152	C	C	.	.			trans	-113.1	20	175.9	-60.4	-38.7	0	0	0	112	W242 P245 L246 I249 P257 F485 N489 G490 T491	W242-F487 HydrophobicContact CB-CD2 4.04Å; W242-F487 HydrophobicContact CB-CE2 4.09Å; W242-F487 AromaticContact CD1-CD2 3.83Å; W242-F487 HydrophobicContact CG-CD2 4.09Å; W242-F487 HydrophobicContact CG-CE2 4.34Å; P245-F487 HydrophobicContact CB-CB 3.65Å; P245-F487 HydrophobicContact CB-CD2 3.92Å; P245-F487 HydrophobicContact CB-CG 4.06Å; P245-F487 HydrophobicContact CG-CB 4.46Å; L246-F487 HydrophobicContact CB-CE2 3.89Å; L246-F487 HydrophobicContact CB-CZ 4.37Å; L246-F487 HydrophobicContact CD1-CE2 4.19Å; L246-F487 HydrophobicContact CD1-CZ 3.85Å; I249-F487 HydrophobicContact CD1-CD1 3.42Å; I249-F487 VanDerWaalsContact CD1-CD1 3.42Å; I249-F487 HydrophobicContact CD1-CE1 3.63Å; I249-F487 HydrophobicContact CD1-CG 3.99Å; I249-F487 HydrophobicContact CD1-CZ 4.35Å; P257-F487 HydrophobicContact CB-CE1 4.07Å; P257-F487 HydrophobicContact CB-CZ 4.21Å; F485-F487 HydrophobicContact CB-CD1 4.24Å; F485-F487 HydrophobicContact CB-CD2 3.72Å; F485-F487 HydrophobicContact CB-CE1 3.96Å; F485-F487 HydrophobicContact CB-CE2 3.39Å; F485-F487 HydrophobicContact CB-CG 4.14Å; F485-F487 HydrophobicContact CB-CZ 3.54Å; F485-F487 AromaticContact CD1-CE1 3.67Å; F485-F487 HydrophobicContact CD1-CE1 3.67Å; F485-F487 AromaticContact CD1-CE2 3.81Å; F485-F487 HydrophobicContact CD1-CE2 3.81Å; F485-F487 AromaticContact CD1-CZ 3.14Å; F485-F487 HydrophobicContact CD1-CZ 3.14Å; F485-F487 HydrophobicContact CD2-CE2 4.09Å; F485-F487 HydrophobicContact CD2-CZ 4.23Å; F485-F487 AromaticContact CE1-CZ 3.82Å; F485-F487 HydrophobicContact CE1-CZ 3.82Å; F485-F487 HydrophobicContact CG-CD2 4.33Å; F485-F487 HydrophobicContact CG-CE1 4.1Å; F485-F487 AromaticContact CG-CE2 3.5Å; F485-F487 HydrophobicContact CG-CE2 3.5Å; F485-F487 VanDerWaalsContact CG-CE2 3.5Å; F485-F487 AromaticContact CG-CZ 3.37Å; F485-F487 HydrophobicContact CG-CZ 3.37Å; F487-N489 PolarHBondContact O-N 2.98Å; F487-G490 PolarHBondContact O-N 2.99Å; F487-G490 VanDerWaalsContact O-N 3.15Å; F487-T491 VanDerWaalsContact C-OG1 3.27Å; F487-T491 WeakPolarHBondContact CA-OG1 3.36Å; F487-T491 WeakPolarHBondContact CD1-O 3.4Å
488	T	84.9	Confident	93.1	Very high	78 Å²	78	28.2 Å²	28.2	48%	0.479	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-55.8	123.6	178.6	54.6	0	0	0	0	110.3	D486 G490 T491	D486-T488 WeakPolarHBondContact OD1-CB 3.23Å; D486-T488 WeakPolarHBondContact OD1-CG2 3.47Å; D486-T488 PolarHBondContact OD1-N 3.15Å; D486-T488 PolarHBondContact OD1-OG1 2.78Å; T488-G490 PolarHBondContact O-N 3.15Å; T488-T491 PolarHBondContact N-OG1 3.39Å; T488-T491 WeakPolarHBondContact O-CB 3.15Å; T488-T491 VanDerWaalsContact O-CG2 3.22Å; T488-T491 WeakPolarHBondContact O-CG2 3.27Å; T488-T491 PolarHBondContact O-N 3.25Å; T488-T491 PolarHBondContact O-OG1 2.97Å
489	N	83.2	Confident	92.7	Very high	128 Å²	128	32.7 Å²	32.7	68%	0.684	17%	0.17	S	C	*	.	G	3₁₀ helix	trans	52	27.3	-178.1	-64.9	-14.2	0	0	0	115.4	F487 V592	F487-N489 PolarHBondContact O-N 2.98Å; N489-V592 HydrophobicContact CB-CG1 4.01Å; N489-V592 WeakPolarHBondContact ND2-CG1 3.37Å
490	G	84.3	Confident	92.1	Very high	25 Å²	25	35.3 Å²	35.3	26%	0.258	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	80.2	21	179	0	0	0	0	0	114.5	F487 T488	F487-G490 PolarHBondContact O-N 2.99Å; F487-G490 VanDerWaalsContact O-N 3.15Å; T488-G490 PolarHBondContact O-N 3.15Å
491	T	93	Very high	91.5	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.031	18%	0.183	C	C	.	.			trans	-55.5	145.7	162.3	48.5	0	0	0	0	110.6	D486 F487 T488 R590 S591 V592	D486-T491 PolarHBondContact O-OG1 2.9Å; D486-T491 PolarHBondContact OD1-OG1 3.23Å; F487-T491 VanDerWaalsContact C-OG1 3.27Å; F487-T491 WeakPolarHBondContact CA-OG1 3.36Å; F487-T491 WeakPolarHBondContact CD1-O 3.4Å; T488-T491 PolarHBondContact N-OG1 3.39Å; T488-T491 WeakPolarHBondContact O-CB 3.15Å; T488-T491 VanDerWaalsContact O-CG2 3.22Å; T488-T491 WeakPolarHBondContact O-CG2 3.27Å; T488-T491 PolarHBondContact O-N 3.25Å; T488-T491 PolarHBondContact O-OG1 2.97Å; T491-R590 VanDerWaalsContact CA-O 3.26Å; T491-R590 WeakPolarHBondContact CA-O 3.49Å; T491-R590 WeakPolarHBondContact CB-O 3.26Å; T491-S591 VanDerWaalsContact CG2-C 3.48Å; T491-V592 HydrophobicContact CG2-CB 4.27Å; T491-V592 HydrophobicContact CG2-CG2 3.5Å; T491-V592 VanDerWaalsContact CG2-N 3.31Å
492	Y	95.2	Very high	90.8	Very high	8 Å²	8	43.1 Å²	43.1	3%	0.031	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	158.8	170.7	67.6	-94	0	0	0	110.9	I249 A253 C254 C494 H589 R590	I249-Y492 HydrophobicContact CG1-CD1 4.42Å; I249-Y492 HydrophobicContact CG2-CD1 4.24Å; I249-Y492 HydrophobicContact CG2-CD2 4.43Å; I249-Y492 HydrophobicContact CG2-CG 4.01Å; A253-Y492 HydrophobicContact CB-CE1 3.78Å; A253-Y492 HydrophobicContact CB-CE2 4.21Å; C254-Y492 HydrophobicContact CB-CD2 4.4Å; C254-Y492 HydrophobicContact CB-CE2 4.43Å; Y492-C494 HydrophobicContact CD2-CB 4.16Å; Y492-C494 HydrophobicContact CE2-CB 4.1Å; Y492-H589 WeakPolarHBondContact O-CA 3.35Å; Y492-R590 HydrophobicContact CD1-CB 3.83Å; Y492-R590 HydrophobicContact CE1-CB 3.65Å; Y492-R590 VanDerWaalsContact CE1-CD 3.4Å; Y492-R590 HydrophobicContact CE1-CG 4.19Å; Y492-R590 HydrophobicContact CG-CB 4.39Å; Y492-R590 PolarHBondContact N-O 2.87Å; Y492-R590 PolarHBondContact O-N 2.81Å
493	T	95.9	Very high	90.1	Very high	22 Å²	22	44.1 Å²	44.1	14%	0.135	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	132.2	170.8	-53.3	0	0	0	0	108.4	P257 L258 I587 V588 Y657	P257-T493 WeakPolarHBondContact CA-O 3.24Å; L258-T493 HydrophobicContact CB-CG2 4.32Å; L258-T493 HydrophobicContact CD1-CG2 4.09Å; L258-T493 PolarHBondContact N-O 3.06Å; T493-I587 HydrophobicContact CG2-CG2 3.17Å; T493-V588 CarbonylContact C-O 3.54Å; T493-V588 WeakPolarHBondContact CA-O 3.26Å; T493-Y657 HydrophobicContact CG2-CD1 4.43Å; T493-Y657 HydrophobicContact CG2-CE1 4.25Å
494	C	96.3	Very high	89.5	Confident	1 Å²	1	44 Å²	44	1%	0.007	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	134.8	-179	-162.8	0	0	0	0	110.8	C254 Y492 V496 I587 V588	C254-C494 HydrophobicContact CB-CB 3.68Å; C254-C494 WeakPolarHBondContact CB-SG 3.32Å; C254-C494 WeakPolarHBondContact SG-CB 3.29Å; C254-C494 CovalentContact SG-SG 2.03Å; C254-C494 PolarHBondContact SG-SG 3.43Å; Y492-C494 HydrophobicContact CD2-CB 4.16Å; Y492-C494 HydrophobicContact CE2-CB 4.1Å; C494-V496 HydrophobicContact CB-CG1 4.47Å; C494-I587 WeakPolarHBondContact O-CA 3.38Å; C494-V588 PolarHBondContact N-O 3.02Å; C494-V588 PolarHBondContact O-N 2.81Å
495	H	97.6	Very high	89.1	Confident	13 Å²	13	41.8 Å²	41.8	6%	0.06	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	123.8	171.8	-175.7	-143.3	0	0	0	110.3	D219 V220 H222 L258 D585 I587 P630	D219-H495 WeakPolarHBondContact CA-O 3.36Å; V220-H495 WeakPolarHBondContact CB-ND1 3.47Å; V220-H495 PolarHBondContact N-O 2.02Å; H222-H495 AromaticContact CE1-ND1 3.3Å; H222-H495 PolarHBondContact CE1-ND1 2.99Å; H222-H495 VanDerWaalsContact CE1-ND1 3.3Å; H222-H495 AromaticContact NE2-CG 3.86Å; H222-H495 AromaticContact NE2-ND1 3.08Å; H222-H495 PolarHBondContact NE2-ND1 2.97Å; L258-H495 HydrophobicContact CD1-CB 4.19Å; L258-H495 HydrophobicContact CD2-CB 4.49Å; H495-D585 IonicContact NE2-OD1 3.1Å; H495-I587 HydrophobicContact CB-CD1 4.18Å; H495-P630 HydrophobicContact CB-CB 4.41Å; H495-P630 HydrophobicContact CB-CG 4.31Å
496	V	95.8	Very high	88.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	148.9	-177.3	-55.4	0	0	0	0	111.2	Y217 E218 D219 C494 A586 V588 L598 Y681	Y217-V496 HydrophobicContact CD1-CB 4.27Å; Y217-V496 HydrophobicContact CD1-CG2 3.61Å; Y217-V496 HydrophobicContact CE1-CG2 4.41Å; Y217-V496 HydrophobicContact CG-CG2 3.97Å; E218-V496 CarbonylContact O-C 3.57Å; E218-V496 WeakPolarHBondContact O-CA 3.45Å; E218-V496 WeakPolarHBondContact O-CB 3.29Å; D219-V496 HydrophobicContact CB-CG1 4.43Å; C494-V496 HydrophobicContact CB-CG1 4.47Å; V496-A586 HydrophobicContact CG2-CB 3.98Å; V496-A586 WeakPolarHBondContact CG2-O 3.5Å; V496-A586 PolarHBondContact N-O 2.88Å; V496-A586 PolarHBondContact O-N 2.79Å; V496-A586 VanDerWaalsContact O-O 3.08Å; V496-V588 HydrophobicContact CB-CG2 4.47Å; V496-V588 HydrophobicContact CG1-CB 4.31Å; V496-V588 HydrophobicContact CG1-CG2 3.84Å; V496-V588 HydrophobicContact CG2-CG2 3.74Å; V496-L598 HydrophobicContact CG2-CD1 4.36Å; V496-Y681 HydrophobicContact CG1-CD2 3.98Å; V496-Y681 HydrophobicContact CG1-CE2 3.82Å
497	Q	94.2	Very high	88.4	Confident	78 Å²	78	38.7 Å²	38.7	36%	0.364	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	138.4	178.5	-179.2	169.1	61.7	0	0	110.5	Y217 E218 V220 R499 D584	Y217-Q497 WeakPolarHBondContact CA-O 3.5Å; Y217-Q497 VanDerWaalsContact CD1-C 3.5Å; E218-Q497 PolarHBondContact N-O 2.92Å; E218-Q497 PolarHBondContact O-N 2.82Å; V220-Q497 HydrophobicContact CG2-CB 3.66Å; Q497-R499 PolarHBondContact O-N 3.42Å; Q497-D584 CarbonylContact C-O 3.57Å; Q497-D584 VanDerWaalsContact CA-O 3.27Å; Q497-D584 WeakPolarHBondContact CA-O 3.22Å; Q497-D584 WeakPolarHBondContact CG-O 3.49Å
498	H	91.9	Very high	88.2	Confident	12 Å²	12	39.5 Å²	39.5	6%	0.056	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	134.4	178.9	-177.8	48.6	0	0	0	111.2	E216 Y217 P500 I582 W583 D584	E216-H498 PolarHBondContact O-ND1 2.64Å; Y217-H498 HydrophobicContact CD1-CB 4.08Å; Y217-H498 HydrophobicContact CE1-CB 3.71Å; H498-P500 WeakPolarHBondContact O-CD 2.97Å; H498-I582 HydrophobicContact CB-CG2 4.49Å; H498-I582 VanDerWaalsContact CD2-CG2 3.46Å; H498-I582 WeakPolarHBondContact CD2-CG2 3.44Å; H498-W583 WeakPolarHBondContact CB-O 3.45Å; H498-D584 PolarHBondContact N-O 2.87Å
499	R	87.1	Confident	88.2	Confident	118 Å²	118	35.8 Å²	35.8	45%	0.445	18%	0.179	S	C	.	.			trans	-114.9	93.7	174.1	-71.3	-60.6	-157.3	172.2	1.8	109.6	E216 E218 Q497	E216-R499 PolarHBondContact O-N 2.66Å; E218-R499 HydrophobicContact CB-CG 4.06Å; E218-R499 HydrophobicContact CG-CG 3.73Å; E218-R499 IonicContact OE2-CZ 3.09Å; E218-R499 VanDerWaalsContact OE2-CZ 3.26Å; E218-R499 IonicContact OE2-NE 3.89Å; E218-R499 PolarHBondContact OE2-NE 3.3Å; E218-R499 IonicContact OE2-NH2 2.82Å; E218-R499 PolarHBondContact OE2-NH2 2.94Å; Q497-R499 PolarHBondContact O-N 3.42Å
500	P	83.1	Confident	88.2	Confident	56 Å²	56	30.9 Å²	30.9	36%	0.364	15%	0.151	S	C	.	.			trans	-62.1	135.8	177.7	22.7	-31	0	0	0	110.7	H498 L534	H498-P500 WeakPolarHBondContact O-CD 2.97Å; P500-L534 HydrophobicContact CB-CD1 3.7Å
501	P	83.7	Confident	88.1	Confident	4 Å²	4	29.7 Å²	29.7	3%	0.026	14%	0.139	C	C	.	.			trans	-74.1	134.1	178.6	31.6	-36	0	0	0	110.9	R212 I503 L534 L560	R212-P501 HydrophobicContact CB-CB 3.9Å; R212-P501 HydrophobicContact CB-CG 4.01Å; R212-P501 VanDerWaalsContact CZ-CB 3.41Å; P501-I503 VanDerWaalsContact C-N 3.26Å; P501-I503 PolarHBondContact O-N 2.68Å; P501-L534 HydrophobicContact CG-CD1 4.32Å; P501-L534 WeakPolarHBondContact O-CD1 3.47Å; P501-L560 HydrophobicContact CG-CD1 4.25Å
502	K	79.3	Confident	87.4	Confident	179 Å²	179	30 Å²	30	78%	0.778	14%	0.14	S	C	*	.	S	Bend	trans	-56.8	-41.5	175.9	-68.7	-175.3	178	-178.4	0	112.8	Q533 L534	K502-Q533 VanDerWaalsContact O-CA 3.24Å; K502-Q533 WeakPolarHBondContact O-CA 3.32Å; K502-Q533 VanDerWaalsContact O-CB 3.29Å; K502-Q533 WeakPolarHBondContact O-CB 3.11Å; K502-Q533 WeakPolarHBondContact O-CG 3.38Å; K502-L534 PolarHBondContact O-N 2.85Å
503	I	79.6	Confident	86.2	Confident	61 Å²	61	29.8 Å²	29.8	31%	0.313	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	123.2	176.2	-59.4	165.7	0	0	0	106.4	P501 I532 Q533	P501-I503 VanDerWaalsContact C-N 3.26Å; P501-I503 PolarHBondContact O-N 2.68Å; I503-I532 CarbonylContact C-O 3.56Å; I503-I532 WeakPolarHBondContact CA-O 3.4Å; I503-Q533 HydrophobicContact CG1-CG 3.83Å
504	I	83.3	Confident	84.8	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-45.2	177.9	-47	-177.2	0	0	0	109.6	R212 L213 I532 L534 F559 L560	R212-I504 PolarHBondContact N-O 2.67Å; L213-I504 HydrophobicContact CD2-CG2 3.41Å; L213-I504 VanDerWaalsContact CD2-CG2 3.41Å; L213-I504 HydrophobicContact CG-CG2 4.13Å; I504-I532 HydrophobicContact CD1-CG2 4.45Å; I504-I532 PolarHBondContact N-O 2.99Å; I504-L534 HydrophobicContact CD1-CD2 4.15Å; I504-L534 HydrophobicContact CD1-CG 3.9Å; I504-L534 HydrophobicContact CG1-CD1 4.41Å; I504-L534 HydrophobicContact CG1-CG 4Å; I504-F559 HydrophobicContact CD1-CD1 3.57Å; I504-F559 HydrophobicContact CD1-CE1 3.5Å; I504-F559 VanDerWaalsContact CD1-CE1 3.5Å; I504-L560 HydrophobicContact CD1-CD1 4.38Å; I504-L560 HydrophobicContact CG1-CD1 4.48Å; I504-L560 HydrophobicContact CG2-CD1 4Å
505	Y	87.1	Confident	82.8	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	167.4	172.5	42.4	-96.9	0	0	0	110.5	V208 K209 I211 L213 I507 I532 L565 L574 H576	V208-Y505 HydrophobicContact CG1-CD2 3.69Å; V208-Y505 HydrophobicContact CG1-CE2 4.43Å; V208-Y505 HydrophobicContact CG1-CG 3.78Å; K209-Y505 WeakPolarHBondContact O-CB 3.23Å; I211-Y505 HydrophobicContact CG2-CD1 4.48Å; L213-Y505 HydrophobicContact CD1-CE1 4.35Å; L213-Y505 HydrophobicContact CD2-CE1 4.16Å; L213-Y505 HydrophobicContact CG-CD1 4.4Å; L213-Y505 HydrophobicContact CG-CE1 4.41Å; Y505-I507 HydrophobicContact CD2-CD1 4.41Å; Y505-I507 HydrophobicContact CD2-CG1 3.94Å; Y505-I507 HydrophobicContact CE2-CD1 4.01Å; Y505-I507 HydrophobicContact CE2-CG1 4.05Å; Y505-I532 HydrophobicContact CD2-CB 4.07Å; Y505-I532 HydrophobicContact CD2-CG1 3.78Å; Y505-I532 HydrophobicContact CE2-CB 3.91Å; Y505-I532 HydrophobicContact CE2-CG1 3.51Å; Y505-I532 HydrophobicContact CE2-CG2 4.24Å; Y505-I532 PolarHBondContact O-N 3.09Å; Y505-L565 HydrophobicContact CE2-CD1 3.73Å; Y505-L565 WeakPolarHBondContact OH-CD1 3.45Å; Y505-L574 HydrophobicContact CE2-CD2 4.12Å; Y505-H576 HydrophobicContact CE1-CB 4.37Å; Y505-H576 AromaticContact CE1-ND1 3.96Å; Y505-H576 AromaticContact CZ-ND1 3.8Å; Y505-H576 PolarHBondContact OH-CE1 3.36Å; Y505-H576 PolarHBondContact OH-ND1 3.37Å
506	T	86	Confident	80.4	Confident	11 Å²	11	44.3 Å²	44.3	7%	0.067	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131.3	172.6	-62.2	0	0	0	0	109	V208 K209 K529 Y530 N531	V208-T506 CarbonylContact C-O 3.49Å; V208-T506 WeakPolarHBondContact CA-O 2.91Å; K209-T506 PolarHBondContact N-O 2.83Å; K209-T506 PolarHBondContact O-N 3.19Å; T506-K529 HydrophobicContact CG2-CD 4.37Å; T506-K529 HydrophobicContact CG2-CG 3.95Å; T506-Y530 CarbonylContact C-O 3.5Å; T506-Y530 VanDerWaalsContact CA-O 3.3Å; T506-Y530 WeakPolarHBondContact CA-O 3.23Å; T506-N531 VanDerWaalsContact CG2-OD1 3.3Å; T506-N531 WeakPolarHBondContact CG2-OD1 3.3Å; T506-N531 PolarHBondContact OG1-OD1 3.24Å
507	I	83.5	Confident	78.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132	174.3	-55.7	171.1	0	0	0	108.3	I206 N207 Y505 K529 Y530 I532 L565 L567 L574	I206-I507 HydrophobicContact CG2-CG2 4.07Å; N207-I507 CarbonylContact O-C 3.47Å; N207-I507 WeakPolarHBondContact O-CA 2.98Å; Y505-I507 HydrophobicContact CD2-CD1 4.41Å; Y505-I507 HydrophobicContact CD2-CG1 3.94Å; Y505-I507 HydrophobicContact CE2-CD1 4.01Å; Y505-I507 HydrophobicContact CE2-CG1 4.05Å; I507-K529 CarbonylContact O-C 3.58Å; I507-K529 VanDerWaalsContact O-CA 3.28Å; I507-K529 WeakPolarHBondContact O-CA 3.39Å; I507-Y530 HydrophobicContact CB-CD2 4.31Å; I507-Y530 HydrophobicContact CG2-CD2 4.4Å; I507-Y530 PolarHBondContact N-O 3.11Å; I507-Y530 PolarHBondContact O-N 3.19Å; I507-I532 HydrophobicContact CD1-CD1 4.27Å; I507-I532 HydrophobicContact CD1-CG1 4.08Å; I507-I532 HydrophobicContact CG1-CG1 4.36Å; I507-L565 HydrophobicContact CD1-CD1 4.2Å; I507-L567 HydrophobicContact CD1-CD2 4.49Å; I507-L567 HydrophobicContact CG2-CD1 4.27Å; I507-L574 HydrophobicContact CD1-CD1 3.91Å; I507-L574 HydrophobicContact CG1-CD1 4.32Å
508	E	87.3	Confident	75.7	Confident	30 Å²	30	48.3 Å²	48.3	14%	0.14	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	124	164.1	-72.9	174.3	-161.9	0	0	108.5	N207 K209 L528 K529	N207-E508 HydrophobicContact CB-CB 4.26Å; N207-E508 PolarHBondContact N-O 3.22Å; N207-E508 PolarHBondContact O-N 3.06Å; K209-E508 WeakPolarHBondContact CE-OE2 3.42Å; K209-E508 IonicContact NZ-OE1 2.81Å; K209-E508 PolarHBondContact NZ-OE1 3.13Å; K209-E508 VanDerWaalsContact NZ-OE1 3.09Å; K209-E508 IonicContact NZ-OE2 3.99Å; K209-E508 PolarHBondContact NZ-OE2 2.96Å; E508-L528 CarbonylContact C-O 3.54Å; E508-L528 VanDerWaalsContact CA-O 3.28Å; E508-L528 WeakPolarHBondContact CA-O 3.25Å; E508-K529 HydrophobicContact CG-CB 4.33Å; E508-K529 HydrophobicContact CG-CD 4.33Å; E508-K529 HydrophobicContact CG-CG 3.98Å
509	T	84.6	Confident	73.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	143.2	-178.5	-176	0	0	0	0	112	H205 L528 Y530 W568	H205-T509 WeakPolarHBondContact O-CA 3.45Å; H205-T509 WeakPolarHBondContact O-CB 3.37Å; H205-T509 PolarHBondContact O-OG1 3.14Å; T509-L528 HydrophobicContact CG2-CB 4.04Å; T509-L528 PolarHBondContact N-O 3.44Å; T509-L528 PolarHBondContact O-N 3.35Å; T509-Y530 HydrophobicContact CG2-CE2 3.97Å; T509-W568 HydrophobicContact CG2-CZ2 4.12Å; T509-W568 PolarHBondContact OG1-NE1 3.21Å
510	W	83.2	Confident	71.6	Confident	25 Å²	25	57.5 Å²	57.5	10%	0.095	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	161.1	175.5	65.8	96.9	0	0	0	110.1	H205 N207 S525 R527	H205-W510 HydrophobicContact CB-CD2 3.66Å; H205-W510 HydrophobicContact CB-CE3 4.06Å; H205-W510 HydrophobicContact CB-CG 4.24Å; H205-W510 HydrophobicContact CB-CH2 3.79Å; H205-W510 HydrophobicContact CB-CZ2 3.38Å; H205-W510 HydrophobicContact CB-CZ3 4.11Å; H205-W510 AromaticContact CD2-CD1 3.93Å; H205-W510 AromaticContact CD2-CE2 3.98Å; H205-W510 AromaticContact CD2-NE1 3.41Å; H205-W510 PolarHBondContact CD2-NE1 3.36Å; H205-W510 AromaticContact CG-CE2 3.52Å; H205-W510 AromaticContact CG-CZ2 3.61Å; H205-W510 AromaticContact CG-NE1 3.45Å; H205-W510 PolarHBondContact N-O 3.13Å; H205-W510 AromaticContact ND1-CZ2 3.77Å; H205-W510 PolarHBondContact O-N 3.46Å; H205-W510 VanDerWaalsContact O-N 3.09Å; N207-W510 VanDerWaalsContact ND2-CH2 3.31Å; N207-W510 WeakPolarHBondContact ND2-CH2 3.42Å; W510-S525 WeakPolarHBondContact CA-OG 3.38Å; W510-R527 HydrophobicContact CB-CG 3.98Å; W510-R527 HydrophobicContact CD2-CG 3.97Å; W510-R527 HydrophobicContact CE3-CG 3.8Å; W510-R527 HydrophobicContact CG-CG 4.06Å
511	L	82.9	Confident	69.9	Low	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	137	178.4	-174	152	0	0	0	109.2	I202 S203 V204 L513 W523 S524 S525 W568 L702 A706	I202-L511 HydrophobicContact CG2-CD1 3.69Å; I202-L511 HydrophobicContact CG2-CD2 4.11Å; I202-L511 HydrophobicContact CG2-CG 3.89Å; S203-L511 CarbonylContact O-C 3.54Å; S203-L511 WeakPolarHBondContact O-CA 3.04Å; V204-L511 HydrophobicContact CG2-CD1 4.13Å; V204-L511 HydrophobicContact CG2-CG 4.35Å; L511-L513 HydrophobicContact CD2-CD2 4.08Å; L511-L513 HydrophobicContact CD2-CG 4.04Å; L511-W523 HydrophobicContact CD2-CE3 4.38Å; L511-W523 HydrophobicContact CD2-CZ3 3.9Å; L511-S524 CarbonylContact O-C 3.59Å; L511-S524 VanDerWaalsContact O-CA 3.32Å; L511-S524 WeakPolarHBondContact O-CA 3.45Å; L511-S525 PolarHBondContact N-OG 3.44Å; L511-S525 PolarHBondContact O-N 2.68Å; L511-W568 HydrophobicContact CB-CH2 4Å; L511-W568 HydrophobicContact CB-CZ2 4.44Å; L511-W568 HydrophobicContact CB-CZ3 4.43Å; L511-L702 HydrophobicContact CD1-CB 4.03Å; L511-A706 HydrophobicContact CD1-CB 4.44Å
512	T	77.8	Confident	68.7	Low	11 Å²	11	62.1 Å²	62.1	7%	0.067	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	149.2	171.1	60.7	0	0	0	0	110.8	S203 H205 W523	S203-T512 WeakPolarHBondContact CB-OG1 3.43Å; S203-T512 PolarHBondContact N-O 3.46Å; S203-T512 PolarHBondContact O-N 3.07Å; H205-T512 PolarHBondContact NE2-OG1 3.2Å; T512-W523 CarbonylContact C-O 3.5Å; T512-W523 VanDerWaalsContact CA-O 3.26Å; T512-W523 WeakPolarHBondContact CA-O 3.01Å
513	L	70.2	Confident	68.1	Low	5 Å²	5	56.1 Å²	56.1	3%	0.026	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	118.1	173.3	-65.2	170.7	0	0	0	108.5	L157 F168 I202 L511 V522 W523 L703	L157-L513 HydrophobicContact CD1-CD1 3.62Å; F168-L513 HydrophobicContact CE1-CB 4.46Å; I202-L513 HydrophobicContact CB-CD2 4.32Å; I202-L513 HydrophobicContact CG1-CD2 3.55Å; L511-L513 HydrophobicContact CD2-CD2 4.08Å; L511-L513 HydrophobicContact CD2-CG 4.04Å; L513-V522 WeakPolarHBondContact O-CA 3.39Å; L513-W523 HydrophobicContact CB-CB 4.35Å; L513-W523 HydrophobicContact CD1-CB 4.24Å; L513-W523 HydrophobicContact CD1-CD2 4.16Å; L513-W523 HydrophobicContact CD1-CE3 3.48Å; L513-W523 VanDerWaalsContact CD1-CE3 3.48Å; L513-W523 HydrophobicContact CD1-CZ3 4.15Å; L513-W523 HydrophobicContact CG-CE3 3.88Å; L513-W523 PolarHBondContact N-O 3.16Å; L513-W523 PolarHBondContact O-N 3.29Å; L513-L703 HydrophobicContact CD1-CD1 4.11Å; L513-L703 HydrophobicContact CD2-CD1 4.45Å
514	E	65.6	Low	67.6	Low	110 Å²	110	56 Å²	56	51%	0.514	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131	177.4	-67.1	-174	178.8	0	0	110.9	G201 V522	G201-E514 PolarHBondContact O-N 3.38Å; E514-V522 HydrophobicContact CG-CG2 4.44Å
515	I	54.4	Low	66.9	Low	41 Å²	41	56.2 Å²	56.2	21%	0.21	31%	0.308	C	S	.	.			trans	-95.1	118.9	177.2	-51	175	0	0	0	109.3	F168 G517 L518 L521	F168-I515 HydrophobicContact CE1-CD1 4.26Å; F168-I515 HydrophobicContact CE1-CG1 3.71Å; F168-I515 HydrophobicContact CZ-CD1 3.61Å; F168-I515 HydrophobicContact CZ-CG1 3.58Å; I515-G517 PolarHBondContact O-N 2.93Å; I515-L518 HydrophobicContact CG2-CB 4.44Å; I515-L518 HydrophobicContact CG2-CD1 4.3Å; I515-L521 HydrophobicContact CD1-CB 3.62Å
516	Q	48.5	Very low	65.9	Low	189 Å²	189	59.9 Å²	59.9	88%	0.883	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	125	168.3	-67.4	-172.6	-0.7	0	0	109.9
517	G	50.7	Low	65.6	Low	82 Å²	82	67.3 Å²	67.3	85%	0.845	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.9	-0.4	171.8	0	0	0	0	0	117.2	I515	I515-G517 PolarHBondContact O-N 2.93Å
518	L	40.8	Very low	65.2	Low	81 Å²	81	68.8 Å²	68.8	42%	0.424	37%	0.367	S	S	.	.	S	Bend	trans	-127.6	136.5	174.5	-79.1	165.6	0	0	0	111.6	I515 K520	I515-L518 HydrophobicContact CG2-CB 4.44Å; I515-L518 HydrophobicContact CG2-CD1 4.3Å; L518-K520 PolarHBondContact O-N 2.6Å; L518-K520 VanDerWaalsContact O-N 3.14Å
519	P	42.9	Very low	64.9	Low	124 Å²	124	73.7 Å²	73.7	81%	0.805	39%	0.388	S	S	*	.	S	Bend	trans	-71.4	110.8	174.5	27.7	-29.5	0	0	0	110.4
520	K	50	Low	64.6	Low	198 Å²	198	77.6 Å²	77.6	86%	0.861	40%	0.403	S	S	*	.	S	Bend	trans	70.2	50.9	159.3	-60.7	-176.3	176.7	179.5	0	119	L518	L518-K520 PolarHBondContact O-N 2.6Å; L518-K520 VanDerWaalsContact O-N 3.14Å
521	L	47.3	Very low	64.2	Low	73 Å²	73	80.5 Å²	80.5	38%	0.382	42%	0.42	S	S	.	.			trans	-106.6	96.1	150.9	-116.2	145.5	0	0	0	108.7	I515	I515-L521 HydrophobicContact CD1-CB 3.62Å
522	V	58.6	Low	63.9	Low	85 Å²	85	81.3 Å²	81.3	52%	0.515	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	107.4	174.1	-179.8	0	0	0	0	107	L513 E514	L513-V522 WeakPolarHBondContact O-CA 3.39Å; E514-V522 HydrophobicContact CG-CG2 4.44Å
523	W	65.8	Low	63.8	Low	53 Å²	53	85.9 Å²	85.9	20%	0.201	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	137.6	167.6	179.8	84.7	0	0	0	108.7	L511 T512 L513 L712 I767	L511-W523 HydrophobicContact CD2-CE3 4.38Å; L511-W523 HydrophobicContact CD2-CZ3 3.9Å; T512-W523 CarbonylContact C-O 3.5Å; T512-W523 VanDerWaalsContact CA-O 3.26Å; T512-W523 WeakPolarHBondContact CA-O 3.01Å; L513-W523 HydrophobicContact CB-CB 4.35Å; L513-W523 HydrophobicContact CD1-CB 4.24Å; L513-W523 HydrophobicContact CD1-CD2 4.16Å; L513-W523 HydrophobicContact CD1-CE3 3.48Å; L513-W523 VanDerWaalsContact CD1-CE3 3.48Å; L513-W523 HydrophobicContact CD1-CZ3 4.15Å; L513-W523 HydrophobicContact CG-CE3 3.88Å; L513-W523 PolarHBondContact N-O 3.16Å; L513-W523 PolarHBondContact O-N 3.29Å; W523-L712 HydrophobicContact CZ2-CD1 4.13Å; W523-I767 HydrophobicContact CZ2-CD1 4.49Å
524	S	69.2	Low	63.6	Low	58 Å²	58	86.5 Å²	86.5	41%	0.406	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	133.7	176.1	-177.9	0	0	0	0	109.4	L511	L511-S524 CarbonylContact O-C 3.59Å; L511-S524 VanDerWaalsContact O-CA 3.32Å; L511-S524 WeakPolarHBondContact O-CA 3.45Å
525	S	68.5	Low	63	Low	5 Å²	5	88.6 Å²	88.6	4%	0.035	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-64.6	158.3	166.5	79.8	0	0	0	0	110.4	W510 L511	W510-S525 WeakPolarHBondContact CA-OG 3.38Å; L511-S525 PolarHBondContact N-OG 3.44Å; L511-S525 PolarHBondContact O-N 2.68Å
526	P	66.5	Low	62.6	Low	76 Å²	76	91 Å²	91	49%	0.494	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-51.1	150.9	159.7	-25.2	34.7	0	0	0	111.6	N710	P526-N710 WeakPolarHBondContact CD-OD1 3.41Å; P526-N710 WeakPolarHBondContact CG-OD1 3.32Å
527	R	79	Confident	62.1	Low	168 Å²	168	86.6 Å²	86.6	63%	0.634	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-81.1	119	175.4	-66.6	-175.7	176.3	144	2	109.9	W510	W510-R527 HydrophobicContact CB-CG 3.98Å; W510-R527 HydrophobicContact CD2-CG 3.97Å; W510-R527 HydrophobicContact CE3-CG 3.8Å; W510-R527 HydrophobicContact CG-CG 4.06Å
528	L	76.5	Confident	61.3	Low	31 Å²	31	85.9 Å²	85.9	16%	0.162	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	133.1	172.1	-56.2	176.1	0	0	0	108.9	E508 T509 Y530 W568 L709	E508-L528 CarbonylContact C-O 3.54Å; E508-L528 VanDerWaalsContact CA-O 3.28Å; E508-L528 WeakPolarHBondContact CA-O 3.25Å; T509-L528 HydrophobicContact CG2-CB 4.04Å; T509-L528 PolarHBondContact N-O 3.44Å; T509-L528 PolarHBondContact O-N 3.35Å; L528-Y530 HydrophobicContact CB-CE2 3.79Å; L528-W568 HydrophobicContact CD1-CH2 4.06Å; L528-W568 HydrophobicContact CD1-CZ2 4.16Å; L528-W568 HydrophobicContact CD1-CZ3 4.41Å; L528-L709 HydrophobicContact CD1-CD1 3.87Å
529	K	79.6	Confident	60.8	Low	133 Å²	133	93.2 Å²	93.2	58%	0.578	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.4	-177.7	-173.9	176.2	-178.2	176.4	0	111	T506 I507 E508	T506-K529 HydrophobicContact CG2-CD 4.37Å; T506-K529 HydrophobicContact CG2-CG 3.95Å; I507-K529 CarbonylContact O-C 3.58Å; I507-K529 VanDerWaalsContact O-CA 3.28Å; I507-K529 WeakPolarHBondContact O-CA 3.39Å; E508-K529 HydrophobicContact CG-CB 4.33Å; E508-K529 HydrophobicContact CG-CD 4.33Å; E508-K529 HydrophobicContact CG-CG 3.98Å
530	Y	78.5	Confident	60.3	Low	81 Å²	81	90.1 Å²	90.1	32%	0.318	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	131.4	-179.8	-52.5	-80.3	0	0	0	110.3	T506 I507 T509 L528 L567	T506-Y530 CarbonylContact C-O 3.5Å; T506-Y530 VanDerWaalsContact CA-O 3.3Å; T506-Y530 WeakPolarHBondContact CA-O 3.23Å; I507-Y530 HydrophobicContact CB-CD2 4.31Å; I507-Y530 HydrophobicContact CG2-CD2 4.4Å; I507-Y530 PolarHBondContact N-O 3.11Å; I507-Y530 PolarHBondContact O-N 3.19Å; T509-Y530 HydrophobicContact CG2-CE2 3.97Å; L528-Y530 HydrophobicContact CB-CE2 3.79Å; Y530-L567 HydrophobicContact CD2-CD2 4.22Å; Y530-L567 HydrophobicContact CE2-CD2 4.1Å
531	N	75.5	Confident	59.5	Low	86 Å²	86	84.7 Å²	84.7	46%	0.46	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	116.2	171	-73.2	-32.9	0	0	0	108.9	T506	T506-N531 VanDerWaalsContact CG2-OD1 3.3Å; T506-N531 WeakPolarHBondContact CG2-OD1 3.3Å; T506-N531 PolarHBondContact OG1-OD1 3.24Å
532	I	77.2	Confident	58.9	Low	18 Å²	18	93 Å²	93	9%	0.092	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	115	-178.1	-51.4	-44.4	0	0	0	108.3	I503 I504 Y505 I507 F559 L565	I503-I532 CarbonylContact C-O 3.56Å; I503-I532 WeakPolarHBondContact CA-O 3.4Å; I504-I532 HydrophobicContact CD1-CG2 4.45Å; I504-I532 PolarHBondContact N-O 2.99Å; Y505-I532 HydrophobicContact CD2-CB 4.07Å; Y505-I532 HydrophobicContact CD2-CG1 3.78Å; Y505-I532 HydrophobicContact CE2-CB 3.91Å; Y505-I532 HydrophobicContact CE2-CG1 3.51Å; Y505-I532 HydrophobicContact CE2-CG2 4.24Å; Y505-I532 PolarHBondContact O-N 3.09Å; I507-I532 HydrophobicContact CD1-CD1 4.27Å; I507-I532 HydrophobicContact CD1-CG1 4.08Å; I507-I532 HydrophobicContact CG1-CG1 4.36Å; I532-F559 HydrophobicContact CG2-CE1 4.13Å; I532-F559 HydrophobicContact CG2-CZ 4.28Å; I532-L565 HydrophobicContact CD1-CD1 4.37Å; I532-L565 HydrophobicContact CD1-CD2 3.44Å; I532-L565 VanDerWaalsContact CD1-CD2 3.44Å; I532-L565 HydrophobicContact CG1-CD1 4.04Å; I532-L565 HydrophobicContact CG1-CD2 4.02Å; I532-L565 HydrophobicContact CG2-CD1 4.25Å; I532-L565 HydrophobicContact CG2-CD2 4.4Å
533	Q	74.7	Confident	57.9	Low	107 Å²	107	98 Å²	98	50%	0.5	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	146.3	-172.5	-66.1	-175.7	-1.8	0	0	111.3	K502 I503 M535	K502-Q533 VanDerWaalsContact O-CA 3.24Å; K502-Q533 WeakPolarHBondContact O-CA 3.32Å; K502-Q533 VanDerWaalsContact O-CB 3.29Å; K502-Q533 WeakPolarHBondContact O-CB 3.11Å; K502-Q533 WeakPolarHBondContact O-CG 3.38Å; I503-Q533 HydrophobicContact CG1-CG 3.83Å; Q533-M535 PolarHBondContact O-N 3.26Å
534	L	65.8	Low	56.8	Low	17 Å²	17	105.8 Å²	105.8	9%	0.089	51%	0.513	C	S	.	.			trans	-74.1	111.8	163.4	-78.3	165.7	0	0	0	107	P500 P501 K502 I504 S536 E556 F559	P500-L534 HydrophobicContact CB-CD1 3.7Å; P501-L534 HydrophobicContact CG-CD1 4.32Å; P501-L534 WeakPolarHBondContact O-CD1 3.47Å; K502-L534 PolarHBondContact O-N 2.85Å; I504-L534 HydrophobicContact CD1-CD2 4.15Å; I504-L534 HydrophobicContact CD1-CG 3.9Å; I504-L534 HydrophobicContact CG1-CD1 4.41Å; I504-L534 HydrophobicContact CG1-CG 4Å; L534-S536 PolarHBondContact O-N 3.17Å; L534-E556 HydrophobicContact CD2-CB 4.09Å; L534-E556 HydrophobicContact CD2-CG 4.41Å; L534-E556 WeakPolarHBondContact CD2-O 3.15Å; L534-F559 HydrophobicContact CD2-CB 4.24Å; L534-F559 HydrophobicContact CD2-CD1 3.86Å
535	M	53.1	Low	55.4	Low	154 Å²	154	105.6 Å²	105.6	76%	0.759	51%	0.512	S	S	*	.			trans	-71.2	95.8	177.3	-69.4	-148.9	-61.2	0	0	109.8	Q533 N537	Q533-M535 PolarHBondContact O-N 3.26Å; M535-N537 PolarHBondContact O-N 2.95Å
536	S	45.4	Very low	54.3	Low	91 Å²	91	112.4 Å²	112.4	64%	0.636	55%	0.548	S	S	*	.			trans	-72.5	100.8	159.9	173.4	0	0	0	0	107	L534 G538 E556	L534-S536 PolarHBondContact O-N 3.17Å; S536-G538 PolarHBondContact O-N 3.16Å; S536-E556 WeakPolarHBondContact CA-OE1 3.28Å
537	N	39.1	Very low	53	Low	98 Å²	98	116.7 Å²	116.7	52%	0.524	56%	0.559	S	S	.	*			trans	-55.3	111.2	170.8	-81	-16.4	0	0	0	107.8	M535 R539	M535-N537 PolarHBondContact O-N 2.95Å; N537-R539 PolarHBondContact O-N 3.34Å; N537-R539 VanDerWaalsContact O-N 3.09Å
538	G	33.4	Very low	51.2	Low	67 Å²	67	111.7 Å²	111.7	69%	0.691	55%	0.547	S	S	*	.			trans	-50.1	121.1	178.2	0	0	0	0	0	109.2	S536 P540	S536-G538 PolarHBondContact O-N 3.16Å; G538-P540 VanDerWaalsContact O-N 3.16Å
539	R	31.1	Very low	49.5	Very low	235 Å²	235	114.8 Å²	114.8	89%	0.887	56%	0.564	S	S	*	*			trans	-4.1	102.2	176	-71.5	177.2	177	164.3	-0.5	112.9	N537	N537-R539 PolarHBondContact O-N 3.34Å; N537-R539 VanDerWaalsContact O-N 3.09Å
540	P	31.6	Very low	47.8	Very low	58 Å²	58	115.1 Å²	115.1	38%	0.377	56%	0.562	S	S	.	*			trans	-54.7	137.2	168.8	20.9	-28	0	0	0	107.7	G538 R542 V548	G538-P540 VanDerWaalsContact O-N 3.16Å; P540-R542 PolarHBondContact O-N 3.17Å; P540-V548 HydrophobicContact CG-CG1 4.35Å
541	P	33.2	Very low	46.3	Very low	84 Å²	84	115.8 Å²	115.8	55%	0.545	57%	0.572	S	S	.	*	S	Bend	trans	-61.5	103.7	-172.3	27	-30.7	0	0	0	108.4	R543	P541-R543 PolarHBondContact O-N 2.99Å
542	R	35.5	Very low	45	Very low	247 Å²	247	113.4 Å²	113.4	93%	0.932	56%	0.558	S	S	*	*	S	Bend	trans	18	68.9	166.4	-71.5	-178.8	171.8	168	-2	114.3	P540	P540-R542 PolarHBondContact O-N 3.17Å
543	R	37.8	Very low	43.7	Very low	191 Å²	191	116.6 Å²	116.6	72%	0.721	57%	0.573	S	S	*	*			trans	-106.4	117.4	150.7	-80.8	-173.2	175	178.1	-2	106.9	P541 S545	P541-R543 PolarHBondContact O-N 2.99Å; R543-S545 PolarHBondContact O-N 3.3Å
544	K	42.2	Very low	43.2	Very low	216 Å²	216	113.2 Å²	113.2	94%	0.939	56%	0.559	S	S	*	*			trans	-64.8	60.7	-175.6	-68.1	178.7	173.4	178.9	0	112.2
545	S	40.4	Very low	43	Very low	55 Å²	55	117.5 Å²	117.5	39%	0.385	58%	0.582	S	S	.	*			trans	-114.9	97.3	175.7	176.1	0	0	0	0	108.6	R543 K547 V548	R543-S545 PolarHBondContact O-N 3.3Å; S545-K547 PolarHBondContact O-N 3.22Å; S545-V548 PolarHBondContact O-N 3.01Å
546	N	44.5	Very low	43.6	Very low	147 Å²	147	111.7 Å²	111.7	79%	0.786	55%	0.553	S	S	*	*	H	α-helix	trans	-57.3	-13.7	174.7	-66.6	-5.2	0	0	0	113.3
547	K	40.3	Very low	44.8	Very low	166 Å²	166	108.5 Å²	108.5	72%	0.722	53%	0.528	S	S	*	.	H	α-helix	trans	-70	-35.3	177	-86.3	-172.6	172.5	-174.6	0	112.9	S545 D549 Y550 D551	S545-K547 PolarHBondContact O-N 3.22Å; K547-D549 VanDerWaalsContact C-N 3.34Å; K547-D549 PolarHBondContact O-N 3.17Å; K547-Y550 PolarHBondContact O-N 3.24Å; K547-D551 PolarHBondContact O-N 2.79Å
548	V	41.2	Very low	46.3	Very low	63 Å²	63	109.7 Å²	109.7	38%	0.382	53%	0.53	S	S	.	.	H	α-helix	trans	-67.3	-37.2	-174	-178.4	0	0	0	0	111.3	P540 S545 Y550 D551 I552	P540-V548 HydrophobicContact CG-CG1 4.35Å; S545-V548 PolarHBondContact O-N 3.01Å; V548-Y550 VanDerWaalsContact C-N 3.31Å; V548-Y550 PolarHBondContact O-N 3.15Å; V548-D551 PolarHBondContact O-N 2.88Å; V548-I552 HydrophobicContact CG1-CD1 3.96Å; V548-I552 WeakPolarHBondContact O-CG1 3.45Å; V548-I552 PolarHBondContact O-N 2.95Å
549	D	40	Very low	48	Very low	97 Å²	97	110 Å²	110	52%	0.519	51%	0.513	S	S	.	.	H	α-helix	trans	-64.9	-35.2	178.7	-73.8	-22.6	0	0	0	112.1	K547 Q553	K547-D549 VanDerWaalsContact C-N 3.34Å; K547-D549 PolarHBondContact O-N 3.17Å; D549-Q553 WeakPolarHBondContact O-CG 3.36Å; D549-Q553 PolarHBondContact O-N 2.91Å
550	Y	44.6	Very low	50.3	Low	139 Å²	139	98.9 Å²	98.9	55%	0.545	47%	0.471	S	S	.	.	H	α-helix	trans	-69.7	-41.6	179.3	-170.2	-93.7	0	0	0	112.4	K547 V548 I552 Q553 T554	K547-Y550 PolarHBondContact O-N 3.24Å; V548-Y550 VanDerWaalsContact C-N 3.31Å; V548-Y550 PolarHBondContact O-N 3.15Å; Y550-I552 VanDerWaalsContact C-N 3.33Å; Y550-I552 PolarHBondContact O-N 2.87Å; Y550-Q553 PolarHBondContact O-N 2.88Å; Y550-T554 HydrophobicContact CD1-CG2 4.33Å; Y550-T554 HydrophobicContact CE1-CG2 3.98Å; Y550-T554 WeakPolarHBondContact O-CG2 3.44Å; Y550-T554 PolarHBondContact O-N 2.95Å; Y550-T554 VanDerWaalsContact O-N 3.16Å; Y550-T554 PolarHBondContact O-OG1 2.88Å; Y550-T554 VanDerWaalsContact O-OG1 3.11Å
551	D	46.1	Very low	52.7	Low	96 Å²	96	99.4 Å²	99.4	51%	0.513	47%	0.467	S	S	.	.	H	α-helix	trans	-67.2	-34.4	179.2	-68.3	-22.4	0	0	0	111.7	K547 V548 T554 L555	K547-D551 PolarHBondContact O-N 2.79Å; V548-D551 PolarHBondContact O-N 2.88Å; D551-T554 WeakPolarHBondContact CA-OG1 3.38Å; D551-T554 PolarHBondContact O-OG1 3.38Å; D551-L555 PolarHBondContact O-N 2.77Å
552	I	47.2	Very low	55	Low	36 Å²	36	98.9 Å²	98.9	19%	0.185	46%	0.458	C	S	.	.	H	α-helix	trans	-69.8	-46.1	177	-65.4	169.7	0	0	0	111.1	V548 Y550 T554 L555 E556	V548-I552 HydrophobicContact CG1-CD1 3.96Å; V548-I552 WeakPolarHBondContact O-CG1 3.45Å; V548-I552 PolarHBondContact O-N 2.95Å; Y550-I552 VanDerWaalsContact C-N 3.33Å; Y550-I552 PolarHBondContact O-N 2.87Å; I552-T554 VanDerWaalsContact C-N 3.28Å; I552-T554 PolarHBondContact O-N 2.82Å; I552-L555 PolarHBondContact O-N 2.89Å; I552-E556 PolarHBondContact O-N 2.9Å
553	Q	51.8	Low	57.1	Low	85 Å²	85	87.3 Å²	87.3	40%	0.397	42%	0.415	S	S	.	.	H	α-helix	trans	-60	-40	179.6	-76	178	-17.8	0	0	111.9	D549 Y550 L555 E556 Q557	D549-Q553 WeakPolarHBondContact O-CG 3.36Å; D549-Q553 PolarHBondContact O-N 2.91Å; Y550-Q553 PolarHBondContact O-N 2.88Å; Q553-L555 PolarHBondContact O-N 2.74Å; Q553-E556 PolarHBondContact O-N 3.05Å; Q553-Q557 VanDerWaalsContact O-CG 3.28Å; Q553-Q557 WeakPolarHBondContact O-CG 3.49Å; Q553-Q557 PolarHBondContact O-N 2.81Å; Q553-Q557 VanDerWaalsContact O-N 3.1Å
554	T	62.4	Low	59	Low	35 Å²	35	81.3 Å²	81.3	22%	0.215	40%	0.397	C	S	.	.	H	α-helix	trans	-66.8	-35.9	177.6	51.3	0	0	0	0	112.9	Y550 D551 I552 Q558	Y550-T554 HydrophobicContact CD1-CG2 4.33Å; Y550-T554 HydrophobicContact CE1-CG2 3.98Å; Y550-T554 WeakPolarHBondContact O-CG2 3.44Å; Y550-T554 PolarHBondContact O-N 2.95Å; Y550-T554 VanDerWaalsContact O-N 3.16Å; Y550-T554 PolarHBondContact O-OG1 2.88Å; Y550-T554 VanDerWaalsContact O-OG1 3.11Å; D551-T554 WeakPolarHBondContact CA-OG1 3.38Å; D551-T554 PolarHBondContact O-OG1 3.38Å; I552-T554 VanDerWaalsContact C-N 3.28Å; I552-T554 PolarHBondContact O-N 2.82Å; T554-Q558 VanDerWaalsContact O-CG 3.26Å; T554-Q558 WeakPolarHBondContact O-CG 3.28Å; T554-Q558 PolarHBondContact O-N 3.39Å
555	L	61.8	Low	60.7	Low	107 Å²	107	72.6 Å²	72.6	56%	0.56	36%	0.36	S	S	*	.	H	α-helix	trans	-67.6	-44	174.5	-80.5	162.1	0	0	0	112.6	D551 I552 Q553 Q557 Q558 F559	D551-L555 PolarHBondContact O-N 2.77Å; I552-L555 PolarHBondContact O-N 2.89Å; Q553-L555 PolarHBondContact O-N 2.74Å; L555-Q557 VanDerWaalsContact C-N 3.31Å; L555-Q557 PolarHBondContact O-N 3.4Å; L555-Q558 WeakPolarHBondContact O-CB 3.34Å; L555-Q558 PolarHBondContact O-N 2.98Å; L555-Q558 VanDerWaalsContact O-N 3.16Å; L555-F559 PolarHBondContact O-N 3.15Å
556	E	67.2	Low	62.5	Low	33 Å²	33	73.6 Å²	73.6	15%	0.154	36%	0.361	C	S	.	.	H	α-helix	trans	-59.5	-44	176.8	-73.6	-177.2	171.3	0	0	111.2	L534 S536 I552 Q553 Q558 F559 L560	L534-E556 HydrophobicContact CD2-CB 4.09Å; L534-E556 HydrophobicContact CD2-CG 4.41Å; L534-E556 WeakPolarHBondContact CD2-O 3.15Å; S536-E556 WeakPolarHBondContact CA-OE1 3.28Å; I552-E556 PolarHBondContact O-N 2.9Å; Q553-E556 PolarHBondContact O-N 3.05Å; E556-Q558 VanDerWaalsContact C-N 3.35Å; E556-Q558 PolarHBondContact O-N 3.2Å; E556-F559 PolarHBondContact O-N 2.88Å; E556-L560 WeakPolarHBondContact O-CB 3.21Å; E556-L560 PolarHBondContact O-N 2.9Å
557	Q	68.9	Low	64.2	Low	24 Å²	24	67 Å²	67	11%	0.112	33%	0.325	C	S	.	.	H	α-helix	trans	-63.5	-39.1	175	-70.5	173.5	6.1	0	0	112.5	Q553 L555 K561 I582 D584	Q553-Q557 VanDerWaalsContact O-CG 3.28Å; Q553-Q557 WeakPolarHBondContact O-CG 3.49Å; Q553-Q557 PolarHBondContact O-N 2.81Å; Q553-Q557 VanDerWaalsContact O-N 3.1Å; L555-Q557 VanDerWaalsContact C-N 3.31Å; L555-Q557 PolarHBondContact O-N 3.4Å; Q557-K561 WeakPolarHBondContact O-CB 3.5Å; Q557-K561 VanDerWaalsContact O-CG 3.31Å; Q557-K561 WeakPolarHBondContact O-CG 3.3Å; Q557-K561 PolarHBondContact O-N 3.47Å; Q557-I582 HydrophobicContact CG-CG2 4.03Å; Q557-D584 PolarHBondContact NE2-OD1 2.69Å; Q557-D584 PolarHBondContact NE2-OD2 2.69Å
558	Q	71.4	Confident	65.8	Low	122 Å²	122	59.4 Å²	59.4	57%	0.57	29%	0.292	S	S	*	.	H	α-helix	trans	-64.3	-45.7	177.1	-78.7	175.2	6.8	0	0	111.3	T554 L555 E556 L560 K561 H562	T554-Q558 VanDerWaalsContact O-CG 3.26Å; T554-Q558 WeakPolarHBondContact O-CG 3.28Å; T554-Q558 PolarHBondContact O-N 3.39Å; L555-Q558 WeakPolarHBondContact O-CB 3.34Å; L555-Q558 PolarHBondContact O-N 2.98Å; L555-Q558 VanDerWaalsContact O-N 3.16Å; E556-Q558 VanDerWaalsContact C-N 3.35Å; E556-Q558 PolarHBondContact O-N 3.2Å; Q558-L560 PolarHBondContact O-N 2.91Å; Q558-K561 WeakPolarHBondContact O-CB 3.45Å; Q558-K561 PolarHBondContact O-N 3.01Å; Q558-K561 VanDerWaalsContact O-N 3.14Å; Q558-H562 PolarHBondContact O-N 3.45Å
559	F	69.9	Low	67.3	Low	73 Å²	73	59.4 Å²	59.4	32%	0.32	29%	0.29	S	S	.	.	H	α-helix	trans	-65.4	-38.7	178.6	-170.6	-107.4	0	0	0	112	I504 I532 L534 L555 E556 K561 H562 H576	I504-F559 HydrophobicContact CD1-CD1 3.57Å; I504-F559 HydrophobicContact CD1-CE1 3.5Å; I504-F559 VanDerWaalsContact CD1-CE1 3.5Å; I532-F559 HydrophobicContact CG2-CE1 4.13Å; I532-F559 HydrophobicContact CG2-CZ 4.28Å; L534-F559 HydrophobicContact CD2-CB 4.24Å; L534-F559 HydrophobicContact CD2-CD1 3.86Å; L555-F559 PolarHBondContact O-N 3.15Å; E556-F559 PolarHBondContact O-N 2.88Å; F559-K561 VanDerWaalsContact C-N 3.29Å; F559-K561 PolarHBondContact O-N 3.19Å; F559-H562 CarbonylContact O-C 3.59Å; F559-H562 VanDerWaalsContact O-C 3.31Å; F559-H562 PolarHBondContact O-N 2.77Å; F559-H576 PolarHBondContact O-NE2 2.84Å
560	L	77.9	Confident	68.8	Low	2 Å²	2	57.3 Å²	57.3	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-65.8	-32.3	173.8	-171.6	62.5	0	0	0	112.2	L213 P501 I504 E556 Q558 I582	L213-L560 HydrophobicContact CD2-CD1 4.3Å; P501-L560 HydrophobicContact CG-CD1 4.25Å; I504-L560 HydrophobicContact CD1-CD1 4.38Å; I504-L560 HydrophobicContact CG1-CD1 4.48Å; I504-L560 HydrophobicContact CG2-CD1 4Å; E556-L560 WeakPolarHBondContact O-CB 3.21Å; E556-L560 PolarHBondContact O-N 2.9Å; Q558-L560 PolarHBondContact O-N 2.91Å; L560-I582 HydrophobicContact CB-CD1 4.32Å; L560-I582 HydrophobicContact CD2-CD1 3.8Å; L560-I582 HydrophobicContact CG-CD1 4Å
561	K	82.4	Confident	70.3	Confident	69 Å²	69	50.7 Å²	50.7	30%	0.3	25%	0.251	S	S	.	.	H	α-helix	trans	-70.5	-41.4	174.9	-79.4	179.7	-176.1	164.6	0	112.8	Q557 Q558 F559 K577 T578 I582	Q557-K561 WeakPolarHBondContact O-CB 3.5Å; Q557-K561 VanDerWaalsContact O-CG 3.31Å; Q557-K561 WeakPolarHBondContact O-CG 3.3Å; Q557-K561 PolarHBondContact O-N 3.47Å; Q558-K561 WeakPolarHBondContact O-CB 3.45Å; Q558-K561 PolarHBondContact O-N 3.01Å; Q558-K561 VanDerWaalsContact O-N 3.14Å; F559-K561 VanDerWaalsContact C-N 3.29Å; F559-K561 PolarHBondContact O-N 3.19Å; K561-K577 CarbonylContact O-C 3.55Å; K561-K577 VanDerWaalsContact O-CA 3.27Å; K561-K577 WeakPolarHBondContact O-CA 3.4Å; K561-T578 HydrophobicContact CB-CG2 4.41Å; K561-T578 HydrophobicContact CG-CG2 4.18Å; K561-T578 PolarHBondContact O-N 3.08Å; K561-I582 HydrophobicContact CG-CD1 3.91Å
562	H	81.7	Confident	71.9	Confident	74 Å²	74	46.1 Å²	46.1	34%	0.343	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	127.7	-177.6	-179.7	-134.4	0	0	0	110.3	Q558 F559 E575 H576	Q558-H562 PolarHBondContact O-N 3.45Å; F559-H562 CarbonylContact O-C 3.59Å; F559-H562 VanDerWaalsContact O-C 3.31Å; F559-H562 PolarHBondContact O-N 2.77Å; H562-E575 IonicContact CD2-OE1 3.09Å; H562-E575 IonicContact CE1-OE1 3.61Å; H562-E575 IonicContact NE2-OE1 3.52Å; H562-E575 PolarHBondContact NE2-OE1 3.24Å; H562-H576 WeakPolarHBondContact CA-O 3.33Å; H562-H576 PolarHBondContact CD2-O 2.82Å; H562-H576 VanDerWaalsContact CD2-O 3.31Å
563	G	80.3	Confident	73.7	Confident	4 Å²	4	47.5 Å²	47.5	4%	0.041	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	146.6	172.9	0	0	0	0	0	111.7	E575 H576	G563-E575 WeakPolarHBondContact O-CA 3.49Å; G563-H576 WeakPolarHBondContact CA-CE1 3.34Å; G563-H576 PolarHBondContact N-CE1 3.06Å; G563-H576 PolarHBondContact N-NE2 3.33Å; G563-H576 PolarHBondContact N-O 2.66Å; G563-H576 VanDerWaalsContact N-O 3.09Å; G563-H576 PolarHBondContact O-N 2.8Å; G563-H576 PolarHBondContact O-ND1 3.31Å
564	I	76.7	Confident	75.2	Confident	65 Å²	65	43.4 Å²	43.4	33%	0.333	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	131.9	-178.7	-59.2	172.4	0	0	0	107.7	W138 L566 Y573 L574 E575	W138-I564 HydrophobicContact CH2-CD1 4.33Å; W138-I564 HydrophobicContact CZ2-CD1 4.14Å; I564-L566 HydrophobicContact CG2-CD2 4.18Å; I564-Y573 HydrophobicContact CG2-CD1 4.38Å; I564-L574 CarbonylContact C-O 3.58Å; I564-L574 WeakPolarHBondContact CA-O 3.13Å; I564-E575 HydrophobicContact CG1-CB 4.37Å; I564-E575 HydrophobicContact CG1-CG 4.1Å
565	L	79	Confident	76.4	Confident	33 Å²	33	43.7 Å²	43.7	17%	0.173	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132.6	175.2	-71.8	134.2	0	0	0	109.2	Y505 I507 I532 Y573 L574	Y505-L565 HydrophobicContact CE2-CD1 3.73Å; Y505-L565 WeakPolarHBondContact OH-CD1 3.45Å; I507-L565 HydrophobicContact CD1-CD1 4.2Å; I532-L565 HydrophobicContact CD1-CD1 4.37Å; I532-L565 HydrophobicContact CD1-CD2 3.44Å; I532-L565 VanDerWaalsContact CD1-CD2 3.44Å; I532-L565 HydrophobicContact CG1-CD1 4.04Å; I532-L565 HydrophobicContact CG1-CD2 4.02Å; I532-L565 HydrophobicContact CG2-CD1 4.25Å; I532-L565 HydrophobicContact CG2-CD2 4.4Å; L565-Y573 WeakPolarHBondContact O-CA 3.34Å; L565-L574 HydrophobicContact CB-CB 4.32Å; L565-L574 HydrophobicContact CD1-CD2 3.89Å; L565-L574 PolarHBondContact N-O 2.78Å; L565-L574 PolarHBondContact O-N 2.84Å
566	L	78.1	Confident	77.6	Confident	76 Å²	76	38.6 Å²	38.6	40%	0.398	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	121.6	177.6	-53.8	-179.2	0	0	0	108.3	I564 E570 Y573	I564-L566 HydrophobicContact CG2-CD2 4.18Å; L566-E570 HydrophobicContact CB-CG 4.35Å; L566-E570 HydrophobicContact CD1-CG 3.97Å; L566-Y573 HydrophobicContact CD2-CD1 3.13Å; L566-Y573 HydrophobicContact CD2-CE1 3.25Å; L566-Y573 HydrophobicContact CD2-CG 4.06Å
567	L	78.8	Confident	78.5	Confident	8 Å²	8	42.5 Å²	42.5	4%	0.042	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	155	179.4	-57.2	176.4	0	0	0	109.1	I507 Y530 N569 E570 N571 I572	I507-L567 HydrophobicContact CD1-CD2 4.49Å; I507-L567 HydrophobicContact CG2-CD1 4.27Å; Y530-L567 HydrophobicContact CD2-CD2 4.22Å; Y530-L567 HydrophobicContact CE2-CD2 4.1Å; L567-N569 PolarHBondContact O-N 3.34Å; L567-E570 PolarHBondContact O-N 3.23Å; L567-N571 PolarHBondContact O-N 3.41Å; L567-I572 HydrophobicContact CB-CB 4.27Å; L567-I572 HydrophobicContact CB-CG2 4.49Å; L567-I572 PolarHBondContact N-O 3.03Å; L567-I572 PolarHBondContact O-N 3.35Å
568	W	74.8	Confident	79.4	Confident	6 Å²	6	41.8 Å²	41.8	2%	0.023	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	57.8	174.1	-59.5	95.7	0	0	0	113.1	T509 L511 L528 E570 N571 I572 L702 T705 A706 L709	T509-W568 HydrophobicContact CG2-CZ2 4.12Å; T509-W568 PolarHBondContact OG1-NE1 3.21Å; L511-W568 HydrophobicContact CB-CH2 4Å; L511-W568 HydrophobicContact CB-CZ2 4.44Å; L511-W568 HydrophobicContact CB-CZ3 4.43Å; L528-W568 HydrophobicContact CD1-CH2 4.06Å; L528-W568 HydrophobicContact CD1-CZ2 4.16Å; L528-W568 HydrophobicContact CD1-CZ3 4.41Å; W568-E570 VanDerWaalsContact C-N 3.33Å; W568-E570 PolarHBondContact O-N 2.98Å; W568-N571 VanDerWaalsContact O-CB 3.3Å; W568-N571 WeakPolarHBondContact O-CB 3.4Å; W568-N571 PolarHBondContact O-N 2.84Å; W568-N571 PolarHBondContact O-ND2 2.82Å; W568-I572 HydrophobicContact CB-CD1 4.44Å; W568-I572 HydrophobicContact CG-CD1 4.26Å; W568-L702 HydrophobicContact CB-CD2 4.11Å; W568-T705 VanDerWaalsContact C-CG2 3.49Å; W568-T705 HydrophobicContact CB-CG2 4.25Å; W568-T705 HydrophobicContact CE3-CG2 4.19Å; W568-A706 HydrophobicContact CE3-CB 4.42Å; W568-A706 HydrophobicContact CZ3-CB 3.67Å; W568-L709 HydrophobicContact CE3-CD1 4.05Å; W568-L709 HydrophobicContact CZ3-CD1 4.3Å
569	N	71.4	Confident	80	Confident	64 Å²	64	37.7 Å²	37.7	34%	0.342	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	49.7	179	-165.9	46.4	0	0	0	112.4	L567 N571 H700 T705	L567-N569 PolarHBondContact O-N 3.34Å; N569-N571 PolarHBondContact O-N 3.41Å; N569-N571 VanDerWaalsContact O-N 3.08Å; N569-H700 PolarHBondContact ND2-CD2 2.8Å; N569-T705 HydrophobicContact CB-CG2 3.59Å
570	E	72.6	Confident	80.7	Confident	52 Å²	52	34.5 Å²	34.5	24%	0.243	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	5.8	178.2	-45.9	-176.9	179.1	0	0	115.4	L566 L567 W568 I572 Y573	L566-E570 HydrophobicContact CB-CG 4.35Å; L566-E570 HydrophobicContact CD1-CG 3.97Å; L567-E570 PolarHBondContact O-N 3.23Å; W568-E570 VanDerWaalsContact C-N 3.33Å; W568-E570 PolarHBondContact O-N 2.98Å; E570-I572 VanDerWaalsContact C-N 3.27Å; E570-I572 PolarHBondContact O-N 2.79Å; E570-Y573 WeakPolarHBondContact O-CE2 3.44Å; E570-Y573 VanDerWaalsContact O-CZ 3.26Å; E570-Y573 PolarHBondContact O-OH 2.9Å
571	N	75.7	Confident	81.2	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-23.5	176.4	-70.2	-47.4	0	0	0	112.8	L567 W568 N569 S696 H697 I698 N699 H700 L702	L567-N571 PolarHBondContact O-N 3.41Å; W568-N571 VanDerWaalsContact O-CB 3.3Å; W568-N571 WeakPolarHBondContact O-CB 3.4Å; W568-N571 PolarHBondContact O-N 2.84Å; W568-N571 PolarHBondContact O-ND2 2.82Å; N569-N571 PolarHBondContact O-N 3.41Å; N569-N571 VanDerWaalsContact O-N 3.08Å; N571-S696 CarbonylContact O-C 3.54Å; N571-S696 WeakPolarHBondContact O-CA 3.39Å; N571-H697 WeakPolarHBondContact CA-O 3.26Å; N571-H697 CarbonylContact O-C 3.57Å; N571-H697 PolarHBondContact O-N 3.49Å; N571-I698 HydrophobicContact CB-CG1 4.46Å; N571-I698 WeakPolarHBondContact OD1-CA 3.26Å; N571-N699 PolarHBondContact OD1-N 2.94Å; N571-H700 PolarHBondContact ND2-O 3.42Å; N571-H700 PolarHBondContact OD1-N 3.4Å; N571-H700 PolarHBondContact OD1-O 2.94Å; N571-L702 HydrophobicContact CB-CD2 3.74Å
572	I	80.8	Confident	81.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	126.6	-177	-63.1	169.4	0	0	0	110	L196 V204 I206 L567 W568 E570 I694 L702	L196-I572 HydrophobicContact CD1-CD1 3.69Å; L196-I572 HydrophobicContact CD1-CG1 4.02Å; L196-I572 HydrophobicContact CD1-CG2 4.3Å; V204-I572 HydrophobicContact CB-CD1 4.13Å; V204-I572 HydrophobicContact CG1-CD1 3.7Å; V204-I572 HydrophobicContact CG2-CD1 4.15Å; I206-I572 HydrophobicContact CD1-CD1 4.45Å; I206-I572 HydrophobicContact CD1-CG2 3.79Å; L567-I572 HydrophobicContact CB-CB 4.27Å; L567-I572 HydrophobicContact CB-CG2 4.49Å; L567-I572 PolarHBondContact N-O 3.03Å; L567-I572 PolarHBondContact O-N 3.35Å; W568-I572 HydrophobicContact CB-CD1 4.44Å; W568-I572 HydrophobicContact CG-CD1 4.26Å; E570-I572 VanDerWaalsContact C-N 3.27Å; E570-I572 PolarHBondContact O-N 2.79Å; I572-I694 HydrophobicContact CG2-CG2 3.71Å; I572-L702 HydrophobicContact CD1-CD2 4.37Å
573	Y	83.4	Confident	81.8	Confident	65 Å²	65	30.5 Å²	30.5	26%	0.255	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	123.9	179.2	-56.6	-103.3	0	0	0	108.1	I564 L565 L566 E570 I694 K695 H697	I564-Y573 HydrophobicContact CG2-CD1 4.38Å; L565-Y573 WeakPolarHBondContact O-CA 3.34Å; L566-Y573 HydrophobicContact CD2-CD1 3.13Å; L566-Y573 HydrophobicContact CD2-CE1 3.25Å; L566-Y573 HydrophobicContact CD2-CG 4.06Å; E570-Y573 WeakPolarHBondContact O-CE2 3.44Å; E570-Y573 VanDerWaalsContact O-CZ 3.26Å; E570-Y573 PolarHBondContact O-OH 2.9Å; Y573-I694 CarbonylContact O-C 3.57Å; Y573-I694 VanDerWaalsContact O-CA 3.29Å; Y573-I694 WeakPolarHBondContact O-CA 2.96Å; Y573-K695 PolarHBondContact N-O 3.28Å; Y573-K695 PolarHBondContact O-N 2.97Å; Y573-H697 HydrophobicContact CD2-CB 4.47Å; Y573-H697 HydrophobicContact CE2-CB 3.8Å
574	L	84.7	Confident	82.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	110.9	166.3	-174.9	156.2	0	0	0	107.9	V208 Y505 I507 I564 L565 I692 I694	V208-L574 HydrophobicContact CG2-CD1 3.69Å; Y505-L574 HydrophobicContact CE2-CD2 4.12Å; I507-L574 HydrophobicContact CD1-CD1 3.91Å; I507-L574 HydrophobicContact CG1-CD1 4.32Å; I564-L574 CarbonylContact C-O 3.58Å; I564-L574 WeakPolarHBondContact CA-O 3.13Å; L565-L574 HydrophobicContact CB-CB 4.32Å; L565-L574 HydrophobicContact CD1-CD2 3.89Å; L565-L574 PolarHBondContact N-O 2.78Å; L565-L574 PolarHBondContact O-N 2.84Å; L574-I692 HydrophobicContact CD1-CG2 4.22Å; L574-I692 HydrophobicContact CD2-CG2 3.97Å; L574-I692 HydrophobicContact CG-CG2 3.91Å; L574-I694 HydrophobicContact CD1-CD1 4.42Å; L574-I694 HydrophobicContact CG-CG1 4.42Å
575	E	86.1	Confident	82.9	Confident	40 Å²	40	32.2 Å²	32.2	19%	0.187	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.2	177.7	-180	175.5	-166	0	0	108.8	H562 G563 I564 I692 E693 K695	H562-E575 IonicContact CD2-OE1 3.09Å; H562-E575 IonicContact CE1-OE1 3.61Å; H562-E575 IonicContact NE2-OE1 3.52Å; H562-E575 PolarHBondContact NE2-OE1 3.24Å; G563-E575 WeakPolarHBondContact O-CA 3.49Å; I564-E575 HydrophobicContact CG1-CB 4.37Å; I564-E575 HydrophobicContact CG1-CG 4.1Å; E575-I692 WeakPolarHBondContact O-CA 3.35Å; E575-E693 PolarHBondContact N-O 3.22Å; E575-E693 PolarHBondContact O-N 3.01Å; E575-K695 IonicContact OE2-NZ 3.92Å; E575-K695 PolarHBondContact OE2-NZ 3.18Å
576	H	87.3	Confident	83.7	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	143.9	169.4	72.9	-90.6	0	0	0	110.2	L213 Y505 F559 H562 G563 T691 I692	L213-H576 HydrophobicContact CD1-CB 3.73Å; L213-H576 HydrophobicContact CD2-CB 4.31Å; L213-H576 WeakPolarHBondContact CD2-CD2 3.41Å; Y505-H576 HydrophobicContact CE1-CB 4.37Å; Y505-H576 AromaticContact CE1-ND1 3.96Å; Y505-H576 AromaticContact CZ-ND1 3.8Å; Y505-H576 PolarHBondContact OH-CE1 3.36Å; Y505-H576 PolarHBondContact OH-ND1 3.37Å; F559-H576 PolarHBondContact O-NE2 2.84Å; H562-H576 WeakPolarHBondContact CA-O 3.33Å; H562-H576 PolarHBondContact CD2-O 2.82Å; H562-H576 VanDerWaalsContact CD2-O 3.31Å; G563-H576 WeakPolarHBondContact CA-CE1 3.34Å; G563-H576 PolarHBondContact N-CE1 3.06Å; G563-H576 PolarHBondContact N-NE2 3.33Å; G563-H576 PolarHBondContact N-O 2.66Å; G563-H576 VanDerWaalsContact N-O 3.09Å; G563-H576 PolarHBondContact O-N 2.8Å; G563-H576 PolarHBondContact O-ND1 3.31Å; H576-T691 WeakPolarHBondContact CA-O 2.97Å; H576-I692 HydrophobicContact CB-CG1 4.19Å
577	K	86.9	Confident	84.6	Confident	116 Å²	116	27 Å²	27	50%	0.504	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	137.6	179.4	-171.9	173.5	-179.2	172.7	0	110.6	K561 S690 T691	K561-K577 CarbonylContact O-C 3.55Å; K561-K577 VanDerWaalsContact O-CA 3.27Å; K561-K577 WeakPolarHBondContact O-CA 3.4Å; K577-S690 CarbonylContact O-C 3.49Å; K577-S690 WeakPolarHBondContact O-CA 3.44Å; K577-T691 PolarHBondContact N-O 3Å; K577-T691 PolarHBondContact O-N 3.39Å
578	T	86.5	Confident	85.4	Confident	8 Å²	8	26.7 Å²	26.7	5%	0.049	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.4	164.5	-174.6	0	0	0	0	111.2	K561 L580 I582 S690	K561-T578 HydrophobicContact CB-CG2 4.41Å; K561-T578 HydrophobicContact CG-CG2 4.18Å; K561-T578 PolarHBondContact O-N 3.08Å; T578-L580 VanDerWaalsContact C-N 3.26Å; T578-L580 PolarHBondContact OG1-N 3.31Å; T578-I582 HydrophobicContact CG2-CD1 4.25Å; T578-S690 VanDerWaalsContact CB-OG 3.32Å; T578-S690 WeakPolarHBondContact CB-OG 3.29Å; T578-S690 PolarHBondContact OG1-OG 3.17Å
579	G	84	Confident	86.4	Confident	37 Å²	37	28.4 Å²	28.4	38%	0.381	15%	0.145	S	C	.	.			trans	-78.4	-9.6	173.3	0	0	0	0	0	113.7	K688 R689	G579-K688 WeakPolarHBondContact O-CD 3.37Å; G579-R689 PolarHBondContact N-O 3.14Å; G579-R689 VanDerWaalsContact N-O 3.16Å
580	L	85.9	Confident	87.5	Confident	6 Å²	6	28.9 Å²	28.9	3%	0.031	14%	0.142	C	C	.	.	S	Bend	trans	-77.6	135	-177.3	-78.4	169.2	0	0	0	111.2	P215 T578 V663 V665 N685 K688	P215-L580 HydrophobicContact CG-CB 3.96Å; P215-L580 HydrophobicContact CG-CD1 4.04Å; T578-L580 VanDerWaalsContact C-N 3.26Å; T578-L580 PolarHBondContact OG1-N 3.31Å; L580-V663 HydrophobicContact CD2-CG1 3.93Å; L580-V665 HydrophobicContact CD2-CG1 4.23Å; L580-N685 HydrophobicContact CD1-CB 4.47Å; L580-N685 HydrophobicContact CD2-CB 3.57Å; L580-N685 HydrophobicContact CG-CB 4.28Å; L580-K688 HydrophobicContact CD2-CB 4.16Å; L580-K688 HydrophobicContact CG-CB 4.3Å
581	P	87.4	Confident	88.4	Confident	24 Å²	24	27.4 Å²	27.4	16%	0.156	14%	0.138	C	C	.	.			trans	-66.6	143	168.2	29.3	-31.7	0	0	0	110	W583 V663	P581-W583 HydrophobicContact CB-CD2 4.5Å; P581-W583 HydrophobicContact CB-CH2 4.1Å; P581-W583 HydrophobicContact CB-CZ2 3.68Å; P581-W583 HydrophobicContact CG-CH2 3.69Å; P581-W583 HydrophobicContact CG-CZ2 3.78Å; P581-W583 HydrophobicContact CG-CZ3 4.25Å; P581-V663 HydrophobicContact CG-CG2 3.63Å
582	I	87.9	Confident	89	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.01	16%	0.156	C	C	.	.			trans	-120.1	127.6	173.6	-62.6	161.7	0	0	0	105.7	P215 H498 Q557 L560 K561 T578	P215-I582 HydrophobicContact CB-CG1 4.22Å; P215-I582 HydrophobicContact CG-CD1 4.37Å; P215-I582 HydrophobicContact CG-CG1 3.89Å; H498-I582 HydrophobicContact CB-CG2 4.49Å; H498-I582 VanDerWaalsContact CD2-CG2 3.46Å; H498-I582 WeakPolarHBondContact CD2-CG2 3.44Å; Q557-I582 HydrophobicContact CG-CG2 4.03Å; L560-I582 HydrophobicContact CB-CD1 4.32Å; L560-I582 HydrophobicContact CD2-CD1 3.8Å; L560-I582 HydrophobicContact CG-CD1 4Å; K561-I582 HydrophobicContact CG-CD1 3.91Å; T578-I582 HydrophobicContact CG2-CD1 4.25Å
583	W	90.1	Very high	89.3	Confident	34 Å²	34	36.7 Å²	36.7	13%	0.129	19%	0.19	C	C	.	.			trans	-127.1	143.5	177.7	-59.4	-60	0	0	0	108	Y217 H498 P581 A586 L598 Q600 T661 V663	Y217-W583 VanDerWaalsContact CE1-O 3.26Å; Y217-W583 WeakPolarHBondContact CE1-O 3.31Å; Y217-W583 PolarHBondContact OH-N 3.48Å; Y217-W583 PolarHBondContact OH-O 2.92Å; H498-W583 WeakPolarHBondContact CB-O 3.45Å; P581-W583 HydrophobicContact CB-CD2 4.5Å; P581-W583 HydrophobicContact CB-CH2 4.1Å; P581-W583 HydrophobicContact CB-CZ2 3.68Å; P581-W583 HydrophobicContact CG-CH2 3.69Å; P581-W583 HydrophobicContact CG-CZ2 3.78Å; P581-W583 HydrophobicContact CG-CZ3 4.25Å; W583-A586 HydrophobicContact CB-CB 4.45Å; W583-A586 HydrophobicContact CE3-CB 4.12Å; W583-L598 HydrophobicContact CE3-CD2 3.91Å; W583-L598 HydrophobicContact CE3-CG 4.11Å; W583-L598 HydrophobicContact CZ3-CB 4.37Å; W583-L598 HydrophobicContact CZ3-CD2 3.77Å; W583-L598 HydrophobicContact CZ3-CG 3.77Å; W583-Q600 HydrophobicContact CB-CG 4.47Å; W583-Q600 HydrophobicContact CD2-CB 3.78Å; W583-Q600 HydrophobicContact CD2-CG 4.05Å; W583-Q600 HydrophobicContact CE3-CB 4.19Å; W583-Q600 HydrophobicContact CG-CB 4.15Å; W583-Q600 HydrophobicContact CG-CG 3.86Å; W583-Q600 HydrophobicContact CH2-CB 4.41Å; W583-Q600 HydrophobicContact CZ2-CB 4.01Å; W583-Q600 HydrophobicContact CZ3-CB 4.49Å; W583-T661 WeakPolarHBondContact CH2-O 3.33Å; W583-T661 HydrophobicContact CZ2-CG2 4.49Å; W583-V663 HydrophobicContact CH2-CG2 4.28Å
584	D	88.7	Confident	89.4	Confident	44 Å²	44	40.2 Å²	40.2	24%	0.235	21%	0.206	C	C	.	.	S	Bend	trans	-62.3	-49.1	178	-66	-56.9	0	0	0	111.5	Q497 H498 Q557	Q497-D584 CarbonylContact C-O 3.57Å; Q497-D584 VanDerWaalsContact CA-O 3.27Å; Q497-D584 WeakPolarHBondContact CA-O 3.22Å; Q497-D584 WeakPolarHBondContact CG-O 3.49Å; H498-D584 PolarHBondContact N-O 2.87Å; Q557-D584 PolarHBondContact NE2-OD1 2.69Å; Q557-D584 PolarHBondContact NE2-OD2 2.69Å
585	D	91.5	Very high	89.6	Confident	62 Å²	62	45.4 Å²	45.4	33%	0.332	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.3	174.7	-62.8	-54	0	0	0	109.7	H495 L601	H495-D585 IonicContact NE2-OD1 3.1Å; D585-L601 HydrophobicContact CB-CB 4.28Å; D585-L601 HydrophobicContact CB-CD2 4.01Å; D585-L601 PolarHBondContact O-N 3.1Å
586	A	95.5	Very high	89.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	165.9	-177.3	0	0	0	0	0	111.2	Y217 V496 W583 L598 F599	Y217-A586 HydrophobicContact CD1-CB 4.31Å; Y217-A586 HydrophobicContact CE1-CB 3.73Å; V496-A586 HydrophobicContact CG2-CB 3.98Å; V496-A586 WeakPolarHBondContact CG2-O 3.5Å; V496-A586 PolarHBondContact N-O 2.88Å; V496-A586 PolarHBondContact O-N 2.79Å; V496-A586 VanDerWaalsContact O-O 3.08Å; W583-A586 HydrophobicContact CB-CB 4.45Å; W583-A586 HydrophobicContact CE3-CB 4.12Å; A586-L598 HydrophobicContact CB-CD1 3.77Å; A586-L598 HydrophobicContact CB-CG 4.2Å; A586-F599 CarbonylContact C-O 3.56Å; A586-F599 WeakPolarHBondContact CA-O 3.35Å; A586-F599 WeakPolarHBondContact CB-O 3.42Å
587	I	96.9	Very high	90.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	120.8	177	-62.5	-67.5	0	0	0	108.6	L258 T493 C494 H495 L598 F599 L601 I656 Y657	L258-I587 HydrophobicContact CD1-CD1 3.64Å; T493-I587 HydrophobicContact CG2-CG2 3.17Å; C494-I587 WeakPolarHBondContact O-CA 3.38Å; H495-I587 HydrophobicContact CB-CD1 4.18Å; I587-L598 WeakPolarHBondContact O-CA 2.99Å; I587-F599 HydrophobicContact CB-CB 4.46Å; I587-F599 PolarHBondContact N-O 2.03Å; I587-F599 PolarHBondContact O-N 2.9Å; I587-L601 HydrophobicContact CD1-CD1 3.98Å; I587-L601 HydrophobicContact CG1-CD1 3.96Å; I587-I656 HydrophobicContact CD1-CG2 4.2Å; I587-I656 HydrophobicContact CG1-CG2 4.36Å; I587-Y657 HydrophobicContact CB-CD1 4.21Å; I587-Y657 HydrophobicContact CB-CG 4.38Å; I587-Y657 HydrophobicContact CG1-CD1 4.46Å; I587-Y657 HydrophobicContact CG2-CD1 3.66Å; I587-Y657 HydrophobicContact CG2-CE1 4.31Å; I587-Y657 HydrophobicContact CG2-CG 4.26Å
588	V	95.5	Very high	90.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	124.6	168.6	172.7	0	0	0	0	107.9	T493 C494 V496 I596 S597 L598 Y681	T493-V588 CarbonylContact C-O 3.54Å; T493-V588 WeakPolarHBondContact CA-O 3.26Å; C494-V588 PolarHBondContact N-O 3.02Å; C494-V588 PolarHBondContact O-N 2.81Å; V496-V588 HydrophobicContact CB-CG2 4.47Å; V496-V588 HydrophobicContact CG1-CB 4.31Å; V496-V588 HydrophobicContact CG1-CG2 3.84Å; V496-V588 HydrophobicContact CG2-CG2 3.74Å; V588-I596 HydrophobicContact CG1-CG2 3.72Å; V588-S597 WeakPolarHBondContact CA-O 3.11Å; V588-L598 HydrophobicContact CG2-CD1 3.71Å; V588-Y681 HydrophobicContact CG1-CD1 4.46Å; V588-Y681 HydrophobicContact CG1-CE1 4.06Å
589	H	95.3	Very high	91.1	Very high	43 Å²	43	39.6 Å²	39.6	20%	0.199	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	127.1	177.3	171.7	-99.9	0	0	0	110	Y492 S597 F599	Y492-H589 WeakPolarHBondContact O-CA 3.35Å; H589-S597 PolarHBondContact N-O 2.63Å; H589-S597 PolarHBondContact ND1-OG 2.79Å; H589-S597 PolarHBondContact O-N 3.25Å; H589-S597 PolarHBondContact O-OG 3.37Å; H589-F599 HydrophobicContact CB-CD2 4.2Å; H589-F599 HydrophobicContact CB-CE2 3.87Å
590	R	94.4	Very high	91.7	Very high	73 Å²	73	40.3 Å²	40.3	28%	0.275	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	122.3	173.3	-174.9	-179.6	-175.3	-163.4	9.1	109.8	T491 Y492 E595 I596	T491-R590 VanDerWaalsContact CA-O 3.26Å; T491-R590 WeakPolarHBondContact CA-O 3.49Å; T491-R590 WeakPolarHBondContact CB-O 3.26Å; Y492-R590 HydrophobicContact CD1-CB 3.83Å; Y492-R590 HydrophobicContact CE1-CB 3.65Å; Y492-R590 VanDerWaalsContact CE1-CD 3.4Å; Y492-R590 HydrophobicContact CE1-CG 4.19Å; Y492-R590 HydrophobicContact CG-CB 4.39Å; Y492-R590 PolarHBondContact N-O 2.87Å; Y492-R590 PolarHBondContact O-N 2.81Å; R590-E595 CarbonylContact C-O 3.52Å; R590-E595 WeakPolarHBondContact CA-O 3.09Å; R590-I596 HydrophobicContact CG-CG1 4.49Å
591	S	91.7	Very high	92.1	Very high	22 Å²	22	41.1 Å²	41.1	15%	0.154	20%	0.203	C	C	.	.			trans	-79.8	172.4	178	73.6	0	0	0	0	112.8	T491 D593 K594 E595	T491-S591 VanDerWaalsContact CG2-C 3.48Å; S591-D593 PolarHBondContact O-N 3.22Å; S591-D593 PolarHBondContact OG-N 3.31Å; S591-K594 WeakPolarHBondContact O-CA 3.42Å; S591-K594 PolarHBondContact O-N 3.18Å; S591-E595 PolarHBondContact N-O 3.43Å; S591-E595 WeakPolarHBondContact OG-CB 3.28Å; S591-E595 PolarHBondContact OG-N 3.09Å; S591-E595 PolarHBondContact OG-O 2.9Å
592	V	88.6	Confident	92.4	Very high	64 Å²	64	41.3 Å²	41.3	39%	0.388	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-37.4	174.3	177.2	0	0	0	0	111.1	N489 T491 K594	N489-V592 HydrophobicContact CB-CG1 4.01Å; N489-V592 WeakPolarHBondContact ND2-CG1 3.37Å; T491-V592 HydrophobicContact CG2-CB 4.27Å; T491-V592 HydrophobicContact CG2-CG2 3.5Å; T491-V592 VanDerWaalsContact CG2-N 3.31Å; V592-K594 PolarHBondContact O-N 3.26Å; V592-K594 VanDerWaalsContact O-N 3.09Å
593	D	86.5	Confident	92.5	Very high	130 Å²	130	46 Å²	46	70%	0.695	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	8.8	176.8	-52.9	-50.3	0	0	0	112.9	S591 E595	S591-D593 PolarHBondContact O-N 3.22Å; S591-D593 PolarHBondContact OG-N 3.31Å; D593-E595 HydrophobicContact CB-CG 4.3Å; D593-E595 PolarHBondContact O-N 3.04Å
594	K	85.5	Confident	92.3	Very high	140 Å²	140	48.9 Å²	48.9	61%	0.609	24%	0.24	S	C	*	.			trans	63.1	13.2	-177.3	-52.2	174.9	-177.6	172.1	0	114	S591 V592	S591-K594 WeakPolarHBondContact O-CA 3.42Å; S591-K594 PolarHBondContact O-N 3.18Å; V592-K594 PolarHBondContact O-N 3.26Å; V592-K594 VanDerWaalsContact O-N 3.09Å
595	E	90	Very high	92.3	Very high	108 Å²	108	55 Å²	55	51%	0.505	26%	0.264	S	S	.	.			trans	-70.3	138	171.7	-59.7	-172.1	157.9	0	0	110.1	R590 S591 D593	R590-E595 CarbonylContact C-O 3.52Å; R590-E595 WeakPolarHBondContact CA-O 3.09Å; S591-E595 PolarHBondContact N-O 3.43Å; S591-E595 WeakPolarHBondContact OG-CB 3.28Å; S591-E595 PolarHBondContact OG-N 3.09Å; S591-E595 PolarHBondContact OG-O 2.9Å; D593-E595 HydrophobicContact CB-CG 4.3Å; D593-E595 PolarHBondContact O-N 3.04Å
596	I	92.7	Very high	92.2	Very high	23 Å²	23	55.3 Å²	55.3	12%	0.118	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	135.4	175.3	-57	178.4	0	0	0	108.1	V588 R590 V665 T667	V588-I596 HydrophobicContact CG1-CG2 3.72Å; R590-I596 HydrophobicContact CG-CG1 4.49Å; I596-V665 HydrophobicContact CB-CG2 4.34Å; I596-V665 HydrophobicContact CG2-CG2 3.85Å; I596-V665 PolarHBondContact O-N 2.97Å; I596-T667 HydrophobicContact CD1-CG2 3.64Å
597	S	94.5	Very high	91.9	Very high	4 Å²	4	55.7 Å²	55.7	3%	0.028	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	141.1	178.7	45.8	0	0	0	0	109.9	V588 H589 F599 V663	V588-S597 WeakPolarHBondContact CA-O 3.11Å; H589-S597 PolarHBondContact N-O 2.63Å; H589-S597 PolarHBondContact ND1-OG 2.79Å; H589-S597 PolarHBondContact O-N 3.25Å; H589-S597 PolarHBondContact O-OG 3.37Å; S597-F599 VanDerWaalsContact OG-CE2 3.28Å; S597-F599 WeakPolarHBondContact OG-CE2 3.31Å; S597-V663 CarbonylContact C-O 3.55Å; S597-V663 WeakPolarHBondContact CA-O 3.36Å
598	L	95.2	Very high	91.4	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.026	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	135.7	174.1	-167.3	74	0	0	0	108.8	Y217 V496 W583 A586 I587 V588 V663 V665 L683	Y217-L598 HydrophobicContact CE2-CD2 4.03Å; V496-L598 HydrophobicContact CG2-CD1 4.36Å; W583-L598 HydrophobicContact CE3-CD2 3.91Å; W583-L598 HydrophobicContact CE3-CG 4.11Å; W583-L598 HydrophobicContact CZ3-CB 4.37Å; W583-L598 HydrophobicContact CZ3-CD2 3.77Å; W583-L598 HydrophobicContact CZ3-CG 3.77Å; A586-L598 HydrophobicContact CB-CD1 3.77Å; A586-L598 HydrophobicContact CB-CG 4.2Å; I587-L598 WeakPolarHBondContact O-CA 2.99Å; V588-L598 HydrophobicContact CG2-CD1 3.71Å; L598-V663 PolarHBondContact N-O 3.27Å; L598-V663 PolarHBondContact O-N 2.75Å; L598-V665 HydrophobicContact CB-CG1 4.35Å; L598-V665 HydrophobicContact CB-CG2 4.29Å; L598-L683 HydrophobicContact CB-CD1 4.49Å; L598-L683 HydrophobicContact CD1-CD1 3.85Å; L598-L683 HydrophobicContact CD2-CD1 3.87Å; L598-L683 HydrophobicContact CG-CD1 4.28Å
599	F	96.3	Very high	90.9	Very high	11 Å²	11	64.9 Å²	64.9	5%	0.048	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	153.4	175.1	-61.7	-97.7	0	0	0	110.6	A586 I587 H589 S597 Y657 K662	A586-F599 CarbonylContact C-O 3.56Å; A586-F599 WeakPolarHBondContact CA-O 3.35Å; A586-F599 WeakPolarHBondContact CB-O 3.42Å; I587-F599 HydrophobicContact CB-CB 4.46Å; I587-F599 PolarHBondContact N-O 2.03Å; I587-F599 PolarHBondContact O-N 2.9Å; H589-F599 HydrophobicContact CB-CD2 4.2Å; H589-F599 HydrophobicContact CB-CE2 3.87Å; S597-F599 VanDerWaalsContact OG-CE2 3.28Å; S597-F599 WeakPolarHBondContact OG-CE2 3.31Å; F599-Y657 HydrophobicContact CB-CD2 3.87Å; F599-Y657 HydrophobicContact CB-CG 3.93Å; F599-Y657 AromaticContact CD1-CD2 3.49Å; F599-Y657 HydrophobicContact CD1-CD2 3.49Å; F599-Y657 VanDerWaalsContact CD1-CD2 3.49Å; F599-Y657 AromaticContact CD1-CE2 3.94Å; F599-Y657 HydrophobicContact CD1-CE2 3.94Å; F599-Y657 HydrophobicContact CD1-CG 4.39Å; F599-Y657 AromaticContact CD2-CD2 3.92Å; F599-Y657 HydrophobicContact CD2-CD2 3.92Å; F599-Y657 HydrophobicContact CD2-CE2 4.12Å; F599-Y657 HydrophobicContact CD2-CG 4.33Å; F599-Y657 AromaticContact CE1-CD2 3.85Å; F599-Y657 HydrophobicContact CE1-CD2 3.85Å; F599-Y657 AromaticContact CE1-CE2 3.8Å; F599-Y657 HydrophobicContact CE1-CE2 3.8Å; F599-Y657 HydrophobicContact CE2-CD2 4.27Å; F599-Y657 HydrophobicContact CE2-CE2 4.01Å; F599-Y657 AromaticContact CG-CD2 3.51Å; F599-Y657 HydrophobicContact CG-CD2 3.51Å; F599-Y657 HydrophobicContact CG-CE2 4.08Å; F599-Y657 HydrophobicContact CG-CG 4Å; F599-Y657 HydrophobicContact CZ-CD2 4.24Å; F599-Y657 AromaticContact CZ-CE2 3.84Å; F599-Y657 HydrophobicContact CZ-CE2 3.84Å; F599-K662 HydrophobicContact CD1-CB 3.99Å; F599-K662 HydrophobicContact CD1-CG 4.48Å; F599-K662 HydrophobicContact CE1-CB 3.38Å; F599-K662 HydrophobicContact CE1-CD 4.22Å; F599-K662 HydrophobicContact CE1-CG 3.66Å; F599-K662 HydrophobicContact CE2-CG 4.35Å; F599-K662 HydrophobicContact CZ-CB 3.88Å; F599-K662 HydrophobicContact CZ-CD 3.92Å; F599-K662 HydrophobicContact CZ-CG 3.57Å
600	Q	94.9	Very high	90.4	Very high	51 Å²	51	68.4 Å²	68.4	24%	0.238	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	139.6	167.8	-166.2	174.1	8	0	0	110.2	W583 Y657 A658 T661	W583-Q600 HydrophobicContact CB-CG 4.47Å; W583-Q600 HydrophobicContact CD2-CB 3.78Å; W583-Q600 HydrophobicContact CD2-CG 4.05Å; W583-Q600 HydrophobicContact CE3-CB 4.19Å; W583-Q600 HydrophobicContact CG-CB 4.15Å; W583-Q600 HydrophobicContact CG-CG 3.86Å; W583-Q600 HydrophobicContact CH2-CB 4.41Å; W583-Q600 HydrophobicContact CZ2-CB 4.01Å; W583-Q600 HydrophobicContact CZ3-CB 4.49Å; Q600-Y657 WeakPolarHBondContact O-CA 3.39Å; Q600-Y657 WeakPolarHBondContact O-CB 3.32Å; Q600-A658 PolarHBondContact O-N 2.98Å; Q600-T661 HydrophobicContact CB-CG2 4Å; Q600-T661 PolarHBondContact N-OG1 2.99Å
601	L	94.9	Very high	90	Very high	24 Å²	24	69.7 Å²	69.7	13%	0.126	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-66	136.9	168.9	-173.4	68.5	0	0	0	110.2	D585 I587 P630 I656	D585-L601 HydrophobicContact CB-CB 4.28Å; D585-L601 HydrophobicContact CB-CD2 4.01Å; D585-L601 PolarHBondContact O-N 3.1Å; I587-L601 HydrophobicContact CD1-CD1 3.98Å; I587-L601 HydrophobicContact CG1-CD1 3.96Å; L601-P630 HydrophobicContact CD1-CG 4.21Å; L601-I656 HydrophobicContact CD1-CD1 4.44Å; L601-I656 HydrophobicContact CD1-CG1 3.98Å
602	K	94	Very high	90	Very high	27 Å²	27	69.2 Å²	69.2	12%	0.117	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-65.1	143.3	177.3	-80.9	178.3	174.2	165.9	0	111.6	D606 F607 P655 I656 Y657 A658	K602-D606 HydrophobicContact CB-CB 4.15Å; K602-D606 HydrophobicContact CD-CB 4.39Å; K602-D606 HydrophobicContact CG-CB 4.08Å; K602-F607 HydrophobicContact CB-CD2 4.32Å; K602-F607 HydrophobicContact CB-CE2 3.65Å; K602-F607 HydrophobicContact CB-CZ 3.95Å; K602-F607 HydrophobicContact CD-CE1 4.47Å; K602-F607 HydrophobicContact CD-CZ 4.33Å; K602-P655 WeakPolarHBondContact CE-O 3.37Å; K602-P655 PolarHBondContact NZ-O 2.84Å; K602-I656 WeakPolarHBondContact CB-O 3.3Å; K602-I656 PolarHBondContact N-O 2.97Å; K602-I656 VanDerWaalsContact N-O 3.08Å; K602-Y657 WeakPolarHBondContact CE-O 3.27Å; K602-A658 HydrophobicContact CG-CB 4.21Å
603	F	89.8	Confident	90.2	Very high	101 Å²	101	69.2 Å²	69.2	44%	0.443	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-81.3	158.6	164.3	-59.7	-76.9	0	0	0	110.4	K605 D606 F607	F603-K605 HydrophobicContact CB-CG 4.05Å; F603-K605 PolarHBondContact O-N 3.05Å; F603-K605 VanDerWaalsContact O-N 3.1Å; F603-D606 WeakPolarHBondContact CB-OD2 3.35Å; F603-D606 WeakPolarHBondContact CD2-OD2 2.8Å; F603-D606 PolarHBondContact N-OD2 2.74Å; F603-D606 WeakPolarHBondContact O-CB 2.9Å; F603-D606 PolarHBondContact O-N 2.99Å; F603-F607 VanDerWaalsContact O-CD2 3.28Å; F603-F607 WeakPolarHBondContact O-CD2 3.22Å
604	L	86.5	Confident	90.5	Very high	95 Å²	95	65 Å²	65	50%	0.497	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-53.3	-36.5	180	-177.4	63.7	0	0	0	113	D606 F607	L604-D606 PolarHBondContact O-N 3.19Å; L604-F607 PolarHBondContact O-N 3.05Å
605	K	88.1	Confident	90.8	Very high	172 Å²	172	61.9 Å²	61.9	75%	0.748	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-68.6	-19.9	178	66.1	179.9	-177.3	176.6	0	114.1	F603 F607	F603-K605 HydrophobicContact CB-CG 4.05Å; F603-K605 PolarHBondContact O-N 3.05Å; F603-K605 VanDerWaalsContact O-N 3.1Å; K605-F607 VanDerWaalsContact C-N 3.3Å
606	D	89.8	Confident	90.8	Very high	68 Å²	68	64.5 Å²	64.5	36%	0.364	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-84.7	-12.1	-179.3	-51.3	-32.1	0	0	0	111.1	K602 F603 L604	K602-D606 HydrophobicContact CB-CB 4.15Å; K602-D606 HydrophobicContact CD-CB 4.39Å; K602-D606 HydrophobicContact CG-CB 4.08Å; F603-D606 WeakPolarHBondContact CB-OD2 3.35Å; F603-D606 WeakPolarHBondContact CD2-OD2 2.8Å; F603-D606 PolarHBondContact N-OD2 2.74Å; F603-D606 WeakPolarHBondContact O-CB 2.9Å; F603-D606 PolarHBondContact O-N 2.99Å; L604-D606 PolarHBondContact O-N 3.19Å
607	F	88.7	Confident	90.4	Very high	8 Å²	8	68.6 Å²	68.6	4%	0.035	35%	0.354	C	S	.	.	S	Bend	trans	-79.5	121.4	168.3	-64.9	-95	0	0	0	108.5	K602 F603 L604 K605 Q626 H651 Q654 I656	K602-F607 HydrophobicContact CB-CD2 4.32Å; K602-F607 HydrophobicContact CB-CE2 3.65Å; K602-F607 HydrophobicContact CB-CZ 3.95Å; K602-F607 HydrophobicContact CD-CE1 4.47Å; K602-F607 HydrophobicContact CD-CZ 4.33Å; F603-F607 VanDerWaalsContact O-CD2 3.28Å; F603-F607 WeakPolarHBondContact O-CD2 3.22Å; L604-F607 PolarHBondContact O-N 3.05Å; K605-F607 VanDerWaalsContact C-N 3.3Å; F607-Q626 HydrophobicContact CE1-CG 4.25Å; F607-H651 HydrophobicContact CB-CB 4.32Å; F607-H651 WeakPolarHBondContact CB-ND1 3.08Å; F607-H651 HydrophobicContact CD1-CB 3.88Å; F607-H651 AromaticContact CD1-CD2 3.62Å; F607-H651 AromaticContact CD1-CG 3.7Å; F607-H651 HydrophobicContact CG-CB 4.47Å; F607-H651 AromaticContact CG-CD2 3.76Å; F607-H651 AromaticContact CG-CG 3.88Å; F607-H651 AromaticContact CG-NE2 3.99Å; F607-Q654 HydrophobicContact CD1-CG 4.35Å; F607-I656 HydrophobicContact CZ-CG1 4.33Å
608	G	85.9	Confident	90	Very high	46 Å²	46	77.6 Å²	77.6	47%	0.474	39%	0.392	S	S	.	.			trans	-55.7	157.7	175.2	0	0	0	0	0	113.1	E610	G608-E610 VanDerWaalsContact C-N 3.34Å
609	T	84.9	Confident	89.5	Confident	147 Å²	147	83.2 Å²	83.2	90%	0.902	42%	0.418	S	S	*	.	S	Bend	trans	-86	-4.8	-179.3	54.1	0	0	0	0	113.8
610	E	86.2	Confident	89.2	Confident	118 Å²	118	86.8 Å²	86.8	55%	0.551	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-64.7	131.9	179.5	-68.6	-176	179	0	0	111.5	G608 R652	G608-E610 VanDerWaalsContact C-N 3.34Å; E610-R652 IonicContact OE2-CZ 3.67Å; E610-R652 IonicContact OE2-NH1 3.26Å; E610-R652 PolarHBondContact OE2-NH1 2.89Å
611	P	85.4	Confident	89.2	Confident	100 Å²	100	84.8 Å²	84.8	65%	0.649	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-68.4	149.6	175.1	29.2	-33.8	0	0	0	111
612	P	92	Very high	89.3	Confident	12 Å²	12	87.2 Å²	87.2	8%	0.078	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-58.7	139	172.3	-20.8	31.1	0	0	0	111.7	L346 L614 I623 V625	L346-P612 HydrophobicContact CD1-CG 4.14Å; P612-L614 PolarHBondContact O-N 2.73Å; P612-I623 HydrophobicContact CB-CB 4.02Å; P612-I623 HydrophobicContact CB-CD1 4.37Å; P612-I623 HydrophobicContact CB-CG2 4.3Å; P612-I623 HydrophobicContact CG-CD1 4.44Å; P612-V625 HydrophobicContact CB-CG1 3.95Å; P612-V625 HydrophobicContact CG-CG1 3.69Å
613	P	91.9	Very high	89.3	Confident	63 Å²	63	86 Å²	86	41%	0.409	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-67.8	127	176.8	27.4	-33.2	0	0	0	110.5
614	L	92.8	Very high	89.7	Confident	42 Å²	42	82 Å²	82	22%	0.22	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-80.7	118.6	178.6	-174.2	66	0	0	0	110.6	F347 Q348 P612 K621 I623	F347-L614 HydrophobicContact CD1-CD1 3.78Å; F347-L614 HydrophobicContact CE1-CD1 4.19Å; F347-L614 HydrophobicContact CG-CD1 4.49Å; F347-L614 WeakPolarHBondContact O-CD2 3.35Å; Q348-L614 HydrophobicContact CB-CD2 4.23Å; Q348-L614 HydrophobicContact CG-CD2 4.41Å; P612-L614 PolarHBondContact O-N 2.73Å; L614-K621 HydrophobicContact CD1-CB 3.99Å; L614-K621 HydrophobicContact CD1-CD 4.18Å; L614-K621 HydrophobicContact CD2-CD 4.11Å; L614-K621 HydrophobicContact CG-CD 4.43Å; L614-I623 HydrophobicContact CB-CG2 4.42Å; L614-I623 HydrophobicContact CD1-CG2 3.75Å
615	Q	92.7	Very high	90.1	Very high	75 Å²	75	77.4 Å²	77.4	35%	0.35	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	139.8	175.7	-57.9	-174.6	16.7	0	0	109.1	K621 Y622	Q615-K621 CarbonylContact O-C 3.59Å; Q615-K621 VanDerWaalsContact O-CA 3.31Å; Q615-K621 WeakPolarHBondContact O-CA 3.34Å; Q615-Y622 HydrophobicContact CB-CD1 4.16Å; Q615-Y622 HydrophobicContact CB-CD2 4.12Å; Q615-Y622 HydrophobicContact CB-CE1 3.79Å; Q615-Y622 HydrophobicContact CB-CE2 3.77Å; Q615-Y622 HydrophobicContact CB-CG 4.32Å; Q615-Y622 HydrophobicContact CG-CE2 4.21Å; Q615-Y622 PolarHBondContact N-O 2.76Å; Q615-Y622 PolarHBondContact O-N 2.74Å; Q615-Y622 PolarHBondContact OE1-OH 2.83Å
616	R	89.1	Confident	90.5	Very high	162 Å²	162	69.7 Å²	69.7	61%	0.611	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	132.7	-179.1	-57.9	-170	-178.3	179.6	1.1	109.3	K621	R616-K621 HydrophobicContact CG-CG 4.19Å
617	H	85	Confident	90.7	Very high	110 Å²	110	66.5 Å²	66.5	51%	0.509	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	103.8	174.5	-178.7	-93.3	0	0	0	108.5	E619 E620 Y622	H617-E619 PolarHBondContact O-N 2.88Å; H617-E620 PolarHBondContact N-O 2.79Å; H617-E620 PolarHBondContact O-N 2.82Å; H617-Y622 HydrophobicContact CB-CE1 4.36Å
618	K	86.7	Confident	90.9	Very high	193 Å²	193	66.5 Å²	66.5	84%	0.839	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	-123.7	-167.8	-54.9	178.9	177	-178.5	0	110.2
619	E	83.9	Confident	91.3	Very high	122 Å²	122	72.7 Å²	72.7	57%	0.57	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-15	177.9	-61.5	180	178.5	0	0	113	P268 H617	P268-E619 VanDerWaalsContact CD-O 3.28Å; P268-E619 WeakPolarHBondContact CD-O 3.35Å; P268-E619 HydrophobicContact CG-CB 3.97Å; P268-E619 VanDerWaalsContact CG-O 3.32Å; P268-E619 WeakPolarHBondContact CG-O 3.32Å; H617-E619 PolarHBondContact O-N 2.88Å
620	E	90.4	Very high	91.8	Very high	86 Å²	86	66.4 Å²	66.4	40%	0.402	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	144.1	179.9	-62.7	-174.4	163.9	0	0	111	H267 H617	H267-E620 HydrophobicContact CB-CG 4.48Å; H267-E620 IonicContact CE1-OE1 3.41Å; H267-E620 IonicContact CG-OE1 2.92Å; H267-E620 IonicContact ND1-OE1 3.48Å; H267-E620 PolarHBondContact ND1-OE1 3.03Å; H617-E620 PolarHBondContact N-O 2.79Å; H617-E620 PolarHBondContact O-N 2.82Å
621	K	95	Very high	92.2	Very high	9 Å²	9	61.4 Å²	61.4	4%	0.039	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	146.3	172.6	-57.8	-171.6	177	-178.4	0	109.3	A265 M266 F347 Q348 E349 L614 Q615 R616	A265-K621 CarbonylContact C-O 3.6Å; A265-K621 WeakPolarHBondContact CA-O 3.45Å; M266-K621 HydrophobicContact CB-CB 4.47Å; M266-K621 HydrophobicContact CE-CB 3.99Å; M266-K621 HydrophobicContact CE-CD 3.77Å; M266-K621 HydrophobicContact CE-CG 3.72Å; M266-K621 PolarHBondContact N-O 2.77Å; M266-K621 PolarHBondContact O-N 3.13Å; F347-K621 HydrophobicContact CD1-CB 3.78Å; F347-K621 HydrophobicContact CD1-CD 4.41Å; F347-K621 HydrophobicContact CE1-CB 4Å; F347-K621 PolarHBondContact O-NZ 2.8Å; Q348-K621 PolarHBondContact O-NZ 2.99Å; E349-K621 HydrophobicContact CG-CD 4.28Å; E349-K621 WeakPolarHBondContact OE1-CE 3.44Å; E349-K621 IonicContact OE1-NZ 2.92Å; E349-K621 PolarHBondContact OE1-NZ 2.69Å; L614-K621 HydrophobicContact CD1-CB 3.99Å; L614-K621 HydrophobicContact CD1-CD 4.18Å; L614-K621 HydrophobicContact CD2-CD 4.11Å; L614-K621 HydrophobicContact CG-CD 4.43Å; Q615-K621 CarbonylContact O-C 3.59Å; Q615-K621 VanDerWaalsContact O-CA 3.31Å; Q615-K621 WeakPolarHBondContact O-CA 3.34Å; R616-K621 HydrophobicContact CG-CG 4.19Å
622	Y	95.3	Very high	92.6	Very high	76 Å²	76	59 Å²	59	30%	0.298	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	157.3	171.2	65	-83.3	0	0	0	111.3	Y263 L264 Q615 H617	Y263-Y622 HydrophobicContact CD1-CD2 4.29Å; L264-Y622 VanDerWaalsContact O-CA 3.26Å; L264-Y622 WeakPolarHBondContact O-CA 2.93Å; Q615-Y622 HydrophobicContact CB-CD1 4.16Å; Q615-Y622 HydrophobicContact CB-CD2 4.12Å; Q615-Y622 HydrophobicContact CB-CE1 3.79Å; Q615-Y622 HydrophobicContact CB-CE2 3.77Å; Q615-Y622 HydrophobicContact CB-CG 4.32Å; Q615-Y622 HydrophobicContact CG-CE2 4.21Å; Q615-Y622 PolarHBondContact N-O 2.76Å; Q615-Y622 PolarHBondContact O-N 2.74Å; Q615-Y622 PolarHBondContact OE1-OH 2.83Å; H617-Y622 HydrophobicContact CB-CE1 4.36Å
623	I	95.9	Very high	92.7	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	150.4	173.8	56.4	178.3	0	0	0	108.4	L264 L346 F347 P612 L614 V625	L264-I623 HydrophobicContact CB-CD1 4.38Å; L264-I623 HydrophobicContact CB-CG1 3.86Å; L264-I623 HydrophobicContact CD2-CD1 4.17Å; L264-I623 HydrophobicContact CG-CG1 4.37Å; L264-I623 PolarHBondContact N-O 3.15Å; L264-I623 PolarHBondContact O-N 2.88Å; L346-I623 HydrophobicContact CD1-CD1 3.92Å; L346-I623 HydrophobicContact CD2-CD1 3.4Å; L346-I623 HydrophobicContact CG-CD1 3.51Å; F347-I623 HydrophobicContact CE2-CD1 3.97Å; F347-I623 HydrophobicContact CE2-CG1 4.34Å; F347-I623 HydrophobicContact CZ-CD1 4.08Å; F347-I623 HydrophobicContact CZ-CG1 3.93Å; P612-I623 HydrophobicContact CB-CB 4.02Å; P612-I623 HydrophobicContact CB-CD1 4.37Å; P612-I623 HydrophobicContact CB-CG2 4.3Å; P612-I623 HydrophobicContact CG-CD1 4.44Å; L614-I623 HydrophobicContact CB-CG2 4.42Å; L614-I623 HydrophobicContact CD1-CG2 3.75Å; I623-V625 HydrophobicContact CB-CG1 4.17Å; I623-V625 HydrophobicContact CD1-CG1 3.58Å; I623-V625 HydrophobicContact CG1-CG1 3.68Å
624	V	96.4	Very high	92.9	Very high	17 Å²	17	56.2 Å²	56.2	10%	0.103	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	121.8	174.3	-162.3	0	0	0	0	108	Q261 Y262 Y263 A653	Q261-V624 HydrophobicContact CB-CG1 4.18Å; Q261-V624 HydrophobicContact CG-CG1 3.82Å; Y262-V624 WeakPolarHBondContact O-CA 3.46Å; Y263-V624 HydrophobicContact CD1-CG1 4.42Å; Y263-V624 HydrophobicContact CD1-CG2 3.84Å; Y263-V624 HydrophobicContact CE1-CG1 4.16Å; Y263-V624 HydrophobicContact CE1-CG2 3.61Å; V624-A653 HydrophobicContact CB-CB 4.04Å; V624-A653 HydrophobicContact CG1-CB 3.69Å; V624-A653 PolarHBondContact O-N 3.49Å
625	V	96.5	Very high	92.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	160.1	-166.6	-60.5	0	0	0	0	112.9	Y262 L264 P612 I623 F627 I650 H651	Y262-V625 PolarHBondContact N-O 2.88Å; Y262-V625 PolarHBondContact O-N 3.03Å; L264-V625 HydrophobicContact CB-CG2 4.32Å; P612-V625 HydrophobicContact CB-CG1 3.95Å; P612-V625 HydrophobicContact CG-CG1 3.69Å; I623-V625 HydrophobicContact CB-CG1 4.17Å; I623-V625 HydrophobicContact CD1-CG1 3.58Å; I623-V625 HydrophobicContact CG1-CG1 3.68Å; V625-F627 HydrophobicContact CG2-CE1 4.03Å; V625-F627 HydrophobicContact CG2-CZ 4.07Å; V625-I650 HydrophobicContact CB-CG2 3.78Å; V625-I650 HydrophobicContact CG1-CG2 3.6Å; V625-I650 HydrophobicContact CG2-CG2 4.15Å; V625-H651 CarbonylContact C-O 3.53Å; V625-H651 WeakPolarHBondContact CA-O 3.33Å; V625-H651 WeakPolarHBondContact CB-O 3.44Å
626	Q	95.2	Very high	92.9	Very high	9 Å²	9	53.2 Å²	53.2	4%	0.042	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	149.5	165.5	-175.9	60.3	-80.8	0	0	109.4	K260 F607 H651 Q654 I656	K260-Q626 PolarHBondContact O-NE2 3.09Å; F607-Q626 HydrophobicContact CE1-CG 4.25Å; Q626-H651 PolarHBondContact N-O 2.9Å; Q626-H651 PolarHBondContact O-N 3.46Å; Q626-Q654 HydrophobicContact CB-CG 4.44Å; Q626-Q654 WeakPolarHBondContact CG-O 3.36Å; Q626-Q654 PolarHBondContact NE2-O 3.47Å; Q626-I656 HydrophobicContact CG-CB 4.35Å
627	F	95.3	Very high	93.2	Very high	1 Å²	1	47 Å²	47	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	151.5	177.8	-54.8	-54.6	0	0	0	112.4	Y262 L481 V625 R629 Q632 Y633 H649 I650	Y262-F627 HydrophobicContact CD1-CE2 4.15Å; Y262-F627 AromaticContact CD2-CD2 3.64Å; Y262-F627 HydrophobicContact CD2-CD2 3.64Å; Y262-F627 AromaticContact CD2-CE2 3.37Å; Y262-F627 HydrophobicContact CD2-CE2 3.37Å; Y262-F627 HydrophobicContact CD2-CZ 4.32Å; Y262-F627 HydrophobicContact CE1-CE2 4.36Å; Y262-F627 AromaticContact CE2-CD2 3.57Å; Y262-F627 HydrophobicContact CE2-CD2 3.57Å; Y262-F627 AromaticContact CE2-CE2 3.62Å; Y262-F627 HydrophobicContact CE2-CE2 3.62Å; Y262-F627 HydrophobicContact CG-CD2 4.38Å; Y262-F627 AromaticContact CG-CE2 3.66Å; Y262-F627 HydrophobicContact CG-CE2 3.66Å; Y262-F627 HydrophobicContact CG-CZ 4.35Å; L481-F627 HydrophobicContact CD1-CE2 4.13Å; L481-F627 HydrophobicContact CD1-CZ 3.72Å; L481-F627 HydrophobicContact CD2-CE2 4.06Å; L481-F627 HydrophobicContact CD2-CZ 4.18Å; V625-F627 HydrophobicContact CG2-CE1 4.03Å; V625-F627 HydrophobicContact CG2-CZ 4.07Å; F627-R629 PolarHBondContact O-N 2.86Å; F627-Q632 HydrophobicContact CB-CB 4.45Å; F627-Y633 AromaticContact CD1-CD2 3.59Å; F627-Y633 HydrophobicContact CD1-CD2 3.59Å; F627-Y633 HydrophobicContact CD1-CE2 4.4Å; F627-Y633 HydrophobicContact CD2-CD2 4.49Å; F627-Y633 WeakPolarHBondContact CD2-O 3.45Å; F627-Y633 AromaticContact CE1-CD2 3.68Å; F627-Y633 HydrophobicContact CE1-CD2 3.68Å; F627-Y633 HydrophobicContact CE1-CG 4.39Å; F627-Y633 WeakPolarHBondContact CE2-O 3.46Å; F627-Y633 HydrophobicContact CG-CD2 4.01Å; F627-Y633 HydrophobicContact CZ-CD2 4.17Å; F627-Y633 HydrophobicContact CZ-CG 4.45Å; F627-H649 WeakPolarHBondContact CA-O 3.24Å; F627-I650 HydrophobicContact CD1-CG1 4.19Å; F627-I650 HydrophobicContact CE1-CG1 3.99Å; F627-I650 HydrophobicContact CE1-CG2 4.27Å
628	S	92.5	Very high	93.7	Very high	9 Å²	9	41.8 Å²	41.8	6%	0.063	19%	0.191	C	C	.	.	S	Bend	trans	-64.9	-20.2	-176.1	70.5	0	0	0	0	114.5	Q632 H649	S628-Q632 PolarHBondContact OG-OE1 3.44Å; S628-H649 PolarHBondContact N-O 3.4Å; S628-H649 PolarHBondContact OG-ND1 2.69Å
629	R	93.8	Very high	94	Very high	176 Å²	176	33.7 Å²	33.7	66%	0.664	16%	0.163	S	C	*	.	S	Bend	trans	-138	147.5	176.8	-65.4	-178.8	179.1	179.4	-2	111.2	F627 F631 Q632	F627-R629 PolarHBondContact O-N 2.86Å; R629-F631 PolarHBondContact O-N 3.1Å; R629-Q632 HydrophobicContact CB-CB 4.16Å; R629-Q632 WeakPolarHBondContact O-CB 3.5Å; R629-Q632 PolarHBondContact O-N 3.07Å
630	P	95.1	Very high	94.3	Very high	15 Å²	15	34.2 Å²	34.2	10%	0.097	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	128.3	174.9	-26.3	34.3	0	0	0	112.2	L258 H495 L601 Q632 I656	L258-P630 HydrophobicContact CD2-CB 3.86Å; H495-P630 HydrophobicContact CB-CB 4.41Å; H495-P630 HydrophobicContact CB-CG 4.31Å; L601-P630 HydrophobicContact CD1-CG 4.21Å; P630-Q632 PolarHBondContact O-N 3.32Å; P630-I656 HydrophobicContact CB-CD1 4.46Å; P630-I656 HydrophobicContact CG-CD1 3.87Å
631	F	95	Very high	94.4	Very high	12 Å²	12	32.7 Å²	32.7	5%	0.053	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	22.4	180	-53.9	-67.7	0	0	0	115.9	H222 A224 D226 L258 R629 Y633	H222-F631 HydrophobicContact CB-CD2 3.9Å; H222-F631 AromaticContact CD2-CD2 3.54Å; H222-F631 AromaticContact CD2-CE2 3.75Å; H222-F631 AromaticContact CE1-CD2 3.97Å; H222-F631 AromaticContact CG-CD2 3.47Å; H222-F631 VanDerWaalsContact CG-CD2 3.47Å; H222-F631 AromaticContact ND1-CD2 3.75Å; H222-F631 AromaticContact NE2-CD2 3.86Å; A224-F631 WeakPolarHBondContact O-CB 3.3Å; D226-F631 HydrophobicContact CB-CE1 4.47Å; L258-F631 HydrophobicContact CD2-CD2 3.96Å; L258-F631 HydrophobicContact CD2-CE1 4.4Å; L258-F631 HydrophobicContact CD2-CE2 3.36Å; L258-F631 HydrophobicContact CD2-CZ 3.63Å; R629-F631 PolarHBondContact O-N 3.1Å; F631-Y633 PolarHBondContact O-N 3.38Å
632	Q	93.6	Very high	94.1	Very high	49 Å²	49	35.4 Å²	35.4	23%	0.229	18%	0.18	C	C	.	.	S	Bend	trans	-53.4	-46.4	171	179.9	170.7	6.1	0	0	110.4	F627 S628 R629 P630 N637 H649	F627-Q632 HydrophobicContact CB-CB 4.45Å; S628-Q632 PolarHBondContact OG-OE1 3.44Å; R629-Q632 HydrophobicContact CB-CB 4.16Å; R629-Q632 WeakPolarHBondContact O-CB 3.5Å; R629-Q632 PolarHBondContact O-N 3.07Å; P630-Q632 PolarHBondContact O-N 3.32Å; Q632-N637 PolarHBondContact O-ND2 3.32Å; Q632-N637 VanDerWaalsContact O-ND2 3.07Å; Q632-H649 PolarHBondContact NE2-CD2 3.23Å; Q632-H649 VanDerWaalsContact NE2-CD2 3.27Å; Q632-H649 PolarHBondContact NE2-ND1 3.41Å
633	Y	95	Very high	93.7	Very high	17 Å²	17	32.4 Å²	32.4	7%	0.067	17%	0.17	C	C	.	.	S	Bend	trans	-121.6	135	163.9	-55.6	-60	0	0	0	108.2	F627 F631 N637 W638 Q641 I645 N646 H649 I650	F627-Y633 AromaticContact CD1-CD2 3.59Å; F627-Y633 HydrophobicContact CD1-CD2 3.59Å; F627-Y633 HydrophobicContact CD1-CE2 4.4Å; F627-Y633 HydrophobicContact CD2-CD2 4.49Å; F627-Y633 WeakPolarHBondContact CD2-O 3.45Å; F627-Y633 AromaticContact CE1-CD2 3.68Å; F627-Y633 HydrophobicContact CE1-CD2 3.68Å; F627-Y633 HydrophobicContact CE1-CG 4.39Å; F627-Y633 WeakPolarHBondContact CE2-O 3.46Å; F627-Y633 HydrophobicContact CG-CD2 4.01Å; F627-Y633 HydrophobicContact CZ-CD2 4.17Å; F627-Y633 HydrophobicContact CZ-CG 4.45Å; F631-Y633 PolarHBondContact O-N 3.38Å; Y633-N637 WeakPolarHBondContact CA-OD1 3.06Å; Y633-W638 HydrophobicContact CD1-CE3 4.34Å; Y633-W638 HydrophobicContact CD1-CZ3 4.25Å; Y633-W638 HydrophobicContact CD2-CZ3 4.44Å; Y633-W638 HydrophobicContact CG-CE3 4.22Å; Y633-W638 AromaticContact CG-CZ3 3.97Å; Y633-W638 HydrophobicContact CG-CZ3 3.97Å; Y633-Q641 HydrophobicContact CD1-CG 4.35Å; Y633-I645 HydrophobicContact CD1-CD1 3.98Å; Y633-I645 HydrophobicContact CD2-CD1 4.43Å; Y633-I645 HydrophobicContact CE1-CD1 3.53Å; Y633-I645 HydrophobicContact CE1-CG1 3.83Å; Y633-I645 HydrophobicContact CE2-CD1 4.01Å; Y633-I645 HydrophobicContact CE2-CG1 4.33Å; Y633-I645 HydrophobicContact CG-CD1 4.41Å; Y633-I645 VanDerWaalsContact OH-CG1 3.28Å; Y633-I645 WeakPolarHBondContact OH-CG1 3.38Å; Y633-N646 PolarHBondContact OH-O 3.38Å; Y633-H649 HydrophobicContact CE2-CB 4.26Å; Y633-I650 HydrophobicContact CE2-CG1 4.39Å
634	S	95.4	Very high	93.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.19	C	C	.	.			trans	-151.1	167.2	179.2	64.4	0	0	0	0	109	A224 S636 N637 W638	A224-S634 WeakPolarHBondContact CB-OG 3.3Å; S634-S636 PolarHBondContact O-N 3.41Å; S634-S636 VanDerWaalsContact O-N 3.08Å; S634-S636 PolarHBondContact OG-OG 3.09Å; S634-S636 VanDerWaalsContact OG-OG 3.11Å; S634-N637 PolarHBondContact N-OD1 3.45Å; S634-N637 PolarHBondContact O-N 3.5Å; S634-N637 VanDerWaalsContact O-N 3.1Å; S634-N637 PolarHBondContact O-OD1 3.34Å; S634-W638 VanDerWaalsContact O-CB 3.22Å; S634-W638 WeakPolarHBondContact O-CB 3.43Å; S634-W638 PolarHBondContact O-N 2.04Å
635	T	93.8	Very high	92.9	Very high	4 Å²	4	36.2 Å²	36.2	3%	0.025	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-18.6	-178.6	51.5	0	0	0	0	114.6	D226 I229 L331 N332 L481 P483	D226-T635 WeakPolarHBondContact CA-OG1 3.41Å; D226-T635 WeakPolarHBondContact OD1-CB 3.32Å; D226-T635 VanDerWaalsContact OD1-CG2 3.32Å; D226-T635 WeakPolarHBondContact OD1-CG2 3.37Å; D226-T635 PolarHBondContact OD1-N 2.72Å; D226-T635 PolarHBondContact OD1-OG1 2.89Å; I229-T635 HydrophobicContact CD1-CG2 4Å; I229-T635 HydrophobicContact CG2-CG2 3.99Å; I229-T635 VanDerWaalsContact CG2-OG1 3.27Å; I229-T635 WeakPolarHBondContact CG2-OG1 3.43Å; L331-T635 CarbonylContact C-O 3.46Å; N332-T635 HydrophobicContact CB-CG2 3.88Å; L481-T635 WeakPolarHBondContact O-CG2 3.09Å; P483-T635 VanDerWaalsContact CD-CG2 3.47Å; P483-T635 HydrophobicContact CG-CG2 4.32Å
636	S	92.7	Very high	92.5	Very high	51 Å²	51	40 Å²	40	36%	0.357	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-25.5	175.9	51.8	0	0	0	0	114	A224 S225 S634	A224-S636 WeakPolarHBondContact CB-OG 3.03Å; S225-S636 PolarHBondContact N-OG 3.44Å; S225-S636 WeakPolarHBondContact O-CB 3.4Å; S225-S636 PolarHBondContact O-OG 2.93Å; S634-S636 PolarHBondContact O-N 3.41Å; S634-S636 VanDerWaalsContact O-N 3.08Å; S634-S636 PolarHBondContact OG-OG 3.09Å; S634-S636 VanDerWaalsContact OG-OG 3.11Å
637	N	94.2	Very high	92.3	Very high	31 Å²	31	41.3 Å²	41.3	17%	0.166	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-6.9	-179.3	74.4	7.2	0	0	0	113.9	A224 Q632 Y633 S634 N640 Q641	A224-N637 HydrophobicContact CB-CB 4.07Å; Q632-N637 PolarHBondContact O-ND2 3.32Å; Q632-N637 VanDerWaalsContact O-ND2 3.07Å; Y633-N637 WeakPolarHBondContact CA-OD1 3.06Å; S634-N637 PolarHBondContact N-OD1 3.45Å; S634-N637 PolarHBondContact O-N 3.5Å; S634-N637 VanDerWaalsContact O-N 3.1Å; S634-N637 PolarHBondContact O-OD1 3.34Å; N637-N640 PolarHBondContact O-N 3.08Å; N637-Q641 PolarHBondContact O-NE2 3.4Å
638	W	95.5	Very high	92.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-66.5	-42.1	-176.7	-173.2	-100.4	0	0	0	113.1	L264 N332 F334 F479 L481 Y633 S634 N640 Q641 I645	L264-W638 HydrophobicContact CD1-CH2 3.93Å; L264-W638 HydrophobicContact CD1-CZ2 3.31Å; L264-W638 HydrophobicContact CD2-CH2 3.94Å; L264-W638 HydrophobicContact CD2-CZ2 4.13Å; L264-W638 HydrophobicContact CG-CZ2 4.38Å; N332-W638 VanDerWaalsContact C-CD1 3.46Å; F334-W638 AromaticContact CD1-CD1 3.92Å; F334-W638 HydrophobicContact CD1-CD2 4.44Å; F334-W638 AromaticContact CD1-CE2 3.9Å; F334-W638 HydrophobicContact CD1-CG 4.49Å; F334-W638 HydrophobicContact CD1-CZ2 4.33Å; F334-W638 AromaticContact CD1-NE1 3.56Å; F334-W638 WeakPolarHBondContact CD1-O 3.37Å; F334-W638 HydrophobicContact CE1-CD2 4.12Å; F334-W638 AromaticContact CE1-CE2 3.43Å; F334-W638 VanDerWaalsContact CE1-CE2 3.43Å; F334-W638 HydrophobicContact CE1-CH2 4.16Å; F334-W638 AromaticContact CE1-CZ2 3.44Å; F334-W638 HydrophobicContact CE1-CZ2 3.44Å; F334-W638 VanDerWaalsContact CE1-CZ2 3.44Å; F334-W638 AromaticContact CE1-NE1 3.56Å; F334-W638 HydrophobicContact CZ-CZ2 4.16Å; F479-W638 HydrophobicContact CB-CZ2 4.27Å; F479-W638 PolarHBondContact O-NE1 3.17Å; L481-W638 HydrophobicContact CB-CB 4.2Å; L481-W638 HydrophobicContact CB-CD2 3.68Å; L481-W638 HydrophobicContact CB-CE3 4.31Å; L481-W638 HydrophobicContact CB-CG 3.61Å; L481-W638 HydrophobicContact CD2-CB 4.22Å; L481-W638 HydrophobicContact CD2-CD2 3.99Å; L481-W638 HydrophobicContact CD2-CE3 3.82Å; L481-W638 HydrophobicContact CD2-CG 4.19Å; L481-W638 HydrophobicContact CG-CD2 4.36Å; Y633-W638 HydrophobicContact CD1-CE3 4.34Å; Y633-W638 HydrophobicContact CD1-CZ3 4.25Å; Y633-W638 HydrophobicContact CD2-CZ3 4.44Å; Y633-W638 HydrophobicContact CG-CE3 4.22Å; Y633-W638 AromaticContact CG-CZ3 3.97Å; Y633-W638 HydrophobicContact CG-CZ3 3.97Å; S634-W638 VanDerWaalsContact O-CB 3.22Å; S634-W638 WeakPolarHBondContact O-CB 3.43Å; S634-W638 PolarHBondContact O-N 2.04Å; W638-N640 PolarHBondContact O-N 3.33Å; W638-N640 VanDerWaalsContact O-N 3.15Å; W638-Q641 HydrophobicContact CE3-CG 4.23Å; W638-Q641 VanDerWaalsContact O-CB 3.25Å; W638-Q641 WeakPolarHBondContact O-CB 3.42Å; W638-Q641 VanDerWaalsContact O-CG 3.28Å; W638-Q641 WeakPolarHBondContact O-CG 3.25Å; W638-Q641 PolarHBondContact O-N 3.35Å; W638-I645 HydrophobicContact CE3-CD1 4.38Å; W638-I645 HydrophobicContact CH2-CD1 3.73Å; W638-I645 HydrophobicContact CZ3-CD1 3.48Å; W638-I645 VanDerWaalsContact CZ3-CD1 3.48Å
639	G	92.5	Very high	92.1	Very high	23 Å²	23	45.8 Å²	45.8	24%	0.237	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-65	-17.6	179.3	0	0	0	0	0	113.9	L331 Q641	L331-G639 VanDerWaalsContact O-CA 3.23Å; L331-G639 WeakPolarHBondContact O-CA 3.38Å; L331-G639 PolarHBondContact O-N 3.48Å; G639-Q641 VanDerWaalsContact C-N 3.34Å
640	N	91	Very high	92.1	Very high	133 Å²	133	37.9 Å²	37.9	71%	0.711	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-88.5	-3.1	175.3	-62.9	-17.3	0	0	0	112.8	N637 W638	N637-N640 PolarHBondContact O-N 3.08Å; W638-N640 PolarHBondContact O-N 3.33Å; W638-N640 VanDerWaalsContact O-N 3.15Å
641	Q	92.4	Very high	92.1	Very high	55 Å²	55	38 Å²	38	26%	0.257	21%	0.211	S	C	.	.			trans	-76.6	168.8	176.9	-56.2	-53.3	-47.4	0	0	111.4	F334 Y633 N637 W638 G639 I645	F334-Q641 HydrophobicContact CD1-CB 3.94Å; F334-Q641 HydrophobicContact CE1-CB 3.74Å; F334-Q641 HydrophobicContact CZ-CB 4.33Å; Y633-Q641 HydrophobicContact CD1-CG 4.35Å; N637-Q641 PolarHBondContact O-NE2 3.4Å; W638-Q641 HydrophobicContact CE3-CG 4.23Å; W638-Q641 VanDerWaalsContact O-CB 3.25Å; W638-Q641 WeakPolarHBondContact O-CB 3.42Å; W638-Q641 VanDerWaalsContact O-CG 3.28Å; W638-Q641 WeakPolarHBondContact O-CG 3.25Å; W638-Q641 PolarHBondContact O-N 3.35Å; G639-Q641 VanDerWaalsContact C-N 3.34Å; Q641-I645 HydrophobicContact CB-CD1 4.4Å; Q641-I645 HydrophobicContact CG-CD1 4.22Å
642	T	88.7	Confident	92.1	Very high	66 Å²	66	43.1 Å²	43.1	41%	0.405	23%	0.229	S	C	.	.			trans	-125.8	172	176.4	70.4	0	0	0	0	110	Q644 I645	T642-Q644 PolarHBondContact O-N 2.04Å; T642-Q644 VanDerWaalsContact O-N 3.13Å; T642-Q644 PolarHBondContact OG1-N 3.41Å; T642-I645 PolarHBondContact O-N 3.02Å
643	C	88.1	Confident	92.1	Very high	12 Å²	12	42.2 Å²	42.2	8%	0.081	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.8	177	-52.6	0	0	0	0	113.5	C336 I338 S340 I645	C336-C643 WeakPolarHBondContact CA-SG 3.01Å; C336-C643 HydrophobicContact CB-CB 4.07Å; C336-C643 WeakPolarHBondContact CB-SG 3.36Å; C336-C643 WeakPolarHBondContact SG-CA 3.49Å; C336-C643 WeakPolarHBondContact SG-CB 2.97Å; C336-C643 CovalentContact SG-SG 2.02Å; C336-C643 PolarHBondContact SG-SG 3Å; I338-C643 HydrophobicContact CD1-CB 4.33Å; I338-C643 HydrophobicContact CG1-CB 4Å; S340-C643 WeakPolarHBondContact CB-O 3.37Å; S340-C643 PolarHBondContact OG-O 3.02Å; C643-I645 PolarHBondContact O-N 3.44Å
644	Q	85.1	Confident	92	Very high	90 Å²	90	43.7 Å²	43.7	42%	0.421	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	31.2	179.3	-57	-60	-14.7	0	0	112.7	T642	T642-Q644 PolarHBondContact O-N 2.04Å; T642-Q644 VanDerWaalsContact O-N 3.13Å; T642-Q644 PolarHBondContact OG1-N 3.41Å
645	I	88.9	Confident	92	Very high	8 Å²	8	45.4 Å²	45.4	4%	0.041	25%	0.249	C	C	.	.			trans	-58.5	141.8	173.5	-168	171.7	0	0	0	110.9	L342 Y633 W638 Q641 T642 C643 I647	L342-I645 HydrophobicContact CB-CG2 3.98Å; L342-I645 HydrophobicContact CD1-CG2 4.45Å; L342-I645 HydrophobicContact CD2-CG2 3.96Å; L342-I645 HydrophobicContact CG-CG2 4.36Å; Y633-I645 HydrophobicContact CD1-CD1 3.98Å; Y633-I645 HydrophobicContact CD2-CD1 4.43Å; Y633-I645 HydrophobicContact CE1-CD1 3.53Å; Y633-I645 HydrophobicContact CE1-CG1 3.83Å; Y633-I645 HydrophobicContact CE2-CD1 4.01Å; Y633-I645 HydrophobicContact CE2-CG1 4.33Å; Y633-I645 HydrophobicContact CG-CD1 4.41Å; Y633-I645 VanDerWaalsContact OH-CG1 3.28Å; Y633-I645 WeakPolarHBondContact OH-CG1 3.38Å; W638-I645 HydrophobicContact CE3-CD1 4.38Å; W638-I645 HydrophobicContact CH2-CD1 3.73Å; W638-I645 HydrophobicContact CZ3-CD1 3.48Å; W638-I645 VanDerWaalsContact CZ3-CD1 3.48Å; Q641-I645 HydrophobicContact CB-CD1 4.4Å; Q641-I645 HydrophobicContact CG-CD1 4.22Å; T642-I645 PolarHBondContact O-N 3.02Å; C643-I645 PolarHBondContact O-N 3.44Å; I645-I647 HydrophobicContact CG2-CG2 4.21Å; I645-I647 PolarHBondContact O-N 2.86Å; I645-I647 VanDerWaalsContact O-N 3.07Å
646	N	89.2	Confident	92	Very high	80 Å²	80	45.7 Å²	45.7	43%	0.428	25%	0.251	S	S	.	.			trans	-75.5	101.9	175.1	-174.7	7.5	0	0	0	110.3	Y633 S648 H649	Y633-N646 PolarHBondContact OH-O 3.38Å; N646-S648 VanDerWaalsContact CG-OG 3.29Å; N646-S648 PolarHBondContact ND2-OG 2.89Å; N646-S648 PolarHBondContact O-N 3.1Å; N646-S648 WeakPolarHBondContact OD1-CB 3.32Å; N646-S648 PolarHBondContact OD1-N 2.67Å; N646-S648 PolarHBondContact OD1-OG 2.73Å; N646-H649 PolarHBondContact ND2-CD2 3.39Å; N646-H649 PolarHBondContact ND2-NE2 2.87Å
647	I	90.3	Very high	92.2	Very high	36 Å²	36	44.9 Å²	44.9	19%	0.185	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-71.3	-10.5	179.5	64.7	167.8	0	0	0	113.5	P341 L342 K345 I645 H649 I650	P341-I647 HydrophobicContact CB-CD1 3.65Å; P341-I647 HydrophobicContact CB-CG1 4.02Å; P341-I647 HydrophobicContact CB-CG2 4.35Å; L342-I647 HydrophobicContact CB-CG2 4.19Å; K345-I647 HydrophobicContact CB-CD1 4.01Å; K345-I647 HydrophobicContact CD-CD1 4.24Å; I645-I647 HydrophobicContact CG2-CG2 4.21Å; I645-I647 PolarHBondContact O-N 2.86Å; I645-I647 VanDerWaalsContact O-N 3.07Å; I647-H649 PolarHBondContact O-N 3.17Å; I647-H649 VanDerWaalsContact O-N 3.1Å; I647-I650 HydrophobicContact CB-CD1 4.47Å; I647-I650 HydrophobicContact CG2-CD1 4.32Å; I647-I650 PolarHBondContact O-N 3.26Å
648	S	90.8	Very high	92.2	Very high	63 Å²	63	44 Å²	44	44%	0.441	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-65.3	-14	179.2	77.1	0	0	0	0	113.7	N646 H651	N646-S648 VanDerWaalsContact CG-OG 3.29Å; N646-S648 PolarHBondContact ND2-OG 2.89Å; N646-S648 PolarHBondContact O-N 3.1Å; N646-S648 WeakPolarHBondContact OD1-CB 3.32Å; N646-S648 PolarHBondContact OD1-N 2.67Å; N646-S648 PolarHBondContact OD1-OG 2.73Å; S648-H651 PolarHBondContact O-CE1 3.07Å; S648-H651 VanDerWaalsContact O-CE1 3.28Å; S648-H651 PolarHBondContact O-NE2 3.03Å
649	H	92.2	Very high	92	Very high	40 Å²	40	49.5 Å²	49.5	19%	0.185	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-97.9	1.6	176.9	-63.4	-74.9	0	0	0	113.1	F627 S628 Q632 Y633 N646 I647 H651	F627-H649 WeakPolarHBondContact CA-O 3.24Å; S628-H649 PolarHBondContact N-O 3.4Å; S628-H649 PolarHBondContact OG-ND1 2.69Å; Q632-H649 PolarHBondContact NE2-CD2 3.23Å; Q632-H649 VanDerWaalsContact NE2-CD2 3.27Å; Q632-H649 PolarHBondContact NE2-ND1 3.41Å; Y633-H649 HydrophobicContact CE2-CB 4.26Å; N646-H649 PolarHBondContact ND2-CD2 3.39Å; N646-H649 PolarHBondContact ND2-NE2 2.87Å; I647-H649 PolarHBondContact O-N 3.17Å; I647-H649 VanDerWaalsContact O-N 3.1Å; H649-H651 PolarHBondContact O-CD2 2.89Å
650	I	94.5	Very high	91.9	Very high	11 Å²	11	55.5 Å²	55.5	6%	0.056	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	111.2	-179.4	-52.4	-178.2	0	0	0	107.5	L346 V625 F627 Y633 I647	L346-I650 HydrophobicContact CD2-CD1 4.11Å; L346-I650 HydrophobicContact CD2-CG2 4.22Å; V625-I650 HydrophobicContact CB-CG2 3.78Å; V625-I650 HydrophobicContact CG1-CG2 3.6Å; V625-I650 HydrophobicContact CG2-CG2 4.15Å; F627-I650 HydrophobicContact CD1-CG1 4.19Å; F627-I650 HydrophobicContact CE1-CG1 3.99Å; F627-I650 HydrophobicContact CE1-CG2 4.27Å; Y633-I650 HydrophobicContact CE2-CG1 4.39Å; I647-I650 HydrophobicContact CB-CD1 4.47Å; I647-I650 HydrophobicContact CG2-CD1 4.32Å; I647-I650 PolarHBondContact O-N 3.26Å
651	H	95	Very high	92	Very high	18 Å²	18	50.3 Å²	50.3	8%	0.083	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	160.5	-175.9	-55.7	-79.4	0	0	0	110.6	F607 V625 Q626 S648 H649	F607-H651 HydrophobicContact CB-CB 4.32Å; F607-H651 WeakPolarHBondContact CB-ND1 3.08Å; F607-H651 HydrophobicContact CD1-CB 3.88Å; F607-H651 AromaticContact CD1-CD2 3.62Å; F607-H651 AromaticContact CD1-CG 3.7Å; F607-H651 HydrophobicContact CG-CB 4.47Å; F607-H651 AromaticContact CG-CD2 3.76Å; F607-H651 AromaticContact CG-CG 3.88Å; F607-H651 AromaticContact CG-NE2 3.99Å; V625-H651 CarbonylContact C-O 3.53Å; V625-H651 WeakPolarHBondContact CA-O 3.33Å; V625-H651 WeakPolarHBondContact CB-O 3.44Å; Q626-H651 PolarHBondContact N-O 2.9Å; Q626-H651 PolarHBondContact O-N 3.46Å; S648-H651 PolarHBondContact O-CE1 3.07Å; S648-H651 VanDerWaalsContact O-CE1 3.28Å; S648-H651 PolarHBondContact O-NE2 3.03Å; H649-H651 PolarHBondContact O-CD2 2.89Å
652	R	94.5	Very high	92	Very high	118 Å²	118	53.4 Å²	53.4	45%	0.445	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	140.9	169.3	-178.1	176.8	178.4	-178	0.3	110	E610 Q654	E610-R652 IonicContact OE2-CZ 3.67Å; E610-R652 IonicContact OE2-NH1 3.26Å; E610-R652 PolarHBondContact OE2-NH1 2.89Å; R652-Q654 WeakPolarHBondContact O-CG 3.29Å; R652-Q654 PolarHBondContact O-N 3.36Å; R652-Q654 PolarHBondContact O-NE2 3.32Å
653	A	94.4	Very high	92.1	Very high	31 Å²	31	50.6 Å²	50.6	26%	0.256	26%	0.258	S	S	.	.	S	Bend	trans	-49.6	123.4	178.4	0	0	0	0	0	112.3	Q261 V624	Q261-A653 HydrophobicContact CB-CB 4.39Å; V624-A653 HydrophobicContact CB-CB 4.04Å; V624-A653 HydrophobicContact CG1-CB 3.69Å; V624-A653 PolarHBondContact O-N 3.49Å
654	Q	93.9	Very high	92.3	Very high	48 Å²	48	52.9 Å²	52.9	22%	0.224	27%	0.274	C	S	.	.			trans	-165.4	163.8	-179.6	64.1	-171.6	-67.8	0	0	109.2	F607 Q626 R652 I656	F607-Q654 HydrophobicContact CD1-CG 4.35Å; Q626-Q654 HydrophobicContact CB-CG 4.44Å; Q626-Q654 WeakPolarHBondContact CG-O 3.36Å; Q626-Q654 PolarHBondContact NE2-O 3.47Å; R652-Q654 WeakPolarHBondContact O-CG 3.29Å; R652-Q654 PolarHBondContact O-N 3.36Å; R652-Q654 PolarHBondContact O-NE2 3.32Å; Q654-I656 PolarHBondContact O-N 3.29Å
655	P	94.3	Very high	92.6	Very high	36 Å²	36	49 Å²	49	23%	0.234	26%	0.256	C	S	.	.			trans	-60.1	138.6	171.5	-26.7	38.7	0	0	0	111.7	K602 Y657 E659	K602-P655 WeakPolarHBondContact CE-O 3.37Å; K602-P655 PolarHBondContact NZ-O 2.84Å; P655-Y657 HydrophobicContact CB-CD1 4.24Å; P655-Y657 HydrophobicContact CB-CD2 4.13Å; P655-Y657 HydrophobicContact CB-CE1 3.98Å; P655-Y657 HydrophobicContact CB-CE2 3.85Å; P655-Y657 HydrophobicContact CB-CG 4.33Å; P655-Y657 PolarHBondContact O-N 2.04Å; P655-E659 HydrophobicContact CB-CG 4.25Å; P655-E659 HydrophobicContact CG-CG 4.17Å; P655-E659 WeakPolarHBondContact CG-OE1 3.24Å
656	I	94.9	Very high	92.6	Very high	10 Å²	10	53 Å²	53	5%	0.051	28%	0.275	C	S	.	.	S	Bend	trans	-73.4	-11.5	177.5	-161.2	167.5	0	0	0	112.7	L258 I587 L601 K602 F607 Q626 P630 Q654	L258-I656 HydrophobicContact CD1-CG2 4.17Å; I587-I656 HydrophobicContact CD1-CG2 4.2Å; I587-I656 HydrophobicContact CG1-CG2 4.36Å; L601-I656 HydrophobicContact CD1-CD1 4.44Å; L601-I656 HydrophobicContact CD1-CG1 3.98Å; K602-I656 WeakPolarHBondContact CB-O 3.3Å; K602-I656 PolarHBondContact N-O 2.97Å; K602-I656 VanDerWaalsContact N-O 3.08Å; F607-I656 HydrophobicContact CZ-CG1 4.33Å; Q626-I656 HydrophobicContact CG-CB 4.35Å; P630-I656 HydrophobicContact CB-CD1 4.46Å; P630-I656 HydrophobicContact CG-CD1 3.87Å; Q654-I656 PolarHBondContact O-N 3.29Å
657	Y	95.4	Very high	92.3	Very high	34 Å²	34	50.9 Å²	50.9	13%	0.133	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-107.6	156.5	178.6	51.2	-95	0	0	0	112.2	T493 I587 F599 Q600 K602 P655 E659	T493-Y657 HydrophobicContact CG2-CD1 4.43Å; T493-Y657 HydrophobicContact CG2-CE1 4.25Å; I587-Y657 HydrophobicContact CB-CD1 4.21Å; I587-Y657 HydrophobicContact CB-CG 4.38Å; I587-Y657 HydrophobicContact CG1-CD1 4.46Å; I587-Y657 HydrophobicContact CG2-CD1 3.66Å; I587-Y657 HydrophobicContact CG2-CE1 4.31Å; I587-Y657 HydrophobicContact CG2-CG 4.26Å; F599-Y657 HydrophobicContact CB-CD2 3.87Å; F599-Y657 HydrophobicContact CB-CG 3.93Å; F599-Y657 AromaticContact CD1-CD2 3.49Å; F599-Y657 HydrophobicContact CD1-CD2 3.49Å; F599-Y657 VanDerWaalsContact CD1-CD2 3.49Å; F599-Y657 AromaticContact CD1-CE2 3.94Å; F599-Y657 HydrophobicContact CD1-CE2 3.94Å; F599-Y657 HydrophobicContact CD1-CG 4.39Å; F599-Y657 AromaticContact CD2-CD2 3.92Å; F599-Y657 HydrophobicContact CD2-CD2 3.92Å; F599-Y657 HydrophobicContact CD2-CE2 4.12Å; F599-Y657 HydrophobicContact CD2-CG 4.33Å; F599-Y657 AromaticContact CE1-CD2 3.85Å; F599-Y657 HydrophobicContact CE1-CD2 3.85Å; F599-Y657 AromaticContact CE1-CE2 3.8Å; F599-Y657 HydrophobicContact CE1-CE2 3.8Å; F599-Y657 HydrophobicContact CE2-CD2 4.27Å; F599-Y657 HydrophobicContact CE2-CE2 4.01Å; F599-Y657 AromaticContact CG-CD2 3.51Å; F599-Y657 HydrophobicContact CG-CD2 3.51Å; F599-Y657 HydrophobicContact CG-CE2 4.08Å; F599-Y657 HydrophobicContact CG-CG 4Å; F599-Y657 HydrophobicContact CZ-CD2 4.24Å; F599-Y657 AromaticContact CZ-CE2 3.84Å; F599-Y657 HydrophobicContact CZ-CE2 3.84Å; Q600-Y657 WeakPolarHBondContact O-CA 3.39Å; Q600-Y657 WeakPolarHBondContact O-CB 3.32Å; K602-Y657 WeakPolarHBondContact CE-O 3.27Å; P655-Y657 HydrophobicContact CB-CD1 4.24Å; P655-Y657 HydrophobicContact CB-CD2 4.13Å; P655-Y657 HydrophobicContact CB-CE1 3.98Å; P655-Y657 HydrophobicContact CB-CE2 3.85Å; P655-Y657 HydrophobicContact CB-CG 4.33Å; P655-Y657 PolarHBondContact O-N 2.04Å; Y657-E659 HydrophobicContact CD2-CG 4.26Å; Y657-E659 HydrophobicContact CE2-CG 4.04Å; Y657-E659 PolarHBondContact O-N 3.11Å
658	A	93.7	Very high	91.5	Very high	11 Å²	11	51.2 Å²	51.2	9%	0.091	27%	0.268	C	S	.	.			trans	-80.2	101.4	-180	0	0	0	0	0	110.1	Q600 K602 N660 T661	Q600-A658 PolarHBondContact O-N 2.98Å; K602-A658 HydrophobicContact CG-CB 4.21Å; A658-N660 VanDerWaalsContact C-N 3.25Å; A658-N660 PolarHBondContact O-N 3.35Å; A658-T661 HydrophobicContact CB-CG2 3.82Å; A658-T661 WeakPolarHBondContact O-CB 3.33Å; A658-T661 PolarHBondContact O-N 3.2Å; A658-T661 PolarHBondContact O-OG1 3.46Å
659	E	91.4	Very high	90.7	Very high	116 Å²	116	51 Å²	51	54%	0.542	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-58.7	-33.2	-171.5	-66	176.3	-116.4	0	0	113.9	P655 Y657 T661 K662	P655-E659 HydrophobicContact CB-CG 4.25Å; P655-E659 HydrophobicContact CG-CG 4.17Å; P655-E659 WeakPolarHBondContact CG-OE1 3.24Å; Y657-E659 HydrophobicContact CD2-CG 4.26Å; Y657-E659 HydrophobicContact CE2-CG 4.04Å; Y657-E659 PolarHBondContact O-N 3.11Å; E659-T661 PolarHBondContact O-N 3.01Å; E659-T661 VanDerWaalsContact O-N 3.16Å; E659-K662 PolarHBondContact O-N 3.49Å
660	N	92.1	Very high	89.9	Confident	149 Å²	149	55.5 Å²	55.5	80%	0.797	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-65.6	-12.3	175.6	64.9	-26	0	0	0	113.9	A658	A658-N660 VanDerWaalsContact C-N 3.25Å; A658-N660 PolarHBondContact O-N 3.35Å
661	T	91.5	Very high	89.2	Confident	25 Å²	25	55.9 Å²	55.9	15%	0.153	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-94.4	7.1	179.5	69.2	0	0	0	0	113.6	W583 Q600 A658 E659 V663	W583-T661 WeakPolarHBondContact CH2-O 3.33Å; W583-T661 HydrophobicContact CZ2-CG2 4.49Å; Q600-T661 HydrophobicContact CB-CG2 4Å; Q600-T661 PolarHBondContact N-OG1 2.99Å; A658-T661 HydrophobicContact CB-CG2 3.82Å; A658-T661 WeakPolarHBondContact O-CB 3.33Å; A658-T661 PolarHBondContact O-N 3.2Å; A658-T661 PolarHBondContact O-OG1 3.46Å; E659-T661 PolarHBondContact O-N 3.01Å; E659-T661 VanDerWaalsContact O-N 3.16Å; T661-V663 PolarHBondContact O-N 2.98Å
662	K	93.1	Very high	88.4	Confident	119 Å²	119	61.6 Å²	61.6	52%	0.517	32%	0.321	S	S	.	.			trans	-49.8	123.5	-177.4	-170.5	176.4	176.9	-175	0	112.3	F599 E659	F599-K662 HydrophobicContact CD1-CB 3.99Å; F599-K662 HydrophobicContact CD1-CG 4.48Å; F599-K662 HydrophobicContact CE1-CB 3.38Å; F599-K662 HydrophobicContact CE1-CD 4.22Å; F599-K662 HydrophobicContact CE1-CG 3.66Å; F599-K662 HydrophobicContact CE2-CG 4.35Å; F599-K662 HydrophobicContact CZ-CB 3.88Å; F599-K662 HydrophobicContact CZ-CD 3.92Å; F599-K662 HydrophobicContact CZ-CG 3.57Å; E659-K662 PolarHBondContact O-N 3.49Å
663	V	91.8	Very high	88	Confident	8 Å²	8	60.9 Å²	60.9	5%	0.048	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	114.6	166.5	-177.6	0	0	0	0	109	L580 P581 W583 S597 L598 T661 V665 K688	L580-V663 HydrophobicContact CD2-CG1 3.93Å; P581-V663 HydrophobicContact CG-CG2 3.63Å; W583-V663 HydrophobicContact CH2-CG2 4.28Å; S597-V663 CarbonylContact C-O 3.55Å; S597-V663 WeakPolarHBondContact CA-O 3.36Å; L598-V663 PolarHBondContact N-O 3.27Å; L598-V663 PolarHBondContact O-N 2.75Å; T661-V663 PolarHBondContact O-N 2.98Å; V663-V665 HydrophobicContact CG1-CG1 3.95Å; V663-V665 PolarHBondContact O-N 3.01Å; V663-K688 HydrophobicContact CG1-CD 4.4Å
664	S	91.4	Very high	87.5	Confident	60 Å²	60	60.9 Å²	60.9	42%	0.42	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	130	171	-58.3	0	0	0	0	109.3	N685	S664-N685 PolarHBondContact O-ND2 3.22Å
665	V	92.1	Very high	87	Confident	9 Å²	9	66 Å²	66	6%	0.055	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	155.9	-176.2	-67.6	0	0	0	0	109.9	L580 I596 L598 V663 L683 K684	L580-V665 HydrophobicContact CD2-CG1 4.23Å; I596-V665 HydrophobicContact CB-CG2 4.34Å; I596-V665 HydrophobicContact CG2-CG2 3.85Å; I596-V665 PolarHBondContact O-N 2.97Å; L598-V665 HydrophobicContact CB-CG1 4.35Å; L598-V665 HydrophobicContact CB-CG2 4.29Å; V663-V665 HydrophobicContact CG1-CG1 3.95Å; V663-V665 PolarHBondContact O-N 3.01Å; V665-L683 HydrophobicContact CB-CB 4.4Å; V665-L683 HydrophobicContact CB-CD2 4.48Å; V665-L683 HydrophobicContact CG1-CB 4.49Å; V665-L683 HydrophobicContact CG2-CD1 4.43Å; V665-L683 HydrophobicContact CG2-CD2 4Å; V665-K684 CarbonylContact C-O 3.56Å; V665-K684 WeakPolarHBondContact CA-O 3.5Å
666	E	88	Confident	86.5	Confident	90 Å²	90	67 Å²	67	42%	0.421	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	143.1	169.9	-65.9	168	-152.9	0	0	108.5	K684	E666-K684 HydrophobicContact CB-CD 4.43Å; E666-K684 HydrophobicContact CB-CG 3.87Å; E666-K684 PolarHBondContact N-O 3.28Å; E666-K684 WeakPolarHBondContact O-CG 3.48Å; E666-K684 PolarHBondContact O-N 3.04Å; E666-K684 WeakPolarHBondContact OE2-CE 3.49Å; E666-K684 IonicContact OE2-NZ 3.58Å; E666-K684 PolarHBondContact OE2-NZ 3.1Å
667	T	82.5	Confident	86.2	Confident	37 Å²	37	71.4 Å²	71.4	23%	0.227	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	128	168.9	52	0	0	0	0	109	I596 S669 Y681 L683	I596-T667 HydrophobicContact CD1-CG2 3.64Å; T667-S669 VanDerWaalsContact CB-O 3.29Å; T667-S669 WeakPolarHBondContact CB-O 3.18Å; T667-S669 PolarHBondContact O-N 3.49Å; T667-S669 PolarHBondContact OG1-O 3.24Å; T667-Y681 HydrophobicContact CG2-CD1 4.22Å; T667-L683 HydrophobicContact CG2-CD2 4.17Å
668	T	74.5	Confident	86	Confident	42 Å²	42	69.8 Å²	69.8	26%	0.258	38%	0.376	S	S	.	.	S	Bend	trans	-61.8	-30.7	176.9	49.6	0	0	0	0	112.9	L214 T682 K684	L214-T668 HydrophobicContact CD1-CG2 3.63Å; T668-T682 HydrophobicContact CG2-CG2 4.26Å; T668-T682 PolarHBondContact N-O 3.44Å; T668-T682 WeakPolarHBondContact OG1-CB 3.35Å; T668-T682 PolarHBondContact OG1-O 2.05Å; T668-K684 HydrophobicContact CG2-CB 4.25Å; T668-K684 HydrophobicContact CG2-CD 3.97Å; T668-K684 HydrophobicContact CG2-CG 4.06Å
669	S	73.6	Confident	86	Confident	60 Å²	60	69.4 Å²	69.4	42%	0.42	37%	0.372	S	S	.	.	S	Bend	trans	-141.7	164.4	173.2	63.8	0	0	0	0	110.2	T667	T667-S669 VanDerWaalsContact CB-O 3.29Å; T667-S669 WeakPolarHBondContact CB-O 3.18Å; T667-S669 PolarHBondContact O-N 3.49Å; T667-S669 PolarHBondContact OG1-O 3.24Å
670	I	76.3	Confident	86.1	Confident	134 Å²	134	65 Å²	65	69%	0.687	35%	0.352	S	S	*	.			trans	-54.3	134	168.1	-60.7	171.4	0	0	0	107.9	Q672	I670-Q672 WeakPolarHBondContact O-CG 3.05Å; I670-Q672 PolarHBondContact O-N 3.36Å; I670-Q672 VanDerWaalsContact O-N 3.14Å
671	P	78.7	Confident	86.1	Confident	19 Å²	19	57.9 Å²	57.9	12%	0.123	31%	0.314	C	S	.	.			trans	-53.6	121.6	177.7	-26.9	34.9	0	0	0	110.9	F679 L680 Y681	P671-F679 HydrophobicContact CB-CB 4.33Å; P671-F679 HydrophobicContact CB-CD1 4.11Å; P671-L680 WeakPolarHBondContact CA-O 3.49Å; P671-Y681 HydrophobicContact CB-CD1 4.33Å; P671-Y681 HydrophobicContact CB-CE1 4.17Å; P671-Y681 HydrophobicContact CG-CD1 3.8Å; P671-Y681 HydrophobicContact CG-CE1 3.63Å
672	Q	79	Confident	86.1	Confident	138 Å²	138	57 Å²	57	65%	0.645	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	149.6	179.9	-69.3	-173.7	-15.8	0	0	110.2	I670 L680	I670-Q672 WeakPolarHBondContact O-CG 3.05Å; I670-Q672 PolarHBondContact O-N 3.36Å; I670-Q672 VanDerWaalsContact O-N 3.14Å; Q672-L680 PolarHBondContact O-N 3.45Å
673	R	85.1	Confident	86	Confident	102 Å²	102	51.4 Å²	51.4	39%	0.385	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	131.1	173.4	-69.5	-176.7	-174.7	-92.3	3.7	110.4	I250 N677 A678 F679	I250-R673 PolarHBondContact O-NH2 3.23Å; R673-N677 PolarHBondContact NH1-O 3.18Å; R673-N677 VanDerWaalsContact NH1-O 3.16Å; R673-A678 CarbonylContact C-O 3.48Å; R673-A678 VanDerWaalsContact CA-O 3.25Å; R673-A678 WeakPolarHBondContact CA-O 3.48Å; R673-F679 HydrophobicContact CG-CD1 4.16Å; R673-F679 HydrophobicContact CG-CE1 3.88Å; R673-F679 HydrophobicContact CG-CZ 4.15Å; R673-F679 VanDerWaalsContact CZ-CZ 3.41Å; R673-F679 VanDerWaalsContact NH2-CZ 3.32Å
674	T	85.1	Confident	85.8	Confident	31 Å²	31	54.2 Å²	54.2	19%	0.19	30%	0.296	C	S	.	.			trans	-79.5	178.3	171	66.1	0	0	0	0	110.6	E218 S676 N677 A678 L680	E218-T674 HydrophobicContact CG-CG2 4.46Å; T674-S676 PolarHBondContact O-N 3.4Å; T674-S676 PolarHBondContact OG1-N 3.4Å; T674-S676 PolarHBondContact OG1-OG 3Å; T674-N677 WeakPolarHBondContact O-CA 3.39Å; T674-N677 PolarHBondContact O-N 3.19Å; T674-A678 PolarHBondContact N-O 3.49Å; T674-A678 PolarHBondContact OG1-N 2.88Å; T674-A678 PolarHBondContact OG1-O 3.02Å; T674-L680 HydrophobicContact CG2-CB 3.82Å
675	T	83.1	Confident	85.7	Confident	157 Å²	157	52.2 Å²	52.2	96%	0.963	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.1	174.5	51.4	0	0	0	0	113.3	N677	T675-N677 PolarHBondContact O-N 3.4Å
676	S	83.4	Confident	85	Confident	57 Å²	57	55.3 Å²	55.3	40%	0.399	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	10.9	172.4	60.5	0	0	0	0	113.2	T674 A678	T674-S676 PolarHBondContact O-N 3.4Å; T674-S676 PolarHBondContact OG1-N 3.4Å; T674-S676 PolarHBondContact OG1-OG 3Å; S676-A678 PolarHBondContact O-N 3.15Å; S676-A678 VanDerWaalsContact O-N 3.13Å
677	N	88.1	Confident	84.7	Confident	101 Å²	101	59.2 Å²	59.2	54%	0.54	32%	0.32	S	S	.	.	S	Bend	trans	61.9	7.2	-171.8	-87.6	-19.9	0	0	0	115.4	R255 R673 T674 T675	R255-N677 WeakPolarHBondContact CD-O 2.98Å; R673-N677 PolarHBondContact NH1-O 3.18Å; R673-N677 VanDerWaalsContact NH1-O 3.16Å; T674-N677 WeakPolarHBondContact O-CA 3.39Å; T674-N677 PolarHBondContact O-N 3.19Å; T675-N677 PolarHBondContact O-N 3.4Å
678	A	92	Very high	84.7	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.008	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-73.8	143.8	176.7	0	0	0	0	0	111.7	E218 D219 R673 T674 S676	E218-A678 HydrophobicContact CB-CB 4.13Å; E218-A678 HydrophobicContact CG-CB 4.3Å; D219-A678 WeakPolarHBondContact OD1-CA 3.35Å; D219-A678 WeakPolarHBondContact OD1-CB 3.45Å; R673-A678 CarbonylContact C-O 3.48Å; R673-A678 VanDerWaalsContact CA-O 3.25Å; R673-A678 WeakPolarHBondContact CA-O 3.48Å; T674-A678 PolarHBondContact N-O 3.49Å; T674-A678 PolarHBondContact OG1-N 2.88Å; T674-A678 PolarHBondContact OG1-O 3.02Å; S676-A678 PolarHBondContact O-N 3.15Å; S676-A678 VanDerWaalsContact O-N 3.13Å
679	F	93.8	Very high	85.2	Confident	3 Å²	3	65.8 Å²	65.8	1%	0.013	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	121.7	171.9	-73.3	-82.2	0	0	0	110.2	E218 D219 I250 K251 T252 A253 R255 P671 R673 Y681	E218-F679 WeakPolarHBondContact CA-O 3.32Å; D219-F679 PolarHBondContact N-O 2.86Å; D219-F679 PolarHBondContact OD1-N 3.3Å; I250-F679 WeakPolarHBondContact O-CE2 3.11Å; I250-F679 WeakPolarHBondContact O-CZ 3.03Å; K251-F679 WeakPolarHBondContact O-CZ 3.32Å; T252-F679 VanDerWaalsContact C-CE1 3.42Å; A253-F679 VanDerWaalsContact C-CD2 3.48Å; A253-F679 WeakPolarHBondContact O-CB 3.47Å; A253-F679 VanDerWaalsContact O-CD2 3.25Å; A253-F679 WeakPolarHBondContact O-CD2 3.09Å; A253-F679 WeakPolarHBondContact O-CG 3.47Å; R255-F679 HydrophobicContact CG-CD2 4.06Å; R255-F679 HydrophobicContact CG-CE2 4.04Å; P671-F679 HydrophobicContact CB-CB 4.33Å; P671-F679 HydrophobicContact CB-CD1 4.11Å; R673-F679 HydrophobicContact CG-CD1 4.16Å; R673-F679 HydrophobicContact CG-CE1 3.88Å; R673-F679 HydrophobicContact CG-CZ 4.15Å; R673-F679 VanDerWaalsContact CZ-CZ 3.41Å; R673-F679 VanDerWaalsContact NH2-CZ 3.32Å; F679-Y681 HydrophobicContact CB-CE2 4Å; F679-Y681 WeakPolarHBondContact O-CD2 3.44Å
680	L	92.6	Very high	86.1	Confident	22 Å²	22	63 Å²	63	12%	0.115	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	124.3	176.3	-177.6	69.2	0	0	0	110.9	E216 Y217 E218 P671 Q672 T674	E216-L680 HydrophobicContact CB-CD1 4.27Å; Y217-L680 CarbonylContact O-C 3.22Å; Y217-L680 WeakPolarHBondContact O-CA 3.28Å; E218-L680 HydrophobicContact CG-CD1 3.97Å; P671-L680 WeakPolarHBondContact CA-O 3.49Å; Q672-L680 PolarHBondContact O-N 3.45Å; T674-L680 HydrophobicContact CG2-CB 3.82Å
681	Y	92.6	Very high	86.8	Confident	1 Å²	1	57.3 Å²	57.3	0%	0.004	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	116.1	173.5	-62.8	-94.6	0	0	0	109.3	E216 Y217 D219 A253 V496 V588 T667 P671 F679	E216-Y681 WeakPolarHBondContact CA-O 3.38Å; Y217-Y681 PolarHBondContact N-O 3.03Å; Y217-Y681 PolarHBondContact O-N 3.18Å; D219-Y681 HydrophobicContact CB-CE2 4.47Å; A253-Y681 PolarHBondContact O-OH 2.69Å; V496-Y681 HydrophobicContact CG1-CD2 3.98Å; V496-Y681 HydrophobicContact CG1-CE2 3.82Å; V588-Y681 HydrophobicContact CG1-CD1 4.46Å; V588-Y681 HydrophobicContact CG1-CE1 4.06Å; T667-Y681 HydrophobicContact CG2-CD1 4.22Å; P671-Y681 HydrophobicContact CB-CD1 4.33Å; P671-Y681 HydrophobicContact CB-CE1 4.17Å; P671-Y681 HydrophobicContact CG-CD1 3.8Å; P671-Y681 HydrophobicContact CG-CE1 3.63Å; F679-Y681 HydrophobicContact CB-CE2 4Å; F679-Y681 WeakPolarHBondContact O-CD2 3.44Å
682	T	90.9	Very high	87.4	Confident	5 Å²	5	56.4 Å²	56.4	3%	0.031	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	111	169.4	-56.9	0	0	0	0	109	R188 L214 E216 T668	R188-T682 HydrophobicContact CB-CG2 4.13Å; R188-T682 HydrophobicContact CG-CG2 4.32Å; L214-T682 HydrophobicContact CB-CG2 3.86Å; L214-T682 HydrophobicContact CD1-CG2 4.22Å; E216-T682 HydrophobicContact CG-CG2 4.41Å; T668-T682 HydrophobicContact CG2-CG2 4.26Å; T668-T682 PolarHBondContact N-O 3.44Å; T668-T682 WeakPolarHBondContact OG1-CB 3.35Å; T668-T682 PolarHBondContact OG1-O 2.05Å
683	L	90.7	Very high	88.1	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	136.4	-164.9	-56.1	178.9	0	0	0	111.5	P215 Y217 L598 V665 T667	P215-L683 PolarHBondContact O-N 3.48Å; Y217-L683 HydrophobicContact CD2-CD1 3.75Å; Y217-L683 HydrophobicContact CD2-CG 4.46Å; Y217-L683 HydrophobicContact CE2-CD1 4.02Å; L598-L683 HydrophobicContact CB-CD1 4.49Å; L598-L683 HydrophobicContact CD1-CD1 3.85Å; L598-L683 HydrophobicContact CD2-CD1 3.87Å; L598-L683 HydrophobicContact CG-CD1 4.28Å; V665-L683 HydrophobicContact CB-CB 4.4Å; V665-L683 HydrophobicContact CB-CD2 4.48Å; V665-L683 HydrophobicContact CG1-CB 4.49Å; V665-L683 HydrophobicContact CG2-CD1 4.43Å; V665-L683 HydrophobicContact CG2-CD2 4Å; T667-L683 HydrophobicContact CG2-CD2 4.17Å
684	K	89.4	Confident	88.3	Confident	68 Å²	68	46.7 Å²	46.7	30%	0.296	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	162.2	170.6	65	171.2	178	155.4	0	110.2	L214 V665 E666 T668	L214-K684 HydrophobicContact CD1-CB 4.42Å; L214-K684 HydrophobicContact CD2-CB 4.28Å; V665-K684 CarbonylContact C-O 3.56Å; V665-K684 WeakPolarHBondContact CA-O 3.5Å; E666-K684 HydrophobicContact CB-CD 4.43Å; E666-K684 HydrophobicContact CB-CG 3.87Å; E666-K684 PolarHBondContact N-O 3.28Å; E666-K684 WeakPolarHBondContact O-CG 3.48Å; E666-K684 PolarHBondContact O-N 3.04Å; E666-K684 WeakPolarHBondContact OE2-CE 3.49Å; E666-K684 IonicContact OE2-NZ 3.58Å; E666-K684 PolarHBondContact OE2-NZ 3.1Å; T668-K684 HydrophobicContact CG2-CB 4.25Å; T668-K684 HydrophobicContact CG2-CD 3.97Å; T668-K684 HydrophobicContact CG2-CG 4.06Å
685	N	87.8	Confident	88.3	Confident	18 Å²	18	47.9 Å²	47.9	10%	0.096	25%	0.247	C	C	.	.			trans	-143.3	133.9	174.4	175	-46.2	0	0	0	109	L580 S664 Q687 K688	L580-N685 HydrophobicContact CD1-CB 4.47Å; L580-N685 HydrophobicContact CD2-CB 3.57Å; L580-N685 HydrophobicContact CG-CB 4.28Å; S664-N685 PolarHBondContact O-ND2 3.22Å; N685-Q687 VanDerWaalsContact C-N 3.34Å; N685-Q687 PolarHBondContact O-N 3.01Å; N685-Q687 WeakPolarHBondContact OD1-CA 3.44Å; N685-Q687 WeakPolarHBondContact OD1-CB 3.43Å; N685-Q687 PolarHBondContact OD1-N 3.01Å; N685-K688 HydrophobicContact CB-CB 4.16Å; N685-K688 CarbonylContact O-C 3.56Å; N685-K688 PolarHBondContact OD1-N 3.33Å
686	S	77.1	Confident	88.3	Confident	73 Å²	73	40.5 Å²	40.5	51%	0.51	20%	0.201	S	C	.	.	S	Bend	trans	-68.4	-29.3	-176.3	53.8	0	0	0	0	113.8	R689	S686-R689 PolarHBondContact O-NE 3.17Å
687	Q	81.9	Confident	87.9	Confident	173 Å²	173	42.1 Å²	42.1	81%	0.808	20%	0.202	S	C	*	.	S	Bend	trans	-89.5	-39.7	177.3	-59.5	179.3	-9.2	0	0	112.4	N685	N685-Q687 VanDerWaalsContact C-N 3.34Å; N685-Q687 PolarHBondContact O-N 3.01Å; N685-Q687 WeakPolarHBondContact OD1-CA 3.44Å; N685-Q687 WeakPolarHBondContact OD1-CB 3.43Å; N685-Q687 PolarHBondContact OD1-N 3.01Å
688	K	83.2	Confident	87	Confident	89 Å²	89	38.2 Å²	38.2	39%	0.387	18%	0.181	S	C	.	.	S	Bend	trans	-103.3	77.5	-178.7	-69.8	179.5	174.4	-172	0	110.2	G579 L580 V663 N685	G579-K688 WeakPolarHBondContact O-CD 3.37Å; L580-K688 HydrophobicContact CD2-CB 4.16Å; L580-K688 HydrophobicContact CG-CB 4.3Å; V663-K688 HydrophobicContact CG1-CD 4.4Å; N685-K688 HydrophobicContact CB-CB 4.16Å; N685-K688 CarbonylContact O-C 3.56Å; N685-K688 PolarHBondContact OD1-N 3.33Å
689	R	85.3	Confident	85.8	Confident	127 Å²	127	42 Å²	42	48%	0.479	20%	0.201	S	C	.	.			trans	-78.7	155.5	-172.7	-54.8	-173.1	-174.7	179.4	-2	112.3	E184 G579 S686	E184-R689 WeakPolarHBondContact OE1-CD 3.39Å; E184-R689 IonicContact OE1-CZ 3.55Å; E184-R689 IonicContact OE1-NE 3.8Å; E184-R689 IonicContact OE1-NH1 2.74Å; E184-R689 PolarHBondContact OE1-NH1 2.84Å; E184-R689 VanDerWaalsContact OE2-CD 3.28Å; E184-R689 WeakPolarHBondContact OE2-CD 3.26Å; E184-R689 IonicContact OE2-CZ 2.92Å; E184-R689 IonicContact OE2-NE 2.63Å; E184-R689 IonicContact OE2-NH1 2.69Å; E184-R689 PolarHBondContact OE2-NH1 2.93Å; G579-R689 PolarHBondContact N-O 3.14Å; G579-R689 VanDerWaalsContact N-O 3.16Å; S686-R689 PolarHBondContact O-NE 3.17Å
690	S	91.1	Very high	84.4	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.014	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129	168.8	-56	0	0	0	0	108.4	V185 K577 T578	V185-S690 PolarHBondContact N-O 3.12Å; K577-S690 CarbonylContact O-C 3.49Å; K577-S690 WeakPolarHBondContact O-CA 3.44Å; T578-S690 VanDerWaalsContact CB-OG 3.32Å; T578-S690 WeakPolarHBondContact CB-OG 3.29Å; T578-S690 PolarHBondContact OG1-OG 3.17Å
691	T	92.1	Very high	83.2	Confident	14 Å²	14	44.4 Å²	44.4	9%	0.086	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	148	-171.5	56.8	0	0	0	0	111.3	K182 K183 E184 H576 K577	K182-T691 VanDerWaalsContact CE-CG2 3.4Å; K182-T691 WeakPolarHBondContact CE-OG1 3.48Å; K182-T691 HydrophobicContact CG-CG2 4.4Å; K183-T691 VanDerWaalsContact O-CA 3.31Å; K183-T691 WeakPolarHBondContact O-CA 3.33Å; E184-T691 HydrophobicContact CG-CG2 3.97Å; H576-T691 WeakPolarHBondContact CA-O 2.97Å; K577-T691 PolarHBondContact N-O 3Å; K577-T691 PolarHBondContact O-N 3.39Å
692	I	92.2	Very high	82.2	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	124.3	164	-59.8	-171.8	0	0	0	107.3	K183 V185 L192 F194 V208 I211 L213 L574 E575 H576	K183-I692 PolarHBondContact N-O 2.91Å; K183-I692 PolarHBondContact O-N 2.95Å; V185-I692 HydrophobicContact CG2-CD1 4.46Å; V185-I692 HydrophobicContact CG2-CG1 4.19Å; L192-I692 HydrophobicContact CD1-CB 4.32Å; L192-I692 HydrophobicContact CD1-CD1 4.33Å; L192-I692 HydrophobicContact CD1-CG1 4.47Å; F194-I692 HydrophobicContact CE2-CG2 4.34Å; F194-I692 HydrophobicContact CZ-CB 4.36Å; F194-I692 HydrophobicContact CZ-CG2 4.06Å; V208-I692 HydrophobicContact CB-CD1 4.44Å; V208-I692 HydrophobicContact CG1-CD1 3.81Å; I211-I692 HydrophobicContact CD1-CD1 3.7Å; I211-I692 HydrophobicContact CG1-CD1 4.07Å; I211-I692 HydrophobicContact CG2-CD1 4.09Å; L213-I692 HydrophobicContact CD1-CD1 3.86Å; L213-I692 HydrophobicContact CD1-CG1 3.67Å; L574-I692 HydrophobicContact CD1-CG2 4.22Å; L574-I692 HydrophobicContact CD2-CG2 3.97Å; L574-I692 HydrophobicContact CG-CG2 3.91Å; E575-I692 WeakPolarHBondContact O-CA 3.35Å; H576-I692 HydrophobicContact CB-CG1 4.19Å
693	E	92.4	Very high	81	Confident	37 Å²	37	44.4 Å²	44.4	17%	0.173	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131.9	178.1	-171.6	173.3	179.9	0	0	109.3	S180 Y181 K182 E575 K695	S180-E693 PolarHBondContact OG-OE1 3.48Å; Y181-E693 CarbonylContact O-C 3.53Å; Y181-E693 WeakPolarHBondContact O-CA 3.42Å; K182-E693 HydrophobicContact CB-CB 4.31Å; K182-E693 HydrophobicContact CB-CG 4.05Å; K182-E693 HydrophobicContact CG-CB 4.18Å; K182-E693 HydrophobicContact CG-CG 4.37Å; E575-E693 PolarHBondContact N-O 3.22Å; E575-E693 PolarHBondContact O-N 3.01Å; E693-K695 HydrophobicContact CG-CG 4.31Å; E693-K695 WeakPolarHBondContact OE1-CE 3.42Å; E693-K695 IonicContact OE1-NZ 2.85Å; E693-K695 IonicContact OE2-NZ 2.64Å
694	I	89.3	Confident	79.8	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	124.3	173.9	-58.7	-167.8	0	0	0	107.7	S180 Y181 F194 L196 I206 I572 Y573 L574	S180-I694 CarbonylContact C-O 3.54Å; S180-I694 VanDerWaalsContact CA-O 3.23Å; S180-I694 WeakPolarHBondContact CA-O 3.33Å; Y181-I694 PolarHBondContact N-O 3.01Å; Y181-I694 PolarHBondContact O-N 2.68Å; F194-I694 HydrophobicContact CB-CD1 3.63Å; F194-I694 HydrophobicContact CD1-CB 4.48Å; F194-I694 HydrophobicContact CD1-CD1 3.78Å; F194-I694 HydrophobicContact CD1-CG1 4.01Å; F194-I694 HydrophobicContact CD2-CD1 3.41Å; F194-I694 VanDerWaalsContact CD2-CD1 3.41Å; F194-I694 HydrophobicContact CD2-CG1 4.27Å; F194-I694 HydrophobicContact CE1-CD1 4.22Å; F194-I694 HydrophobicContact CE1-CG1 4.1Å; F194-I694 HydrophobicContact CE2-CD1 3.9Å; F194-I694 HydrophobicContact CE2-CG1 4.36Å; F194-I694 HydrophobicContact CG-CD1 3.34Å; F194-I694 HydrophobicContact CG-CG1 4.09Å; F194-I694 HydrophobicContact CZ-CD1 4.27Å; F194-I694 HydrophobicContact CZ-CG1 4.28Å; L196-I694 HydrophobicContact CD1-CG2 4.12Å; L196-I694 HydrophobicContact CD2-CG2 4.31Å; I206-I694 HydrophobicContact CB-CD1 3.93Å; I206-I694 HydrophobicContact CD1-CD1 3.72Å; I206-I694 HydrophobicContact CD1-CG2 3.97Å; I206-I694 HydrophobicContact CG1-CD1 4.42Å; I206-I694 HydrophobicContact CG2-CD1 3.75Å; I572-I694 HydrophobicContact CG2-CG2 3.71Å; Y573-I694 CarbonylContact O-C 3.57Å; Y573-I694 VanDerWaalsContact O-CA 3.29Å; Y573-I694 WeakPolarHBondContact O-CA 2.96Å; L574-I694 HydrophobicContact CD1-CD1 4.42Å; L574-I694 HydrophobicContact CG-CG1 4.42Å
695	K	85.4	Confident	78.6	Confident	56 Å²	56	46 Å²	46	24%	0.243	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.2	174	-65.5	168.5	-174.2	154.3	0	108.6	M179 Y573 E575 E693	M179-K695 CarbonylContact O-C 3.56Å; M179-K695 WeakPolarHBondContact O-CA 3.2Å; Y573-K695 PolarHBondContact N-O 3.28Å; Y573-K695 PolarHBondContact O-N 2.97Å; E575-K695 IonicContact OE2-NZ 3.92Å; E575-K695 PolarHBondContact OE2-NZ 3.18Å; E693-K695 HydrophobicContact CG-CG 4.31Å; E693-K695 WeakPolarHBondContact OE1-CE 3.42Å; E693-K695 IonicContact OE1-NZ 2.85Å; E693-K695 IonicContact OE2-NZ 2.64Å
696	S	82.8	Confident	77.6	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.007	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	133	169.3	56.1	0	0	0	0	110.4	Q178 M179 Y198 N571	Q178-S696 WeakPolarHBondContact CG-O 3.44Å; M179-S696 WeakPolarHBondContact CB-OG 3.5Å; M179-S696 PolarHBondContact N-OG 2.93Å; M179-S696 VanDerWaalsContact N-OG 3.15Å; M179-S696 PolarHBondContact O-N 3.42Å; M179-S696 PolarHBondContact O-OG 2.94Å; Y198-S696 WeakPolarHBondContact OH-CB 3.3Å; Y198-S696 PolarHBondContact OH-OG 3.32Å; N571-S696 CarbonylContact O-C 3.54Å; N571-S696 WeakPolarHBondContact O-CA 3.39Å
697	H	75.2	Confident	76.7	Confident	92 Å²	92	42.1 Å²	42.1	43%	0.426	19%	0.192	S	C	.	.			trans	-137.3	91.5	171.1	-176	-87.3	0	0	0	107.4	N571 Y573 N699	N571-H697 WeakPolarHBondContact CA-O 3.26Å; N571-H697 CarbonylContact O-C 3.57Å; N571-H697 PolarHBondContact O-N 3.49Å; Y573-H697 HydrophobicContact CD2-CB 4.47Å; Y573-H697 HydrophobicContact CE2-CB 3.8Å; H697-N699 PolarHBondContact CE1-OD1 3.41Å; H697-N699 PolarHBondContact ND1-ND2 3.42Å; H697-N699 PolarHBondContact ND1-OD1 2.99Å; H697-N699 PolarHBondContact O-N 3.41Å; H697-N699 VanDerWaalsContact O-N 3.11Å
698	I	69.7	Low	75.7	Confident	18 Å²	18	35.7 Å²	35.7	9%	0.092	17%	0.166	C	C	.	.			trans	-79.9	102.4	-169.7	-62.9	173.7	0	0	0	108.5	L175 Y198 N571 H700 L702	L175-I698 HydrophobicContact CB-CB 4.27Å; L175-I698 HydrophobicContact CB-CD1 3.65Å; L175-I698 HydrophobicContact CB-CG2 4.19Å; L175-I698 HydrophobicContact CD1-CD1 4.1Å; L175-I698 HydrophobicContact CD1-CG2 4.13Å; L175-I698 HydrophobicContact CD2-CD1 3.78Å; L175-I698 HydrophobicContact CG-CD1 4.05Å; Y198-I698 HydrophobicContact CD1-CD1 4.11Å; Y198-I698 HydrophobicContact CE1-CD1 3.4Å; Y198-I698 HydrophobicContact CE2-CD1 4.3Å; N571-I698 HydrophobicContact CB-CG1 4.46Å; N571-I698 WeakPolarHBondContact OD1-CA 3.26Å; I698-H700 WeakPolarHBondContact CG2-O 3.37Å; I698-L702 HydrophobicContact CD1-CD1 3.78Å; I698-L702 HydrophobicContact CD1-CG 4.33Å; I698-L702 HydrophobicContact CG1-CD1 4.45Å
699	N	65.6	Low	74.5	Confident	82 Å²	82	35 Å²	35	44%	0.439	17%	0.166	S	C	.	.	S	Bend	trans	-95.4	-27.4	173.8	-74.5	-28.7	0	0	0	111.8	N571 H697	N571-N699 PolarHBondContact OD1-N 2.94Å; H697-N699 PolarHBondContact CE1-OD1 3.41Å; H697-N699 PolarHBondContact ND1-ND2 3.42Å; H697-N699 PolarHBondContact ND1-OD1 2.99Å; H697-N699 PolarHBondContact O-N 3.41Å; H697-N699 VanDerWaalsContact O-N 3.11Å
700	H	65.6	Low	73	Confident	70 Å²	70	31 Å²	31	32%	0.324	16%	0.155	S	C	.	.	S	Bend	trans	-130.8	154	-175.5	-61.4	-65.4	0	0	0	109.9	E152 N569 N571 I698 L702	E152-H700 IonicContact OE1-ND1 3.19Å; N569-H700 PolarHBondContact ND2-CD2 2.8Å; N571-H700 PolarHBondContact ND2-O 3.42Å; N571-H700 PolarHBondContact OD1-N 3.4Å; N571-H700 PolarHBondContact OD1-O 2.94Å; I698-H700 WeakPolarHBondContact CG2-O 3.37Å; H700-L702 PolarHBondContact O-N 2.93Å; H700-L702 VanDerWaalsContact O-N 3.16Å
701	S	66.1	Low	70.8	Confident	5 Å²	5	34 Å²	34	4%	0.035	19%	0.185	C	C	.	.			trans	-52.7	121.7	171.6	166.5	0	0	0	0	111.9	I155 E170 L703 Y704 T705	I155-S701 WeakPolarHBondContact CD1-OG 3.44Å; E170-S701 VanDerWaalsContact OE2-CA 3.29Å; E170-S701 WeakPolarHBondContact OE2-CA 3.38Å; E170-S701 VanDerWaalsContact OE2-CB 3.24Å; E170-S701 WeakPolarHBondContact OE2-CB 3.32Å; E170-S701 PolarHBondContact OE2-OG 2.97Å; S701-L703 PolarHBondContact O-N 3.46Å; S701-L703 PolarHBondContact OG-N 2.97Å; S701-Y704 WeakPolarHBondContact O-CB 3.44Å; S701-Y704 PolarHBondContact O-N 3.48Å; S701-Y704 PolarHBondContact OG-N 3.32Å; S701-T705 PolarHBondContact O-N 3.23Å; S701-T705 VanDerWaalsContact O-N 3.07Å; S701-T705 PolarHBondContact O-OG1 3.04Å
702	L	71.8	Confident	68.4	Low	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.8	-35.4	171.6	-74.8	173.7	0	0	0	110.4	E170 Y198 I202 V204 L511 W568 N571 I572 I698 H700 T705 A706	E170-L702 WeakPolarHBondContact OE1-CB 3.46Å; E170-L702 PolarHBondContact OE1-N 2.82Å; E170-L702 PolarHBondContact OE2-N 3.41Å; E170-L702 VanDerWaalsContact OE2-N 3.11Å; Y198-L702 HydrophobicContact CD2-CD1 4.2Å; Y198-L702 HydrophobicContact CE2-CD1 3.71Å; I202-L702 HydrophobicContact CG2-CD1 4.26Å; V204-L702 HydrophobicContact CG2-CD1 4.04Å; L511-L702 HydrophobicContact CD1-CB 4.03Å; W568-L702 HydrophobicContact CB-CD2 4.11Å; N571-L702 HydrophobicContact CB-CD2 3.74Å; I572-L702 HydrophobicContact CD1-CD2 4.37Å; I698-L702 HydrophobicContact CD1-CD1 3.78Å; I698-L702 HydrophobicContact CD1-CG 4.33Å; I698-L702 HydrophobicContact CG1-CD1 4.45Å; H700-L702 PolarHBondContact O-N 2.93Å; H700-L702 VanDerWaalsContact O-N 3.16Å; L702-T705 PolarHBondContact O-N 3.23Å; L702-A706 WeakPolarHBondContact O-CB 3.49Å; L702-A706 PolarHBondContact O-N 3.34Å
703	L	66.4	Low	65.8	Low	6 Å²	6	43 Å²	43	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-68.5	-43	179.3	-161.4	59	0	0	0	112.2	I155 L157 E170 L513 S701 T705 A706 A707	I155-L703 HydrophobicContact CB-CD2 4.31Å; I155-L703 HydrophobicContact CG2-CD2 3.91Å; I155-L703 HydrophobicContact CG2-CG 4.34Å; L157-L703 HydrophobicContact CD1-CD1 3.65Å; L157-L703 HydrophobicContact CD1-CD2 3.77Å; L157-L703 HydrophobicContact CD1-CG 4.03Å; L157-L703 HydrophobicContact CG-CD2 3.85Å; L157-L703 HydrophobicContact CG-CG 4.41Å; E170-L703 WeakPolarHBondContact OE2-CB 3.47Å; E170-L703 PolarHBondContact OE2-N 3.49Å; L513-L703 HydrophobicContact CD1-CD1 4.11Å; L513-L703 HydrophobicContact CD2-CD1 4.45Å; S701-L703 PolarHBondContact O-N 3.46Å; S701-L703 PolarHBondContact OG-N 2.97Å; L703-T705 VanDerWaalsContact C-N 3.32Å; L703-T705 PolarHBondContact O-N 2.91Å; L703-A706 PolarHBondContact O-N 3.34Å; L703-A707 WeakPolarHBondContact O-CB 3.33Å; L703-A707 PolarHBondContact O-N 3.38Å
704	Y	64.7	Low	63.2	Low	98 Å²	98	44.4 Å²	44.4	38%	0.384	24%	0.243	S	C	.	.	H	α-helix	trans	-55.5	-51.4	171	-174	-110.5	0	0	0	110.7	I155 S701 A706 A707 C708 F714	I155-Y704 VanDerWaalsContact CD1-CB 3.45Å; I155-Y704 HydrophobicContact CD1-CD2 3.91Å; I155-Y704 HydrophobicContact CD1-CG 4.1Å; S701-Y704 WeakPolarHBondContact O-CB 3.44Å; S701-Y704 PolarHBondContact O-N 3.48Å; S701-Y704 PolarHBondContact OG-N 3.32Å; Y704-A706 VanDerWaalsContact C-N 3.3Å; Y704-A706 PolarHBondContact O-N 2.88Å; Y704-A707 PolarHBondContact O-N 2.84Å; Y704-C708 VanDerWaalsContact CE1-SG 3.53Å; Y704-C708 WeakPolarHBondContact O-CB 3.42Å; Y704-C708 PolarHBondContact O-N 3.32Å; Y704-C708 PolarHBondContact O-SG 3.17Å; Y704-C708 VanDerWaalsContact O-SG 3.36Å; Y704-F714 HydrophobicContact CD2-CD2 4.42Å; Y704-F714 AromaticContact CD2-CE2 3.72Å; Y704-F714 HydrophobicContact CD2-CE2 3.72Å; Y704-F714 AromaticContact CD2-CZ 3.9Å; Y704-F714 HydrophobicContact CD2-CZ 3.9Å; Y704-F714 HydrophobicContact CE2-CD2 4.25Å; Y704-F714 AromaticContact CE2-CE2 3.92Å; Y704-F714 HydrophobicContact CE2-CE2 3.92Å
705	T	65.3	Low	60.6	Low	5 Å²	5	49.2 Å²	49.2	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-59.1	-44.2	-179.3	-56.8	0	0	0	0	111.3	W568 N569 S701 L702 L703 C708 L709	W568-T705 VanDerWaalsContact C-CG2 3.49Å; W568-T705 HydrophobicContact CB-CG2 4.25Å; W568-T705 HydrophobicContact CE3-CG2 4.19Å; N569-T705 HydrophobicContact CB-CG2 3.59Å; S701-T705 PolarHBondContact O-N 3.23Å; S701-T705 VanDerWaalsContact O-N 3.07Å; S701-T705 PolarHBondContact O-OG1 3.04Å; L702-T705 PolarHBondContact O-N 3.23Å; L703-T705 VanDerWaalsContact C-N 3.32Å; L703-T705 PolarHBondContact O-N 2.91Å; T705-C708 PolarHBondContact O-N 3.05Å; T705-L709 HydrophobicContact CG2-CD1 3.77Å; T705-L709 HydrophobicContact CG2-CG 4.28Å; T705-L709 WeakPolarHBondContact O-CB 3.3Å; T705-L709 VanDerWaalsContact O-CG 3.26Å; T705-L709 WeakPolarHBondContact O-CG 3.37Å; T705-L709 PolarHBondContact O-N 2.82Å
706	A	65.8	Low	58	Low	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.4	-45.4	177.2	0	0	0	0	0	112.1	L511 W568 L702 L703 Y704 N710	L511-A706 HydrophobicContact CD1-CB 4.44Å; W568-A706 HydrophobicContact CE3-CB 4.42Å; W568-A706 HydrophobicContact CZ3-CB 3.67Å; L702-A706 WeakPolarHBondContact O-CB 3.49Å; L702-A706 PolarHBondContact O-N 3.34Å; L703-A706 PolarHBondContact O-N 3.34Å; Y704-A706 VanDerWaalsContact C-N 3.3Å; Y704-A706 PolarHBondContact O-N 2.88Å; A706-N710 WeakPolarHBondContact O-CB 3.43Å; A706-N710 VanDerWaalsContact O-CG 3.24Å; A706-N710 PolarHBondContact O-N 3.35Å; A706-N710 VanDerWaalsContact O-N 3.12Å; A706-N710 PolarHBondContact O-ND2 3.43Å
707	A	59.5	Low	55.6	Low	9 Å²	9	55.9 Å²	55.9	7%	0.074	31%	0.312	C	S	.	.	H	α-helix	trans	-65.2	-42.9	177.7	0	0	0	0	0	112.3	L703 Y704 N710 G711 L712 F714	L703-A707 WeakPolarHBondContact O-CB 3.33Å; L703-A707 PolarHBondContact O-N 3.38Å; Y704-A707 PolarHBondContact O-N 2.84Å; A707-N710 CarbonylContact O-C 3.52Å; A707-N710 PolarHBondContact O-N 3.04Å; A707-G711 PolarHBondContact O-N 3.41Å; A707-L712 HydrophobicContact CB-CB 3.95Å; A707-L712 HydrophobicContact CB-CD1 4.31Å; A707-L712 PolarHBondContact O-N 3.06Å; A707-F714 HydrophobicContact CB-CD2 4.46Å; A707-F714 HydrophobicContact CB-CE1 4.03Å; A707-F714 HydrophobicContact CB-CE2 3.33Å; A707-F714 HydrophobicContact CB-CZ 3.07Å
708	C	60.3	Low	53.4	Low	38 Å²	38	59.4 Å²	59.4	26%	0.257	33%	0.326	S	S	.	.	H	α-helix	trans	-61.7	-46.9	176.3	-73	0	0	0	0	112.3	Y704 T705 N710 G711	Y704-C708 VanDerWaalsContact CE1-SG 3.53Å; Y704-C708 WeakPolarHBondContact O-CB 3.42Å; Y704-C708 PolarHBondContact O-N 3.32Å; Y704-C708 PolarHBondContact O-SG 3.17Å; Y704-C708 VanDerWaalsContact O-SG 3.36Å; T705-C708 PolarHBondContact O-N 3.05Å; C708-N710 PolarHBondContact O-N 2.9Å; C708-G711 PolarHBondContact O-N 3.1Å
709	L	58.8	Low	51.6	Low	75 Å²	75	64.2 Å²	64.2	39%	0.393	36%	0.358	S	S	.	.	H	α-helix	trans	-64.2	-24.9	177.9	-72.4	172	0	0	0	112.7	L528 W568 T705	L528-L709 HydrophobicContact CD1-CD1 3.87Å; W568-L709 HydrophobicContact CE3-CD1 4.05Å; W568-L709 HydrophobicContact CZ3-CD1 4.3Å; T705-L709 HydrophobicContact CG2-CD1 3.77Å; T705-L709 HydrophobicContact CG2-CG 4.28Å; T705-L709 WeakPolarHBondContact O-CB 3.3Å; T705-L709 VanDerWaalsContact O-CG 3.26Å; T705-L709 WeakPolarHBondContact O-CG 3.37Å; T705-L709 PolarHBondContact O-N 2.82Å
710	N	52.5	Low	50.1	Low	44 Å²	44	66.2 Å²	66.2	24%	0.235	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	4.3	179.3	-65.8	-46.4	0	0	0	113.8	P526 A706 A707 C708 L712	P526-N710 WeakPolarHBondContact CD-OD1 3.41Å; P526-N710 WeakPolarHBondContact CG-OD1 3.32Å; A706-N710 WeakPolarHBondContact O-CB 3.43Å; A706-N710 VanDerWaalsContact O-CG 3.24Å; A706-N710 PolarHBondContact O-N 3.35Å; A706-N710 VanDerWaalsContact O-N 3.12Å; A706-N710 PolarHBondContact O-ND2 3.43Å; A707-N710 CarbonylContact O-C 3.52Å; A707-N710 PolarHBondContact O-N 3.04Å; C708-N710 PolarHBondContact O-N 2.9Å; N710-L712 HydrophobicContact CB-CD1 4.46Å; N710-L712 HydrophobicContact CB-CG 4.27Å; N710-L712 PolarHBondContact O-N 3.48Å
711	G	44.8	Very low	48.4	Very low	63 Å²	63	66.4 Å²	66.4	65%	0.649	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	20.5	-179.2	0	0	0	0	0	114.6	A707 C708 T713	A707-G711 PolarHBondContact O-N 3.41Å; C708-G711 PolarHBondContact O-N 3.1Å; G711-T713 PolarHBondContact O-N 3.06Å
712	L	42.5	Very low	46.7	Very low	74 Å²	74	74.1 Å²	74.1	39%	0.387	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-72.5	125.5	177.1	-67.6	173.7	0	0	0	109.7	W523 A707 N710	W523-L712 HydrophobicContact CZ2-CD1 4.13Å; A707-L712 HydrophobicContact CB-CB 3.95Å; A707-L712 HydrophobicContact CB-CD1 4.31Å; A707-L712 PolarHBondContact O-N 3.06Å; N710-L712 HydrophobicContact CB-CD1 4.46Å; N710-L712 HydrophobicContact CB-CG 4.27Å; N710-L712 PolarHBondContact O-N 3.48Å
713	T	36.3	Very low	44.7	Very low	130 Å²	130	79.2 Å²	79.2	80%	0.798	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-79.3	127.8	-179.2	47.2	0	0	0	0	111.6	G711	G711-T713 PolarHBondContact O-N 3.06Å
714	F	39.2	Very low	43	Very low	67 Å²	67	85.9 Å²	85.9	29%	0.294	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-94.5	131.5	172.4	-67.8	-80.4	0	0	0	111.1	I155 Y704 A707 V765	I155-F714 HydrophobicContact CG2-CE1 4.11Å; Y704-F714 HydrophobicContact CD2-CD2 4.42Å; Y704-F714 AromaticContact CD2-CE2 3.72Å; Y704-F714 HydrophobicContact CD2-CE2 3.72Å; Y704-F714 AromaticContact CD2-CZ 3.9Å; Y704-F714 HydrophobicContact CD2-CZ 3.9Å; Y704-F714 HydrophobicContact CE2-CD2 4.25Å; Y704-F714 AromaticContact CE2-CE2 3.92Å; Y704-F714 HydrophobicContact CE2-CE2 3.92Å; A707-F714 HydrophobicContact CB-CD2 4.46Å; A707-F714 HydrophobicContact CB-CE1 4.03Å; A707-F714 HydrophobicContact CB-CE2 3.33Å; A707-F714 HydrophobicContact CB-CZ 3.07Å; F714-V765 HydrophobicContact CD1-CB 4.26Å; F714-V765 HydrophobicContact CD1-CG1 3.64Å; F714-V765 HydrophobicContact CD1-CG2 3.59Å; F714-V765 HydrophobicContact CE1-CB 4.38Å; F714-V765 HydrophobicContact CE1-CG1 3.75Å; F714-V765 HydrophobicContact CE1-CG2 3.73Å
715	T	33.8	Very low	41.4	Very low	101 Å²	101	90 Å²	90	62%	0.62	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-99.5	120.7	168.8	48.3	0	0	0	0	110.2	S717	T715-S717 PolarHBondContact O-N 3.36Å
716	Q	31.6	Very low	39.6	Very low	127 Å²	127	96.9 Å²	96.9	59%	0.593	55%	0.549	S	S	*	.			trans	-80.1	113.6	172.4	-175.4	177.5	32.9	0	0	109.8	K718 W763	Q716-K718 PolarHBondContact O-N 3.47Å; Q716-W763 HydrophobicContact CB-CE3 4.48Å; Q716-W763 HydrophobicContact CB-CZ3 3.81Å; Q716-W763 HydrophobicContact CG-CE3 4.25Å; Q716-W763 HydrophobicContact CG-CH2 4Å; Q716-W763 HydrophobicContact CG-CZ3 3.52Å
717	S	32.8	Very low	37.8	Very low	70 Å²	70	103.6 Å²	103.6	49%	0.49	59%	0.586	S	S	.	*			trans	-82.7	107.8	166.3	56	0	0	0	0	109.3	T715	T715-S717 PolarHBondContact O-N 3.36Å
718	K	28.3	Very low	36.3	Very low	166 Å²	166	109.2 Å²	109.2	72%	0.722	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-72.4	124.9	168.6	-72.9	-176.9	179.9	176.9	0	108.5	Q716 N720	Q716-K718 PolarHBondContact O-N 3.47Å; K718-N720 PolarHBondContact O-N 2.83Å
719	P	32.7	Very low	35	Very low	118 Å²	118	113.9 Å²	113.9	77%	0.766	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-65.4	121.9	171.4	25.7	-30.3	0	0	0	108.2	G721	P719-G721 PolarHBondContact O-N 2.96Å
720	N	32.3	Very low	33.5	Very low	124 Å²	124	114.8 Å²	114.8	66%	0.663	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-56.1	123.1	174.8	-84.6	-7.1	0	0	0	108.4	K718 F722	K718-N720 PolarHBondContact O-N 2.83Å; N720-F722 PolarHBondContact O-N 2.71Å
721	G	30.5	Very low	32.4	Very low	74 Å²	74	120.7 Å²	120.7	76%	0.763	69%	0.693	S	S	*	*			trans	-52.6	115.5	172.7	0	0	0	0	0	108.5	P719 S723	P719-G721 PolarHBondContact O-N 2.96Å; G721-S723 VanDerWaalsContact C-N 3.32Å; G721-S723 PolarHBondContact O-N 2.92Å
722	F	30.8	Very low	31.5	Very low	167 Å²	167	126 Å²	126	73%	0.732	70%	0.701	S	S	*	*			trans	-61.4	97.3	172.3	-86.2	-101.8	0	0	0	107.3	N720 D724	N720-F722 PolarHBondContact O-N 2.71Å; F722-D724 VanDerWaalsContact C-N 3.33Å; F722-D724 PolarHBondContact O-N 2.66Å; F722-D724 VanDerWaalsContact O-N 3.1Å
723	S	30.4	Very low	30.8	Very low	108 Å²	108	131.7 Å²	131.7	76%	0.755	72%	0.723	S	S	*	*			trans	-73.2	97.4	162.3	59.2	0	0	0	0	106.4	G721 K725	G721-S723 VanDerWaalsContact C-N 3.32Å; G721-S723 PolarHBondContact O-N 2.92Å; S723-K725 PolarHBondContact O-N 3.39Å
724	D	30.4	Very low	30.4	Very low	145 Å²	145	135.3 Å²	135.3	78%	0.775	72%	0.723	S	S	*	*			trans	-62.8	76.3	171.4	-75.4	-30.8	0	0	0	110.4	F722	F722-D724 VanDerWaalsContact C-N 3.33Å; F722-D724 PolarHBondContact O-N 2.66Å; F722-D724 VanDerWaalsContact O-N 3.1Å
725	K	30.1	Very low	29.6	Very low	184 Å²	184	142.1 Å²	142.1	80%	0.8	75%	0.753	S	S	*	*			trans	-143	87.8	163.8	-74.6	-164.6	178	178.1	0	110.5	S723	S723-K725 PolarHBondContact O-N 3.39Å
726	I	28.2	Very low	29.2	Very low	150 Å²	150	143.8 Å²	143.8	77%	0.769	76%	0.763	S	S	*	*				44.7	112.6	129.2	-57.6	171.2	0	0	0	117
727	N	28	Very low	28.8	Very low	142 Å²	142	147 Å²	147	76%	0.759	78%	0.778	S	S	*	*			trans	48	91.3	145.3	-57.4	-17.4	0	0	0	117.8
728	T	28.7	Very low	28.4	Very low	126 Å²	126	152.6 Å²	152.6	77%	0.773	80%	0.796	S	S	*	*				171.9	139.2	107.1	30.3	0	0	0	0	108.8	S730	T728-S730 PolarHBondContact O-N 3.12Å; T728-S730 VanDerWaalsContact O-N 3.08Å
729	P	31.7	Very low	28.2	Very low	137 Å²	137	151.8 Å²	151.8	89%	0.89	81%	0.805	S	S	*	*			trans	-81.5	94	-174.9	32.2	-29.9	0	0	0	109
730	S	27.7	Very low	27.7	Very low	93 Å²	93	149.4 Å²	149.4	65%	0.65	80%	0.802	S	S	*	*			trans	-107.5	125.3	162.6	58.4	0	0	0	0	109	T728 E732	T728-S730 PolarHBondContact O-N 3.12Å; T728-S730 VanDerWaalsContact O-N 3.08Å; S730-E732 PolarHBondContact O-N 3.39Å
731	D	29.3	Very low	27.3	Very low	169 Å²	169	154.9 Å²	154.9	90%	0.904	81%	0.814	S	S	*	*			trans	-48.9	91.8	-177	-61.9	-53.9	0	0	0	114	K733	D731-K733 PolarHBondContact O-N 3.48Å
732	E	26.4	Very low	26.9	Very low	173 Å²	173	158.6 Å²	158.6	81%	0.808	82%	0.815	S	S	*	*			trans	-86.4	109.2	167.9	-78.8	-169.2	162.8	0	0	110.6	S730 Y734	S730-E732 PolarHBondContact O-N 3.39Å; E732-Y734 PolarHBondContact O-N 2.89Å
733	K	28.1	Very low	26.5	Very low	195 Å²	195	159.8 Å²	159.8	85%	0.848	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-64.1	123.2	173.9	-77.5	173.7	173.7	173.6	0	111.2	D731	D731-K733 PolarHBondContact O-N 3.48Å
734	Y	27.7	Very low	26.4	Very low	205 Å²	205	159.8 Å²	159.8	80%	0.804	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-64.6	133.6	172.6	-60.8	-88.3	0	0	0	112.1	E732	E732-Y734 PolarHBondContact O-N 2.89Å
735	F	22.9	Very low	26	Very low	211 Å²	211	160.5 Å²	160.5	93%	0.925	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-93.1	123.3	169.4	-95.5	-91.9	0	0	0	110.5
736	T	25.5	Very low	25.7	Very low	135 Å²	135	155.7 Å²	155.7	83%	0.828	79%	0.794	S	S	*	*			trans	-96.4	110.4	171.2	18.2	0	0	0	0	109.6	Q738	T736-Q738 PolarHBondContact O-N 3.46Å
737	E	22.9	Very low	25.4	Very low	195 Å²	195	157.2 Å²	157.2	91%	0.911	80%	0.798	S	S	*	*			trans	-81.7	111.1	171.8	-122.4	177.6	-178.9	0	0	109.7	V739	E737-V739 PolarHBondContact O-N 3.17Å
738	Q	23.2	Very low	25.2	Very low	188 Å²	188	155 Å²	155	88%	0.879	79%	0.79	S	S	*	*			trans	-73.6	112.9	177.4	-78.4	-179.9	-20.3	0	0	110.9	T736	T736-Q738 PolarHBondContact O-N 3.46Å
739	V	24	Very low	25	Very low	148 Å²	148	154.9 Å²	154.9	90%	0.897	79%	0.794	S	S	*	*			trans	-98.5	128.3	158.3	-174.9	0	0	0	0	107.6	E737	E737-V739 PolarHBondContact O-N 3.17Å
740	G	24	Very low	24.7	Very low	69 Å²	69	153.8 Å²	153.8	71%	0.711	79%	0.785	S	S	*	*	S	Bend	trans	-46	145.7	-161.4	0	0	0	0	0	119.6
741	R	22	Very low	24.5	Very low	239 Å²	239	158.8 Å²	158.8	90%	0.902	80%	0.798	S	S	*	*	S	Bend	trans	36.6	124.3	155	-75.1	-174.4	176.7	-177.9	-1	117.9
742	L	22.2	Very low	24.4	Very low	152 Å²	152	160.1 Å²	160.1	80%	0.796	79%	0.79	S	S	*	*			cis	-152.1	138.9	16	-90.6	131.3	0	0	0	108.7
743	Y	23.5	Very low	24.4	Very low	191 Å²	191	160.1 Å²	160.1	75%	0.749	80%	0.795	S	S	*	*			trans	-2.9	147.7	161.5	-69.6	-85.5	0	0	0	120.8
744	P	27.6	Very low	24.4	Very low	109 Å²	109	157.4 Å²	157.4	71%	0.708	79%	0.79	S	S	*	*			cis	-130.3	161.3	37.9	35.2	-16	0	0	0	117.8
745	E	21.8	Very low	24.7	Very low	160 Å²	160	154.3 Å²	154.3	75%	0.748	79%	0.792	S	S	*	*			trans	-79.9	127.5	-167.6	-163.9	173	-164.2	0	0	112
746	I	24.2	Very low	25	Very low	82 Å²	82	151.7 Å²	151.7	42%	0.421	79%	0.788	S	S	.	*			trans	-120	113.6	175.4	-59.7	175.9	0	0	0	108.3	I160 V748 T766 A768	I160-I746 HydrophobicContact CD1-CG2 4.29Å; I746-V748 HydrophobicContact CG2-CG2 4.4Å; I746-T766 HydrophobicContact CD1-CG2 4.13Å; I746-A768 HydrophobicContact CD1-CB 3.89Å
747	Q	22.2	Very low	25.1	Very low	182 Å²	182	151.2 Å²	151.2	85%	0.85	79%	0.789	S	S	*	*			trans	-77.7	127.6	172.2	-74.9	-178.4	-12	0	0	110.2
748	V	23.8	Very low	25.2	Very low	97 Å²	97	150.5 Å²	150.5	59%	0.588	79%	0.785	S	S	*	*			trans	-114.1	115.5	-176	-179.7	0	0	0	0	109.4	I746 T750	I746-V748 HydrophobicContact CG2-CG2 4.4Å; V748-T750 HydrophobicContact CG1-CG2 4.31Å
749	S	24.6	Very low	25.3	Very low	122 Å²	122	149.9 Å²	149.9	85%	0.853	79%	0.787	S	S	*	*			trans	-104.1	124.3	168	59.3	0	0	0	0	110.2
750	T	24.3	Very low	25.3	Very low	114 Å²	114	147.1 Å²	147.1	70%	0.699	77%	0.767	S	S	*	*			trans	-103.7	132.8	-179	41.7	0	0	0	0	111.8	V748	V748-T750 HydrophobicContact CG1-CG2 4.31Å
751	Q	25.2	Very low	25.4	Very low	198 Å²	198	146.5 Å²	146.5	93%	0.925	75%	0.75	S	S	*	*			trans	-115.4	139.2	167.7	-154.3	171.9	15.5	0	0	109.4
752	R	26.2	Very low	25.7	Very low	197 Å²	197	138.2 Å²	138.2	74%	0.743	73%	0.726	S	S	*	*			trans	-91.5	136.1	-166.4	-140.7	179.5	-170.7	163.2	2.4	110.8
753	L	26.9	Very low	25.9	Very low	173 Å²	173	135.4 Å²	135.4	91%	0.906	71%	0.705	S	S	*	*			trans	-131.6	119.9	165.9	-87.6	160	0	0	0	107.5
754	D	28.1	Very low	26.4	Very low	138 Å²	138	132.1 Å²	132.1	74%	0.738	69%	0.691	S	S	*	*			trans	-86.8	118.1	-179	-72.7	-35.8	0	0	0	110.3
755	T	33.7	Very low	26.7	Very low	140 Å²	140	127.5 Å²	127.5	86%	0.859	66%	0.661	S	S	*	*			trans	-149.6	136.4	155.8	48.4	0	0	0	0	110.9
756	N	28.8	Very low	27.3	Very low	157 Å²	157	121.9 Å²	121.9	84%	0.84	64%	0.638	S	S	*	*			trans	-73.3	154.8	-177.1	-70.3	-36.5	0	0	0	113.9
757	C	27.9	Very low	27.6	Very low	124 Å²	124	119.6 Å²	119.6	84%	0.838	63%	0.626	S	S	*	*			trans	88.5	126.9	159.6	-60.1	0	0	0	0	118.8
758	E	25.4	Very low	27.9	Very low	181 Å²	181	113.7 Å²	113.7	85%	0.846	61%	0.608	S	S	*	*			trans	75.8	119.8	171.5	-62.7	-172.8	166.3	0	0	118.6	N760	E758-N760 VanDerWaalsContact C-N 3.34Å; E758-N760 PolarHBondContact O-N 2.88Å
759	L	24.8	Very low	28	Very low	174 Å²	174	113 Å²	113	91%	0.911	60%	0.601	S	S	*	*			trans	-70.5	77.7	-176.1	-82.3	155.8	0	0	0	111.5
760	N	24.8	Very low	28.1	Very low	91 Å²	91	113 Å²	113	49%	0.487	60%	0.597	S	S	.	*			trans	-85.3	107.1	166	-77.9	-13	0	0	0	109.8	Q153 E758 T762	Q153-N760 PolarHBondContact OE1-OD1 2.95Å; E758-N760 VanDerWaalsContact C-N 3.34Å; E758-N760 PolarHBondContact O-N 2.88Å; N760-T762 PolarHBondContact O-N 3.09Å
761	T	25.5	Very low	28.2	Very low	55 Å²	55	115.7 Å²	115.7	34%	0.337	60%	0.599	S	S	.	*			trans	-63.4	116.6	169	49.4	0	0	0	0	109	N151	N151-T761 VanDerWaalsContact CB-OG1 3.32Å; N151-T761 WeakPolarHBondContact CB-OG1 3.42Å; N151-T761 PolarHBondContact ND2-OG1 3.1Å
762	T	27.4	Very low	28.4	Very low	66 Å²	66	115.5 Å²	115.5	41%	0.405	62%	0.615	S	S	.	*			trans	-109.7	126.9	-178.9	28.2	0	0	0	0	110.2	R156 N760	R156-T762 VanDerWaalsContact CZ-CG2 3.49Å; N760-T762 PolarHBondContact O-N 3.09Å
763	W	28.3	Very low	28.5	Very low	93 Å²	93	111.5 Å²	111.5	35%	0.352	61%	0.608	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.9	121.3	176.8	-59.6	83	0	0	0	109.4	H154 R156 Q716	H154-W763 PolarHBondContact O-N 3.25Å; R156-W763 VanDerWaalsContact CB-O 3.26Å; R156-W763 WeakPolarHBondContact CB-O 3.49Å; R156-W763 PolarHBondContact N-O 2.7Å; R156-W763 VanDerWaalsContact N-O 3.07Å; Q716-W763 HydrophobicContact CB-CE3 4.48Å; Q716-W763 HydrophobicContact CB-CZ3 3.81Å; Q716-W763 HydrophobicContact CG-CE3 4.25Å; Q716-W763 HydrophobicContact CG-CH2 4Å; Q716-W763 HydrophobicContact CG-CZ3 3.52Å
764	R	32.4	Very low	28.6	Very low	121 Å²	121	108.2 Å²	108.2	46%	0.457	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.1	115.7	172.9	-177	-176.6	-79	170.3	-4.3	109	V158	V158-R764 HydrophobicContact CG2-CG 3.92Å
765	V	34.7	Very low	28.6	Very low	13 Å²	13	106.6 Å²	106.6	8%	0.079	59%	0.585	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.3	118.7	178.2	-170.3	0	0	0	0	107.6	I155 R156 L157 V158 F714	I155-V765 HydrophobicContact CG2-CG2 3.72Å; R156-V765 WeakPolarHBondContact O-CA 3.36Å; R156-V765 VanDerWaalsContact O-CB 3.29Å; R156-V765 WeakPolarHBondContact O-CB 3.33Å; R156-V765 PolarHBondContact O-N 3.01Å; L157-V765 CarbonylContact C-O 3.4Å; L157-V765 VanDerWaalsContact CA-O 3.23Å; L157-V765 WeakPolarHBondContact CA-O 3.47Å; L157-V765 HydrophobicContact CD2-CB 3.57Å; L157-V765 HydrophobicContact CD2-CG1 3.36Å; L157-V765 HydrophobicContact CD2-CG2 4.49Å; V158-V765 PolarHBondContact N-O 3.01Å; F714-V765 HydrophobicContact CD1-CB 4.26Å; F714-V765 HydrophobicContact CD1-CG1 3.64Å; F714-V765 HydrophobicContact CD1-CG2 3.59Å; F714-V765 HydrophobicContact CE1-CB 4.38Å; F714-V765 HydrophobicContact CE1-CG1 3.75Å; F714-V765 HydrophobicContact CE1-CG2 3.73Å
766	T	33.7	Very low	28.3	Very low	42 Å²	42	104.6 Å²	104.6	26%	0.258	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103	112.5	178.7	-53.3	0	0	0	0	108	I160 I746 A768	I160-T766 HydrophobicContact CD1-CG2 3.52Å; I160-T766 HydrophobicContact CG1-CG2 4.06Å; I746-T766 HydrophobicContact CD1-CG2 4.13Å; T766-A768 PolarHBondContact O-N 3.33Å
767	I	30.8	Very low	28.3	Very low	33 Å²	33	101.3 Å²	101.3	17%	0.169	55%	0.552	C	S	.	*			trans	-85.9	105	167.5	-60.4	169.3	0	0	0	105.7	L157 W523	L157-I767 HydrophobicContact CB-CD1 4.38Å; L157-I767 HydrophobicContact CD1-CD1 3.57Å; L157-I767 HydrophobicContact CD2-CD1 3.51Å; L157-I767 HydrophobicContact CD2-CG1 3.61Å; L157-I767 HydrophobicContact CG-CD1 3.97Å; W523-I767 HydrophobicContact CZ2-CD1 4.49Å
768	A	29.2	Very low	28.3	Very low	59 Å²	59	99.8 Å²	99.8	49%	0.488	53%	0.533	S	S	.	.			trans	-83.9	112.8	166	0	0	0	0	0	107.7	I746 T766 T770	I746-A768 HydrophobicContact CD1-CB 3.89Å; T766-A768 PolarHBondContact O-N 3.33Å; A768-T770 PolarHBondContact O-N 3.39Å; A768-T770 VanDerWaalsContact O-N 3.11Å
769	D	26.5	Very low	28.5	Very low	82 Å²	82	94 Å²	94	44%	0.439	51%	0.51	S	S	.	.			trans	-62	112	166.6	-77.4	-30.9	0	0	0	107.8	F771	D769-F771 VanDerWaalsContact C-N 3.28Å; D769-F771 HydrophobicContact CB-CD2 4.19Å; D769-F771 HydrophobicContact CB-CE2 4.28Å; D769-F771 PolarHBondContact O-N 3.32Å
770	T	25.9	Very low	28.8	Very low	123 Å²	123	87.8 Å²	87.8	76%	0.755	48%	0.479	S	S	*	.			trans	-71.2	93.1	160.3	49.2	0	0	0	0	106.8	A768	A768-T770 PolarHBondContact O-N 3.39Å; A768-T770 VanDerWaalsContact O-N 3.11Å
771	F	25.5	Very low	29.2	Very low	169 Å²	169	87.6 Å²	87.6	74%	0.741	48%	0.479	S	S	*	.			trans	-60.8	137.3	160.7	-90.6	-91.9	0	0	0	108.2	D769	D769-F771 VanDerWaalsContact C-N 3.28Å; D769-F771 HydrophobicContact CB-CD2 4.19Å; D769-F771 HydrophobicContact CB-CE2 4.28Å; D769-F771 PolarHBondContact O-N 3.32Å
772	P	30.2	Very low	29.5	Very low	195 Å²	195	90.5 Å²	90.5	100%	1.266	49%	0.492	S	S	*	.			trans	-61	0	-177	25.2	-33.9	0	0	0	113.6

Retrieved 772 of 772 residues in 481.6 ms (Link to these results)

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