A0A096NVJ6_PAPAN Loading...

Threonine aspartase 1

AlphaFold DB (A0A2K6RU45), UniProt , Accession A0A096NVJ6, Species PAPAN (Papio anubis, Olive baboon), Gene TASP1, Length 420 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	40.2	Very low	33.7	Very low	233 Å²	233	146 Å²	146	100%	1.148	83%	0.83	S	S	*	*				0	91.4	0	-82.2	168.9	164.3	0	0	106.8
2	T	36	Very low	33.3	Very low	120 Å²	120	140.3 Å²	140.3	74%	0.736	83%	0.827	S	S	*	*				55.3	122.2	97.7	46.5	0	0	0	0	112.1
3	M	30.8	Very low	33.2	Very low	160 Å²	160	142.3 Å²	142.3	79%	0.788	83%	0.83	S	S	*	*			cis	-160.3	138.4	-10.4	-91.1	-164	-159.2	0	0	104.6
4	E	32.3	Very low	33.5	Very low	146 Å²	146	139.7 Å²	139.7	68%	0.682	82%	0.82	S	S	*	*				43.5	146.5	117.7	-64.2	-162.6	142.9	0	0	117.6
5	K	37.1	Very low	33.6	Very low	179 Å²	179	138.5 Å²	138.5	78%	0.778	82%	0.822	S	S	*	*			cis	-172.9	150.9	-0.2	-106	167.8	175.1	157.4	0	102.4
6	G	31	Very low	33.6	Very low	71 Å²	71	144.6 Å²	144.6	73%	0.732	83%	0.827	S	S	*	*				161.7	167.7	63.9	0	0	0	0	0	111.5
7	M	33.3	Very low	34	Very low	190 Å²	190	143.5 Å²	143.5	94%	0.936	83%	0.83	S	S	*	*			trans	-87.5	171.1	-160.2	-60.4	133.1	63	0	0	115.6
8	S	33.2	Very low	33.9	Very low	103 Å²	103	141.7 Å²	141.7	72%	0.72	83%	0.827	S	S	*	*			trans	133.3	99.1	139.1	-176.3	0	0	0	0	111.1
9	S	33.1	Very low	33.8	Very low	118 Å²	118	144.5 Å²	144.5	83%	0.825	83%	0.831	S	S	*	*				67.1	119	84.4	69.5	0	0	0	0	115.6
10	G	31	Very low	33.7	Very low	79 Å²	79	144.3 Å²	144.3	81%	0.814	83%	0.832	S	S	*	*			trans	-178.2	100.8	170.6	0	0	0	0	0	110.6
11	E	32.6	Very low	33.7	Very low	207 Å²	207	142.7 Å²	142.7	97%	0.967	83%	0.829	S	S	*	*			trans	-69.9	160.3	-175.8	-60.9	172.6	131.3	0	0	114.1
12	G	29.6	Very low	33.7	Very low	77 Å²	77	136.1 Å²	136.1	79%	0.794	81%	0.812	S	S	*	*			trans	143.3	81.5	154.9	0	0	0	0	0	117.7
13	L	32.1	Very low	33.6	Very low	167 Å²	167	133.5 Å²	133.5	87%	0.874	81%	0.809	S	S	*	*			trans	-61.3	170.8	159.9	-85.1	114.1	0	0	0	112.2
14	P	37.3	Very low	34.1	Very low	106 Å²	106	135.3 Å²	135.3	69%	0.688	81%	0.813	S	S	*	*			cis	-132.7	150.3	8.5	33.7	-13.7	0	0	0	115.9	R16	P14-R16 PolarHBondContact O-N 3.38Å
15	S	34.2	Very low	34.6	Very low	122 Å²	122	134.2 Å²	134.2	85%	0.853	81%	0.81	S	S	*	*			trans	-77.2	108.3	163.9	55.6	0	0	0	0	110.8
16	R	33.9	Very low	35.1	Very low	236 Å²	236	129.5 Å²	129.5	89%	0.891	80%	0.797	S	S	*	*			trans	-101.9	111.9	159.5	-90.6	-174.8	174.8	-178.5	-0.4	109.2	P14	P14-R16 PolarHBondContact O-N 3.38Å
17	S	40.1	Very low	35.8	Very low	125 Å²	125	129.8 Å²	129.8	87%	0.874	79%	0.792	S	S	*	*			trans	-61.2	124.5	163.8	53.7	0	0	0	0	110.4
18	S	31.9	Very low	36.1	Very low	111 Å²	111	128.7 Å²	128.7	78%	0.776	78%	0.782	S	S	*	*			trans	-129.6	122	156.4	54.9	0	0	0	0	108.6
19	Q	33.2	Very low	36.3	Very low	196 Å²	196	128.9 Å²	128.9	92%	0.916	77%	0.771	S	S	*	*			trans	-52.2	128.7	-173.6	-67	163.1	-40	0	0	112.4	S21	Q19-S21 PolarHBondContact O-N 3.23Å
20	V	32.1	Very low	36.5	Very low	139 Å²	139	128.9 Å²	128.9	84%	0.842	76%	0.761	S	S	*	*			trans	-81.1	102.1	161.6	178.9	0	0	0	0	107	A22	V20-A22 PolarHBondContact O-N 3.35Å
21	S	32	Very low	36.6	Very low	111 Å²	111	131.7 Å²	131.7	78%	0.776	75%	0.753	S	S	*	*			trans	-74.9	102.6	165.3	53.4	0	0	0	0	108.4	Q19 G23	Q19-S21 PolarHBondContact O-N 3.23Å; S21-G23 VanDerWaalsContact C-N 3.31Å; S21-G23 PolarHBondContact O-N 2.94Å
22	A	40.3	Very low	36.6	Very low	95 Å²	95	125.3 Å²	125.3	79%	0.785	74%	0.736	S	S	*	*			trans	-68.8	91.7	167	0	0	0	0	0	108.6	V20 K24	V20-A22 PolarHBondContact O-N 3.35Å; A22-K24 PolarHBondContact O-N 3.27Å
23	G	34.3	Very low	36.8	Very low	66 Å²	66	130.6 Å²	130.6	68%	0.68	74%	0.737	S	S	*	*			trans	-65.3	115.2	170	0	0	0	0	0	109.8	S21 I25	S21-G23 VanDerWaalsContact C-N 3.31Å; S21-G23 PolarHBondContact O-N 2.94Å; G23-I25 PolarHBondContact O-N 3.2Å
24	K	41.8	Very low	36.9	Very low	198 Å²	198	130.6 Å²	130.6	86%	0.861	73%	0.733	S	S	*	*			trans	-63.6	103.5	168	-82.4	179.6	174.8	177.1	0	108.6	A22 T26	A22-K24 PolarHBondContact O-N 3.27Å; K24-T26 PolarHBondContact O-N 3.04Å
25	I	41.7	Very low	37	Very low	122 Å²	122	130 Å²	130	63%	0.626	73%	0.731	S	S	*	*			trans	-65.1	115.1	166.9	-58.4	173.3	0	0	0	106.5	G23 E29 L30	G23-I25 PolarHBondContact O-N 3.2Å; I25-E29 HydrophobicContact CG2-CB 4.04Å; I25-L30 HydrophobicContact CG2-CD1 4.4Å; I25-L30 HydrophobicContact CG2-CG 4.31Å
26	T	49.1	Very low	37.2	Very low	81 Å²	81	135.5 Å²	135.5	50%	0.497	74%	0.735	S	S	.	*			trans	-81.1	149.9	176.3	54.7	0	0	0	0	109.5	K24 K28 E29	K24-T26 PolarHBondContact O-N 3.04Å; T26-K28 PolarHBondContact O-N 2.95Å; T26-E29 PolarHBondContact O-N 2.87Å
27	A	44.6	Very low	37.9	Very low	76 Å²	76	133.5 Å²	133.5	63%	0.628	73%	0.733	S	S	*	*	H	α-helix	trans	-52.6	-24.4	-179.8	0	0	0	0	0	113.8	E29 L30 E31	A27-E29 PolarHBondContact O-N 3.25Å; A27-L30 PolarHBondContact O-N 3.44Å; A27-E31 PolarHBondContact O-N 3.49Å
28	K	40.8	Very low	38.6	Very low	167 Å²	167	133 Å²	133	73%	0.726	72%	0.716	S	S	*	*	H	α-helix	trans	-66.1	-28.9	173.1	-91.3	-175.4	170.5	-178.3	0	114.8	T26 A32	T26-K28 PolarHBondContact O-N 2.95Å; K28-A32 WeakPolarHBondContact O-CB 3.44Å; K28-A32 PolarHBondContact O-N 3.09Å; K28-A32 VanDerWaalsContact O-N 3.09Å
29	E	36.5	Very low	40.3	Very low	107 Å²	107	134.5 Å²	134.5	50%	0.5	71%	0.709	S	S	.	*	H	α-helix	trans	-81.2	-22.7	178.7	-76.3	179.5	140	0	0	112.8	I25 T26 A27 K33	I25-E29 HydrophobicContact CG2-CB 4.04Å; T26-E29 PolarHBondContact O-N 2.87Å; A27-E29 PolarHBondContact O-N 3.25Å; E29-K33 PolarHBondContact O-N 3.49Å
30	L	37.3	Very low	42.6	Very low	118 Å²	118	129.9 Å²	129.9	62%	0.618	68%	0.683	S	S	*	*	H	α-helix	trans	-76.9	-35.7	169.9	-79.4	158.2	0	0	0	111.2	I25 A27 K33	I25-L30 HydrophobicContact CG2-CD1 4.4Å; I25-L30 HydrophobicContact CG2-CG 4.31Å; A27-L30 PolarHBondContact O-N 3.44Å; L30-K33 PolarHBondContact O-N 3.45Å
31	E	33.5	Very low	45.4	Very low	139 Å²	139	123.3 Å²	123.3	65%	0.65	64%	0.643	S	S	*	*	H	α-helix	trans	-67.9	-34.4	171.8	-73.2	177.5	162	0	0	112.5	A27 K33 Q34	A27-E31 PolarHBondContact O-N 3.49Å; E31-K33 VanDerWaalsContact C-N 3.31Å; E31-K33 PolarHBondContact O-N 3.41Å; E31-Q34 PolarHBondContact O-N 3.46Å
32	A	33	Very low	48.4	Very low	72 Å²	72	118 Å²	118	60%	0.595	61%	0.607	S	S	*	*	H	α-helix	trans	-72	-20.2	178.3	0	0	0	0	0	114.1	K28	K28-A32 WeakPolarHBondContact O-CB 3.44Å; K28-A32 PolarHBondContact O-N 3.09Å; K28-A32 VanDerWaalsContact O-N 3.09Å
33	K	32.8	Very low	51.2	Low	189 Å²	189	113.7 Å²	113.7	82%	0.822	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	0.5	178.4	-79.4	-177.1	176.1	179.1	0	114.3	E29 L30 E31	E29-K33 PolarHBondContact O-N 3.49Å; L30-K33 PolarHBondContact O-N 3.45Å; E31-K33 VanDerWaalsContact C-N 3.31Å; E31-K33 PolarHBondContact O-N 3.41Å
34	Q	34.9	Very low	54.3	Low	167 Å²	167	110.6 Å²	110.6	78%	0.78	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	4.5	-176.8	-150.4	154.5	4.3	0	0	114.7	E31	E31-Q34 PolarHBondContact O-N 3.46Å
35	S	38.7	Very low	57	Low	94 Å²	94	101.1 Å²	101.1	66%	0.657	50%	0.497	S	S	*	.			trans	-132.3	43.1	-171.6	-172.8	0	0	0	0	116
36	Y	38.2	Very low	59.7	Low	236 Å²	236	95.3 Å²	95.3	93%	0.925	47%	0.467	S	S	*	.			trans	-130.3	58.9	154.2	-85.7	-89.3	0	0	0	109.2	E38	Y36-E38 PolarHBondContact O-N 3.36Å
37	K	48.2	Very low	62.1	Low	195 Å²	195	91.5 Å²	91.5	85%	0.848	44%	0.443	S	S	*	.			trans	-69.7	116.4	153.7	-90.8	-175.7	174.1	-179.2	0	105.8	K39	K37-K39 PolarHBondContact O-N 2.9Å; K37-K39 VanDerWaalsContact O-N 3.17Å
38	E	56.2	Low	64.6	Low	114 Å²	114	87.9 Å²	87.9	53%	0.533	41%	0.414	S	S	.	.			trans	-48.8	126.1	168.1	-76.5	-167.4	162.3	0	0	108.4	Y36 R40 V419	Y36-E38 PolarHBondContact O-N 3.36Å; E38-R40 PolarHBondContact O-N 3.17Å; E38-R40 VanDerWaalsContact O-N 3.1Å; E38-V419 PolarHBondContact OE2-N 3.1Å
39	K	66.2	Low	67	Low	143 Å²	143	80 Å²	80	62%	0.622	38%	0.379	S	S	*	.			trans	-66.8	114.7	-179.2	-72.5	179.8	178.3	177.5	0	107.6	K37 G41	K37-K39 PolarHBondContact O-N 2.9Å; K37-K39 VanDerWaalsContact O-N 3.17Å; K39-G41 PolarHBondContact O-N 3.35Å
40	R	82.7	Confident	69.3	Low	99 Å²	99	74.9 Å²	74.9	37%	0.374	36%	0.355	S	S	.	.			trans	-56.1	135.2	173.5	-68.1	-179.4	174.9	-161.2	4.6	109.7	E38 H242 A384	E38-R40 PolarHBondContact O-N 3.17Å; E38-R40 VanDerWaalsContact O-N 3.1Å; R40-H242 PolarHBondContact NH1-NE2 2.86Å; R40-A384 WeakPolarHBondContact O-CB 3.35Å
41	G	89.8	Confident	71.7	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.01	33%	0.326	C	S	.	.			trans	-63.3	158.4	173.8	0	0	0	0	0	112.2	K39 H242	K39-G41 PolarHBondContact O-N 3.35Å; G41-H242 WeakPolarHBondContact O-CB 3.34Å; G41-H242 PolarHBondContact O-N 3.21Å
42	G	96.6	Very high	74.2	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.7	153.8	178	0	0	0	0	0	111.3	V240 A384	G42-V240 VanDerWaalsContact CA-O 3.31Å; G42-V240 WeakPolarHBondContact CA-O 3.39Å; G42-A384 WeakPolarHBondContact O-CB 3.35Å; G42-A384 PolarHBondContact O-N 3.1Å
43	F	98.6	Very high	76.7	Confident	4 Å²	4	63.7 Å²	63.7	2%	0.018	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	144.5	178.7	-174.1	-86.5	0	0	0	110.5	L45 V239 V240 L346 V366 F368 Y381 M382 C413 L415	F43-L45 HydrophobicContact CE1-CB 4.12Å; F43-V239 WeakPolarHBondContact O-CA 3.4Å; F43-V240 HydrophobicContact CB-CG1 3.8Å; F43-V240 PolarHBondContact N-O 3.35Å; F43-V240 PolarHBondContact O-N 3.07Å; F43-L346 HydrophobicContact CD1-CD1 3.79Å; F43-V366 HydrophobicContact CB-CG1 4.47Å; F43-V366 HydrophobicContact CD1-CG1 4.13Å; F43-V366 HydrophobicContact CG-CG1 4.3Å; F43-F368 HydrophobicContact CE1-CB 3.71Å; F43-F368 AromaticContact CE1-CD1 3.78Å; F43-F368 HydrophobicContact CE1-CD1 3.78Å; F43-F368 HydrophobicContact CE1-CD2 4.39Å; F43-F368 AromaticContact CE1-CG 3.7Å; F43-F368 HydrophobicContact CE1-CG 3.7Å; F43-F368 AromaticContact CE2-CD1 3.91Å; F43-F368 HydrophobicContact CE2-CD1 3.91Å; F43-F368 AromaticContact CE2-CE1 3.9Å; F43-F368 HydrophobicContact CE2-CE1 3.9Å; F43-F368 HydrophobicContact CE2-CG 4.5Å; F43-F368 HydrophobicContact CE2-CZ 4.49Å; F43-F368 HydrophobicContact CZ-CB 4.03Å; F43-F368 AromaticContact CZ-CD1 3.27Å; F43-F368 HydrophobicContact CZ-CD1 3.27Å; F43-F368 AromaticContact CZ-CD2 3.94Å; F43-F368 HydrophobicContact CZ-CD2 3.94Å; F43-F368 AromaticContact CZ-CE1 3.59Å; F43-F368 HydrophobicContact CZ-CE1 3.59Å; F43-F368 HydrophobicContact CZ-CE2 4.21Å; F43-F368 AromaticContact CZ-CG 3.46Å; F43-F368 HydrophobicContact CZ-CG 3.46Å; F43-F368 VanDerWaalsContact CZ-CG 3.46Å; F43-F368 HydrophobicContact CZ-CZ 4.05Å; F43-Y381 HydrophobicContact CE2-CD2 4.26Å; F43-Y381 HydrophobicContact CZ-CD2 4.01Å; F43-Y381 HydrophobicContact CZ-CG 4.27Å; F43-M382 WeakPolarHBondContact CA-O 3.41Å; F43-C413 HydrophobicContact CD2-CB 3.94Å; F43-C413 HydrophobicContact CE2-CB 4.01Å; F43-L415 HydrophobicContact CB-CD1 4.06Å; F43-L415 HydrophobicContact CB-CD2 4.34Å
44	V	98.9	Very high	79.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	140.5	175.7	59.8	0	0	0	0	110.1	V46 C69 A72 I73 V238 V239 Y381 M382	V44-V46 HydrophobicContact CG2-CG1 3.7Å; V44-C69 HydrophobicContact CG1-CB 3.99Å; V44-A72 HydrophobicContact CB-CB 3.91Å; V44-A72 HydrophobicContact CG1-CB 4.05Å; V44-A72 HydrophobicContact CG2-CB 3.69Å; V44-I73 HydrophobicContact CG1-CD1 3.91Å; V44-I73 HydrophobicContact CG1-CG1 3.94Å; V44-V238 WeakPolarHBondContact CA-O 3.34Å; V44-V239 HydrophobicContact CB-CG2 4.06Å; V44-V239 HydrophobicContact CG2-CG2 3.73Å; V44-Y381 CarbonylContact O-C 3.58Å; V44-Y381 WeakPolarHBondContact O-CA 3.44Å; V44-Y381 WeakPolarHBondContact O-CB 3.44Å; V44-M382 HydrophobicContact CG1-CB 4Å; V44-M382 PolarHBondContact N-O 2.85Å; V44-M382 PolarHBondContact O-N 3.49Å
45	L	98.9	Very high	81.5	Confident	0 Å²	0	56 Å²	56	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	134.8	165.3	170.3	65.4	0	0	0	108	F43 A237 V238 I344 F368 L369 W370 V379 G380 Y381	F43-L45 HydrophobicContact CE1-CB 4.12Å; L45-A237 CarbonylContact O-C 3.57Å; L45-A237 VanDerWaalsContact O-CA 3.3Å; L45-A237 WeakPolarHBondContact O-CA 3.24Å; L45-V238 HydrophobicContact CB-CG2 3.79Å; L45-V238 HydrophobicContact CD2-CG2 4.34Å; L45-V238 HydrophobicContact CG-CG2 4.3Å; L45-V238 PolarHBondContact N-O 3.35Å; L45-V238 PolarHBondContact O-N 2.78Å; L45-I344 HydrophobicContact CD1-CG2 4.38Å; L45-I344 HydrophobicContact CD2-CB 3.66Å; L45-I344 HydrophobicContact CD2-CG2 4.09Å; L45-I344 HydrophobicContact CG-CB 3.88Å; L45-I344 HydrophobicContact CG-CD1 4.15Å; L45-I344 HydrophobicContact CG-CG2 4.06Å; L45-I344 WeakPolarHBondContact O-CD1 3.44Å; L45-F368 HydrophobicContact CD2-CB 4.21Å; L45-L369 WeakPolarHBondContact CD2-O 3.27Å; L45-W370 HydrophobicContact CD1-CE3 4.31Å; L45-V379 HydrophobicContact CD1-CB 4.27Å; L45-G380 CarbonylContact C-O 3.55Å; L45-G380 WeakPolarHBondContact CA-O 3.43Å; L45-Y381 HydrophobicContact CD1-CD1 4.45Å
46	V	98.9	Very high	83.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	157	-179.5	-49.3	0	0	0	0	111	V44 C65 A68 A89 L93 G236 A237 V379 G380	V44-V46 HydrophobicContact CG2-CG1 3.7Å; V46-C65 HydrophobicContact CG2-CB 3.75Å; V46-A68 HydrophobicContact CG1-CB 4.29Å; V46-A68 HydrophobicContact CG2-CB 4.35Å; V46-A89 HydrophobicContact CG1-CB 4.16Å; V46-L93 HydrophobicContact CB-CD1 4.27Å; V46-G236 CarbonylContact C-O 3.55Å; V46-G236 VanDerWaalsContact CA-O 3.29Å; V46-G236 WeakPolarHBondContact CA-O 3.4Å; V46-A237 HydrophobicContact CB-CB 4.26Å; V46-A237 HydrophobicContact CG1-CB 3.71Å; V46-V379 CarbonylContact O-C 3.53Å; V46-V379 VanDerWaalsContact O-CA 3.27Å; V46-V379 WeakPolarHBondContact O-CA 3.35Å; V46-G380 WeakPolarHBondContact CG2-O 3.39Å; V46-G380 PolarHBondContact N-O 3.25Å; V46-G380 PolarHBondContact O-N 3.4Å
47	H	98.8	Very high	85.9	Confident	0 Å²	0	50 Å²	50	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	152.3	167.8	70.5	85.1	0	0	0	112.7	T234 G236 S289 I344 M377 C378	H47-T234 PolarHBondContact CE1-O 3.29Å; H47-T234 PolarHBondContact ND1-O 3.48Å; H47-T234 VanDerWaalsContact ND1-O 3.07Å; H47-G236 PolarHBondContact CE1-N 3.3Å; H47-G236 VanDerWaalsContact CE1-N 3.26Å; H47-G236 PolarHBondContact N-O 2.84Å; H47-G236 VanDerWaalsContact NE2-CA 3.33Å; H47-G236 WeakPolarHBondContact NE2-CA 3.14Å; H47-G236 PolarHBondContact NE2-N 3.19Å; H47-G236 PolarHBondContact O-N 3.36Å; H47-S289 PolarHBondContact NE2-OG 2.96Å; H47-I344 HydrophobicContact CB-CD1 4.47Å; H47-I344 HydrophobicContact CB-CG2 3.95Å; H47-M377 HydrophobicContact CB-CE 3.5Å; H47-M377 VanDerWaalsContact CB-CE 3.5Å; H47-C378 CarbonylContact C-O 3.57Å; H47-C378 WeakPolarHBondContact CA-O 3.27Å
48	A	96.8	Very high	87.9	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.008	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	47	173.3	0	0	0	0	0	111.8	H53 Y61 V64 C65 L93 T99 C378	A48-H53 PolarHBondContact O-NE2 3.45Å; A48-Y61 HydrophobicContact CB-CD1 4.07Å; A48-Y61 WeakPolarHBondContact O-CD1 3.5Å; A48-V64 HydrophobicContact CB-CG1 4.19Å; A48-C65 WeakPolarHBondContact CB-SG 3.48Å; A48-L93 HydrophobicContact CB-CD2 4.33Å; A48-T99 HydrophobicContact CB-CG2 4.42Å; A48-C378 HydrophobicContact CB-CB 4.35Å; A48-C378 PolarHBondContact N-O 3.35Å
49	G	90.5	Very high	89.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	110.5	143.6	173.4	0	0	0	0	0	113.2	H53 T234 M377 C378	G49-H53 PolarHBondContact O-CE1 3.28Å; G49-H53 PolarHBondContact O-NE2 3.43Å; G49-T234 WeakPolarHBondContact CA-O 3.46Å; G49-T234 PolarHBondContact N-O 3.01Å; G49-M377 WeakPolarHBondContact O-CA 3.43Å; G49-M377 WeakPolarHBondContact O-CG 3.38Å; G49-C378 PolarHBondContact O-N 3.27Å
50	A	86.5	Confident	91.1	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	117.1	162.8	0	0	0	0	0	106.9	S291 T374 M377	A50-S291 PolarHBondContact N-OG 3.08Å; A50-T374 HydrophobicContact CB-CG2 4.16Å; A50-M377 HydrophobicContact CB-CB 4.34Å; A50-M377 HydrophobicContact CB-CG 4.05Å; A50-M377 HydrophobicContact CB-SD 4.19Å
51	G	87.9	Confident	91.7	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.3	-132.2	-168.2	0	0	0	0	0	110	T374 S376	G51-T374 PolarHBondContact N-OG1 2.97Å; G51-S376 PolarHBondContact N-O 3.11Å; G51-S376 PolarHBondContact O-N 2.73Å; G51-S376 PolarHBondContact O-OG 3.37Å
52	Y	84.3	Confident	92	Very high	93 Å²	93	39.4 Å²	39.4	37%	0.365	19%	0.192	S	C	.	.			trans	-117.2	116.3	175.9	178	-108.9	0	0	0	112.9	S229 E375	Y52-S229 WeakPolarHBondContact CB-OG 3.42Å; Y52-E375 HydrophobicContact CD2-CB 4.34Å; Y52-E375 WeakPolarHBondContact CD2-OE2 3.41Å; Y52-E375 VanDerWaalsContact CE2-OE2 3.26Å; Y52-E375 WeakPolarHBondContact CE2-OE2 3.49Å
53	H	85.6	Confident	92.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.209	C	C	.	.			trans	-103.6	100.3	174.8	-57.4	77	0	0	0	109.4	A48 G49 Y61 S376 I393 R395	A48-H53 PolarHBondContact O-NE2 3.45Å; G49-H53 PolarHBondContact O-CE1 3.28Å; G49-H53 PolarHBondContact O-NE2 3.43Å; H53-Y61 AromaticContact CD2-CD2 3.59Å; H53-Y61 AromaticContact CD2-CE2 3.81Å; H53-Y61 AromaticContact CD2-CG 3.75Å; H53-S376 PolarHBondContact N-OG 3.48Å; H53-S376 PolarHBondContact ND1-OG 3.05Å; H53-I393 HydrophobicContact CB-CG2 4.34Å; H53-R395 PolarHBondContact O-NH1 3.28Å; H53-R395 PolarHBondContact O-NH2 2.7Å
54	S	83.8	Confident	92.1	Very high	26 Å²	26	43.1 Å²	43.1	18%	0.182	21%	0.209	C	C	.	.			trans	-58	144.9	171.2	64	0	0	0	0	110.8	S56 K57 A58	S54-S56 PolarHBondContact O-N 3.47Å; S54-S56 PolarHBondContact OG-OG 3.02Å; S54-K57 PolarHBondContact O-N 3.37Å; S54-K57 VanDerWaalsContact O-N 3.1Å; S54-K57 WeakPolarHBondContact OG-CB 3.38Å; S54-K57 PolarHBondContact OG-N 3.29Å; S54-A58 PolarHBondContact O-N 3Å
55	E	84.4	Confident	92.1	Very high	170 Å²	170	43.1 Å²	43.1	79%	0.794	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-35.1	179.7	-63.2	-172.2	173.5	0	0	113	K57 A58	E55-K57 PolarHBondContact O-N 2.92Å; E55-A58 PolarHBondContact O-N 2.88Å
56	S	85.2	Confident	92.1	Very high	103 Å²	103	46.8 Å²	46.8	72%	0.72	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-34.5	179.4	58.8	0	0	0	0	113.5	S54	S54-S56 PolarHBondContact O-N 3.47Å; S54-S56 PolarHBondContact OG-OG 3.02Å
57	K	85.5	Confident	92.1	Very high	100 Å²	100	50.9 Å²	50.9	44%	0.435	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-14	178.9	-65.8	-177.7	176.9	-176.6	0	113.9	S54 E55 K59 E60 Y61	S54-K57 PolarHBondContact O-N 3.37Å; S54-K57 VanDerWaalsContact O-N 3.1Å; S54-K57 WeakPolarHBondContact OG-CB 3.38Å; S54-K57 PolarHBondContact OG-N 3.29Å; E55-K57 PolarHBondContact O-N 2.92Å; K57-K59 PolarHBondContact O-N 3.21Å; K57-E60 PolarHBondContact O-N 3.17Å; K57-Y61 HydrophobicContact CB-CD2 4Å; K57-Y61 HydrophobicContact CB-CE2 3.68Å; K57-Y61 HydrophobicContact CD-CE2 4.35Å; K57-Y61 VanDerWaalsContact O-CD2 3.24Å; K57-Y61 WeakPolarHBondContact O-CD2 3.41Å; K57-Y61 PolarHBondContact O-N 3.48Å
58	A	90.6	Very high	92.1	Very high	10 Å²	10	50.9 Å²	50.9	8%	0.083	24%	0.24	C	C	.	.	H	α-helix	trans	-54.4	-30.7	-177.6	0	0	0	0	0	113.4	S54 E55 K62 I393	S54-A58 PolarHBondContact O-N 3Å; E55-A58 PolarHBondContact O-N 2.88Å; A58-K62 WeakPolarHBondContact O-CB 3.31Å; A58-K62 VanDerWaalsContact O-CE 3.3Å; A58-K62 WeakPolarHBondContact O-CE 3.23Å; A58-K62 WeakPolarHBondContact O-CG 3.34Å; A58-K62 PolarHBondContact O-N 3.27Å; A58-K62 VanDerWaalsContact O-N 3.13Å; A58-I393 HydrophobicContact CB-CD1 4.43Å; A58-I393 HydrophobicContact CB-CG1 4.16Å
59	K	94.8	Very high	92.2	Very high	159 Å²	159	50.9 Å²	50.9	69%	0.691	24%	0.24	S	C	*	.	H	α-helix	trans	-67.4	-39	176.4	-168.4	176.8	179.5	-178	0	112.6	K57 H63	K57-K59 PolarHBondContact O-N 3.21Å; K59-H63 WeakPolarHBondContact O-CB 3.48Å; K59-H63 PolarHBondContact O-N 3.31Å
60	E	93.8	Very high	92.5	Very high	74 Å²	74	54.3 Å²	54.3	35%	0.346	26%	0.256	S	S	.	.	H	α-helix	trans	-70.1	-45.2	179.9	-58.1	-52.2	133.2	0	0	111.2	K57 K62 H63 V64 F98	K57-E60 PolarHBondContact O-N 3.17Å; E60-K62 PolarHBondContact O-N 3.32Å; E60-H63 WeakPolarHBondContact O-CB 3.42Å; E60-H63 PolarHBondContact O-N 3Å; E60-H63 VanDerWaalsContact O-N 3.11Å; E60-V64 PolarHBondContact O-N 3.21Å; E60-F98 HydrophobicContact CB-CD2 3.87Å; E60-F98 HydrophobicContact CB-CE2 4.01Å; E60-F98 HydrophobicContact CB-CG 4.24Å; E60-F98 HydrophobicContact CG-CD2 4.26Å; E60-F98 HydrophobicContact CG-CE2 3.9Å; E60-F98 HydrophobicContact CG-CZ 4.03Å
61	Y	95	Very high	93.1	Very high	11 Å²	11	58 Å²	58	4%	0.043	27%	0.272	C	S	.	.	H	α-helix	trans	-61.1	-44.4	175.7	-67.8	-73.2	0	0	0	112.1	A48 H53 K57 H63 V64 C65 D233 C378	A48-Y61 HydrophobicContact CB-CD1 4.07Å; A48-Y61 WeakPolarHBondContact O-CD1 3.5Å; H53-Y61 AromaticContact CD2-CD2 3.59Å; H53-Y61 AromaticContact CD2-CE2 3.81Å; H53-Y61 AromaticContact CD2-CG 3.75Å; K57-Y61 HydrophobicContact CB-CD2 4Å; K57-Y61 HydrophobicContact CB-CE2 3.68Å; K57-Y61 HydrophobicContact CD-CE2 4.35Å; K57-Y61 VanDerWaalsContact O-CD2 3.24Å; K57-Y61 WeakPolarHBondContact O-CD2 3.41Å; K57-Y61 PolarHBondContact O-N 3.48Å; Y61-H63 VanDerWaalsContact C-N 3.31Å; Y61-H63 PolarHBondContact O-N 3.45Å; Y61-V64 WeakPolarHBondContact O-CG1 3.47Å; Y61-V64 PolarHBondContact O-N 2.73Å; Y61-C65 PolarHBondContact O-N 2.88Å; Y61-C65 PolarHBondContact O-SG 2.99Å; Y61-D233 PolarHBondContact OH-OD2 3.23Å; Y61-C378 VanDerWaalsContact C-SG 3.53Å
62	K	97.6	Very high	93.6	Very high	76 Å²	76	57.9 Å²	57.9	33%	0.33	27%	0.272	S	S	.	.	H	α-helix	trans	-62.3	-39.7	173.2	-74.1	-174.7	-66.6	-173.7	0	111.7	A58 E60 C65 K66 T391 I393	A58-K62 WeakPolarHBondContact O-CB 3.31Å; A58-K62 VanDerWaalsContact O-CE 3.3Å; A58-K62 WeakPolarHBondContact O-CE 3.23Å; A58-K62 WeakPolarHBondContact O-CG 3.34Å; A58-K62 PolarHBondContact O-N 3.27Å; A58-K62 VanDerWaalsContact O-N 3.13Å; E60-K62 PolarHBondContact O-N 3.32Å; K62-C65 PolarHBondContact O-N 2.96Å; K62-K66 WeakPolarHBondContact O-CB 3.34Å; K62-K66 PolarHBondContact O-N 2.84Å; K62-T391 HydrophobicContact CB-CG2 4.49Å; K62-T391 WeakPolarHBondContact O-CG2 3.26Å; K62-I393 HydrophobicContact CD-CG1 4.17Å; K62-I393 HydrophobicContact CG-CD1 4.01Å; K62-I393 HydrophobicContact CG-CG1 4.21Å
63	H	98.1	Very high	94.3	Very high	80 Å²	80	53.6 Å²	53.6	37%	0.37	26%	0.255	S	S	.	.	H	α-helix	trans	-62.4	-46.4	179.6	-175.4	82.5	0	0	0	112.1	K59 E60 Y61 K66 R67	K59-H63 WeakPolarHBondContact O-CB 3.48Å; K59-H63 PolarHBondContact O-N 3.31Å; E60-H63 WeakPolarHBondContact O-CB 3.42Å; E60-H63 PolarHBondContact O-N 3Å; E60-H63 VanDerWaalsContact O-N 3.11Å; Y61-H63 VanDerWaalsContact C-N 3.31Å; Y61-H63 PolarHBondContact O-N 3.45Å; H63-K66 WeakPolarHBondContact O-CB 3.37Å; H63-K66 PolarHBondContact O-N 3.29Å; H63-R67 WeakPolarHBondContact NE2-CD 3.45Å; H63-R67 PolarHBondContact O-N 2.91Å; H63-R67 VanDerWaalsContact O-N 3.1Å
64	V	98.1	Very high	94.9	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.012	28%	0.276	C	S	.	.	H	α-helix	trans	-66.2	-42.3	177.4	68	0	0	0	0	111.6	A48 E60 Y61 K66 R67 A68 E92 L93 T99	A48-V64 HydrophobicContact CB-CG1 4.19Å; E60-V64 PolarHBondContact O-N 3.21Å; Y61-V64 WeakPolarHBondContact O-CG1 3.47Å; Y61-V64 PolarHBondContact O-N 2.73Å; V64-K66 VanDerWaalsContact C-N 3.26Å; V64-K66 PolarHBondContact O-N 3.21Å; V64-R67 PolarHBondContact O-N 3.2Å; V64-R67 VanDerWaalsContact O-N 3.14Å; V64-A68 WeakPolarHBondContact O-CB 3.43Å; V64-A68 PolarHBondContact O-N 3.36Å; V64-E92 WeakPolarHBondContact CG2-O 3.36Å; V64-L93 HydrophobicContact CB-CD2 4.49Å; V64-L93 HydrophobicContact CG1-CD2 4.11Å; V64-L93 HydrophobicContact CG2-CD2 3.79Å; V64-T99 HydrophobicContact CG1-CG2 4.37Å
65	C	98.6	Very high	95.6	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.8	-40.3	174.4	-73.2	0	0	0	0	112.1	V46 A48 Y61 K62 A68 C69 C378 T391	V46-C65 HydrophobicContact CG2-CB 3.75Å; A48-C65 WeakPolarHBondContact CB-SG 3.48Å; Y61-C65 PolarHBondContact O-N 2.88Å; Y61-C65 PolarHBondContact O-SG 2.99Å; K62-C65 PolarHBondContact O-N 2.96Å; C65-A68 PolarHBondContact O-N 2.9Å; C65-C69 PolarHBondContact O-N 3.38Å; C65-C69 PolarHBondContact O-SG 2.85Å; C65-C378 VanDerWaalsContact SG-SG 3.67Å; C65-T391 HydrophobicContact CB-CG2 4.29Å
66	K	98.7	Very high	96.2	Very high	77 Å²	77	53.4 Å²	53.4	34%	0.335	25%	0.25	S	C	.	.	H	α-helix	trans	-60.4	-48.5	176.2	-169	-165.7	69.4	172.6	0	111.4	K62 H63 V64 C69 Q70 A389 T391	K62-K66 WeakPolarHBondContact O-CB 3.34Å; K62-K66 PolarHBondContact O-N 2.84Å; H63-K66 WeakPolarHBondContact O-CB 3.37Å; H63-K66 PolarHBondContact O-N 3.29Å; V64-K66 VanDerWaalsContact C-N 3.26Å; V64-K66 PolarHBondContact O-N 3.21Å; K66-C69 PolarHBondContact O-N 3.45Å; K66-Q70 WeakPolarHBondContact O-CG 3.45Å; K66-Q70 PolarHBondContact O-N 2.86Å; K66-Q70 VanDerWaalsContact O-N 3.14Å; K66-A389 HydrophobicContact CG-CB 3.89Å; K66-T391 HydrophobicContact CB-CG2 3.89Å
67	R	98.7	Very high	96.6	Very high	86 Å²	86	51.9 Å²	51.9	33%	0.325	23%	0.231	S	C	.	.	H	α-helix	trans	-65.5	-42.1	179.5	-66.6	-169.1	-58.9	163.1	13.7	111.4	H63 V64 C69 Q70 K71 E92	H63-R67 WeakPolarHBondContact NE2-CD 3.45Å; H63-R67 PolarHBondContact O-N 2.91Å; H63-R67 VanDerWaalsContact O-N 3.1Å; V64-R67 PolarHBondContact O-N 3.2Å; V64-R67 VanDerWaalsContact O-N 3.14Å; R67-C69 VanDerWaalsContact C-N 3.34Å; R67-C69 PolarHBondContact O-N 3.35Å; R67-Q70 WeakPolarHBondContact O-CA 3.36Å; R67-Q70 WeakPolarHBondContact O-CB 3.3Å; R67-Q70 PolarHBondContact O-N 3.37Å; R67-Q70 VanDerWaalsContact O-N 3.07Å; R67-K71 WeakPolarHBondContact O-CG 3.48Å; R67-K71 PolarHBondContact O-N 2.95Å; R67-E92 HydrophobicContact CB-CG 3.67Å; R67-E92 WeakPolarHBondContact CB-OE1 3.44Å; R67-E92 WeakPolarHBondContact CD-OE1 3.43Å; R67-E92 IonicContact CZ-OE1 3.4Å; R67-E92 IonicContact NE-OE1 3.38Å; R67-E92 PolarHBondContact NE-OE1 2.95Å; R67-E92 IonicContact NH1-OE1 3.52Å; R67-E92 PolarHBondContact NH1-OE1 2.86Å; R67-E92 IonicContact NH2-OE1 3.87Å; R67-E92 PolarHBondContact NH2-OE1 2.97Å
68	A	98.8	Very high	97.1	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.2	-43	177.8	0	0	0	0	0	112	V46 V64 C65 Q70 K71 A72 A89 E92 L93	V46-A68 HydrophobicContact CG1-CB 4.29Å; V46-A68 HydrophobicContact CG2-CB 4.35Å; V64-A68 WeakPolarHBondContact O-CB 3.43Å; V64-A68 PolarHBondContact O-N 3.36Å; C65-A68 PolarHBondContact O-N 2.9Å; A68-Q70 VanDerWaalsContact C-N 3.34Å; A68-Q70 PolarHBondContact O-N 2.71Å; A68-K71 PolarHBondContact O-N 3.05Å; A68-A72 PolarHBondContact O-N 3.33Å; A68-A89 HydrophobicContact CB-CB 4.21Å; A68-A89 WeakPolarHBondContact CB-O 3.38Å; A68-A89 WeakPolarHBondContact O-CB 3.37Å; A68-E92 HydrophobicContact CB-CB 4.26Å; A68-E92 HydrophobicContact CB-CG 4.26Å; A68-L93 HydrophobicContact CB-CD1 4.09Å; A68-L93 HydrophobicContact CB-CD2 3.92Å; A68-L93 HydrophobicContact CB-CG 3.69Å
69	C	98.8	Very high	97.3	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59	-45.1	172.2	-68.6	0	0	0	0	111.9	V44 C65 K66 R67 K71 A72 I73 G380 M382 A389	V44-C69 HydrophobicContact CG1-CB 3.99Å; C65-C69 PolarHBondContact O-N 3.38Å; C65-C69 PolarHBondContact O-SG 2.85Å; K66-C69 PolarHBondContact O-N 3.45Å; R67-C69 VanDerWaalsContact C-N 3.34Å; R67-C69 PolarHBondContact O-N 3.35Å; C69-K71 VanDerWaalsContact C-N 3.33Å; C69-K71 PolarHBondContact O-N 3.45Å; C69-A72 PolarHBondContact O-N 3.15Å; C69-I73 WeakPolarHBondContact O-CG1 3.48Å; C69-I73 PolarHBondContact O-N 3.24Å; C69-G380 PolarHBondContact SG-O 3.45Å; C69-G380 VanDerWaalsContact SG-O 3.41Å; C69-M382 HydrophobicContact CB-CB 3.8Å; C69-M382 HydrophobicContact CB-SD 4.33Å; C69-A389 HydrophobicContact CB-CB 3.82Å
70	Q	98.6	Very high	97.5	Very high	72 Å²	72	45.8 Å²	45.8	34%	0.336	23%	0.232	S	C	.	.	H	α-helix	trans	-60.3	-43.4	178.1	-69.9	171.2	-39.9	0	0	111.3	K66 R67 A68 I73 E74 M382	K66-Q70 WeakPolarHBondContact O-CG 3.45Å; K66-Q70 PolarHBondContact O-N 2.86Å; K66-Q70 VanDerWaalsContact O-N 3.14Å; R67-Q70 WeakPolarHBondContact O-CA 3.36Å; R67-Q70 WeakPolarHBondContact O-CB 3.3Å; R67-Q70 PolarHBondContact O-N 3.37Å; R67-Q70 VanDerWaalsContact O-N 3.07Å; A68-Q70 VanDerWaalsContact C-N 3.34Å; A68-Q70 PolarHBondContact O-N 2.71Å; Q70-I73 PolarHBondContact O-N 3.3Å; Q70-E74 WeakPolarHBondContact O-CB 3.42Å; Q70-E74 VanDerWaalsContact O-CG 3.23Å; Q70-E74 WeakPolarHBondContact O-CG 3.45Å; Q70-E74 PolarHBondContact O-N 3.42Å; Q70-M382 HydrophobicContact CG-SD 4.25Å
71	K	98.8	Very high	97.7	Very high	77 Å²	77	47.1 Å²	47.1	34%	0.335	24%	0.241	S	C	.	.	H	α-helix	trans	-63.3	-41.3	177.5	-67.3	-56.3	175.5	-164.8	0	113.8	R67 A68 C69 E74 K75 A88 E92	R67-K71 WeakPolarHBondContact O-CG 3.48Å; R67-K71 PolarHBondContact O-N 2.95Å; A68-K71 PolarHBondContact O-N 3.05Å; C69-K71 VanDerWaalsContact C-N 3.33Å; C69-K71 PolarHBondContact O-N 3.45Å; K71-E74 WeakPolarHBondContact CD-OE2 3.39Å; K71-E74 IonicContact NZ-OE1 2.88Å; K71-E74 IonicContact NZ-OE2 2.72Å; K71-E74 PolarHBondContact NZ-OE2 2.98Å; K71-K75 WeakPolarHBondContact O-CG 3.32Å; K71-K75 PolarHBondContact O-N 3.33Å; K71-A88 HydrophobicContact CB-CB 4.32Å; K71-E92 HydrophobicContact CG-CB 4.09Å; K71-E92 HydrophobicContact CG-CG 4.11Å
72	A	98.7	Very high	97.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.8	-46.7	173.2	0	0	0	0	0	112	V44 A68 C69 E74 K75 L76 A85 A89 V239	V44-A72 HydrophobicContact CB-CB 3.91Å; V44-A72 HydrophobicContact CG1-CB 4.05Å; V44-A72 HydrophobicContact CG2-CB 3.69Å; A68-A72 PolarHBondContact O-N 3.33Å; C69-A72 PolarHBondContact O-N 3.15Å; A72-E74 PolarHBondContact O-N 3.44Å; A72-K75 WeakPolarHBondContact O-CB 3.43Å; A72-K75 PolarHBondContact O-N 3.48Å; A72-K75 VanDerWaalsContact O-N 3.17Å; A72-L76 WeakPolarHBondContact O-CG 3.45Å; A72-L76 PolarHBondContact O-N 3.44Å; A72-A85 WeakPolarHBondContact CB-O 3.2Å; A72-A89 HydrophobicContact CB-CB 4.06Å; A72-V239 HydrophobicContact CB-CG2 4.35Å
73	I	98.3	Very high	97.9	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.015	23%	0.226	C	C	.	.	H	α-helix	trans	-65.2	-39.8	179.6	-65.5	-53.5	0	0	0	112	V44 C69 Q70 K75 L76 Q77 M382 A384	V44-I73 HydrophobicContact CG1-CD1 3.91Å; V44-I73 HydrophobicContact CG1-CG1 3.94Å; C69-I73 WeakPolarHBondContact O-CG1 3.48Å; C69-I73 PolarHBondContact O-N 3.24Å; Q70-I73 PolarHBondContact O-N 3.3Å; I73-K75 PolarHBondContact O-N 3.08Å; I73-L76 HydrophobicContact CD1-CD1 4.07Å; I73-L76 PolarHBondContact O-N 2.87Å; I73-Q77 HydrophobicContact CG2-CG 4.04Å; I73-Q77 WeakPolarHBondContact O-CB 3.38Å; I73-Q77 WeakPolarHBondContact O-CG 3.42Å; I73-Q77 PolarHBondContact O-N 3.48Å; I73-M382 HydrophobicContact CB-CE 4.25Å; I73-M382 HydrophobicContact CB-SD 4.4Å; I73-M382 HydrophobicContact CG1-CB 4.07Å; I73-M382 HydrophobicContact CG1-CE 4.16Å; I73-M382 HydrophobicContact CG1-CG 3.82Å; I73-M382 HydrophobicContact CG1-SD 3.9Å; I73-M382 HydrophobicContact CG2-CE 4.09Å; I73-A384 HydrophobicContact CD1-CB 4.14Å; I73-A384 HydrophobicContact CG2-CB 4.03Å
74	E	97.6	Very high	98	Very high	96 Å²	96	42 Å²	42	45%	0.449	22%	0.221	S	C	.	.	H	α-helix	trans	-54.2	-42.8	173.1	-78	167.5	-159.4	0	0	110.9	Q70 K71 A72 A78	Q70-E74 WeakPolarHBondContact O-CB 3.42Å; Q70-E74 VanDerWaalsContact O-CG 3.23Å; Q70-E74 WeakPolarHBondContact O-CG 3.45Å; Q70-E74 PolarHBondContact O-N 3.42Å; K71-E74 WeakPolarHBondContact CD-OE2 3.39Å; K71-E74 IonicContact NZ-OE1 2.88Å; K71-E74 IonicContact NZ-OE2 2.72Å; K71-E74 PolarHBondContact NZ-OE2 2.98Å; A72-E74 PolarHBondContact O-N 3.44Å; E74-A78 WeakPolarHBondContact O-CB 3.17Å; E74-A78 PolarHBondContact O-N 3.27Å
75	K	98.3	Very high	98	Very high	92 Å²	92	41.9 Å²	41.9	40%	0.4	22%	0.221	S	C	.	.	H	α-helix	trans	-66.8	-46.3	176.4	-73.7	-69.3	-173.3	172.9	0	112.9	K71 A72 I73 Q77 A78 G79 A80 A85 A88	K71-K75 WeakPolarHBondContact O-CG 3.32Å; K71-K75 PolarHBondContact O-N 3.33Å; A72-K75 WeakPolarHBondContact O-CB 3.43Å; A72-K75 PolarHBondContact O-N 3.48Å; A72-K75 VanDerWaalsContact O-N 3.17Å; I73-K75 PolarHBondContact O-N 3.08Å; K75-Q77 PolarHBondContact O-N 3.01Å; K75-A78 PolarHBondContact O-N 2.89Å; K75-G79 PolarHBondContact O-N 2.88Å; K75-A80 HydrophobicContact CB-CB 4.08Å; K75-A80 HydrophobicContact CD-CB 4.14Å; K75-A80 VanDerWaalsContact O-CB 3.27Å; K75-A80 WeakPolarHBondContact O-CB 3.41Å; K75-A80 PolarHBondContact O-N 3.07Å; K75-A85 HydrophobicContact CB-CB 3.83Å; K75-A88 HydrophobicContact CD-CB 4.44Å; K75-A88 HydrophobicContact CG-CB 3.63Å
76	L	96.8	Very high	98	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-62.7	-42.5	178.5	-65.8	176.3	0	0	0	111.8	A72 I73 A78 G79 A85 V239 D241	A72-L76 WeakPolarHBondContact O-CG 3.45Å; A72-L76 PolarHBondContact O-N 3.44Å; I73-L76 HydrophobicContact CD1-CD1 4.07Å; I73-L76 PolarHBondContact O-N 2.87Å; L76-A78 VanDerWaalsContact C-N 3.28Å; L76-A78 PolarHBondContact O-N 2.87Å; L76-G79 WeakPolarHBondContact O-CA 3.46Å; L76-G79 PolarHBondContact O-N 3.46Å; L76-A85 HydrophobicContact CD2-CB 3.63Å; L76-A85 HydrophobicContact CG-CB 3.79Å; L76-V239 HydrophobicContact CD1-CG1 3.8Å; L76-V239 HydrophobicContact CD2-CG1 3.93Å; L76-V239 HydrophobicContact CG-CG1 4.29Å; L76-D241 HydrophobicContact CD2-CB 3.88Å
77	Q	95.3	Very high	98	Very high	70 Å²	70	38.8 Å²	38.8	33%	0.327	21%	0.208	S	C	.	.	H	α-helix	trans	-66.5	-30.6	176.8	-72.3	177.1	-21.2	0	0	112.5	I73 K75 G79 A384	I73-Q77 HydrophobicContact CG2-CG 4.04Å; I73-Q77 WeakPolarHBondContact O-CB 3.38Å; I73-Q77 WeakPolarHBondContact O-CG 3.42Å; I73-Q77 PolarHBondContact O-N 3.48Å; K75-Q77 PolarHBondContact O-N 3.01Å; Q77-G79 PolarHBondContact O-N 2.86Å; Q77-A384 HydrophobicContact CG-CB 4.44Å; Q77-A384 PolarHBondContact NE2-O 2.85Å
78	A	95.9	Very high	98	Very high	83 Å²	83	35.6 Å²	35.6	69%	0.686	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-5	171.5	0	0	0	0	0	113.5	E74 K75 L76	E74-A78 WeakPolarHBondContact O-CB 3.17Å; E74-A78 PolarHBondContact O-N 3.27Å; K75-A78 PolarHBondContact O-N 2.89Å; L76-A78 VanDerWaalsContact C-N 3.28Å; L76-A78 PolarHBondContact O-N 2.87Å
79	G	95.3	Very high	98	Very high	30 Å²	30	35.6 Å²	35.6	31%	0.309	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	23.5	-178.6	0	0	0	0	0	114.1	K75 L76 Q77	K75-G79 PolarHBondContact O-N 2.88Å; L76-G79 WeakPolarHBondContact O-CA 3.46Å; L76-G79 PolarHBondContact O-N 3.46Å; Q77-G79 PolarHBondContact O-N 2.86Å
80	A	97.4	Very high	98	Very high	28 Å²	28	35.6 Å²	35.6	23%	0.231	20%	0.2	C	C	.	.			trans	-72	164.7	173	0	0	0	0	0	111.6	K75 D84	K75-A80 HydrophobicContact CB-CB 4.08Å; K75-A80 HydrophobicContact CD-CB 4.14Å; K75-A80 VanDerWaalsContact O-CB 3.27Å; K75-A80 WeakPolarHBondContact O-CB 3.41Å; K75-A80 PolarHBondContact O-N 3.07Å; A80-D84 HydrophobicContact CB-CB 4.08Å
81	L	98.2	Very high	98	Very high	102 Å²	102	33.9 Å²	33.9	53%	0.534	19%	0.194	S	C	.	.			trans	-66.9	153.9	176.1	-59	175.4	0	0	0	111.1	T83 D84 A85	L81-T83 PolarHBondContact O-N 3.42Å; L81-D84 PolarHBondContact O-N 3.06Å; L81-A85 PolarHBondContact O-N 3.14Å
82	A	98.6	Very high	98	Very high	4 Å²	4	31.5 Å²	31.5	3%	0.033	18%	0.184	C	C	.	.	H	α-helix	trans	-56.5	-36.2	174	0	0	0	0	0	112.1	A85 V86 V239 A247	A82-A85 PolarHBondContact O-N 3.47Å; A82-V86 PolarHBondContact O-N 3.01Å; A82-V239 HydrophobicContact CB-CG1 4.44Å; A82-A247 HydrophobicContact CB-CB 3.78Å
83	T	98.9	Very high	98	Very high	3 Å²	3	31.5 Å²	31.5	2%	0.018	18%	0.184	C	C	.	.	H	α-helix	trans	-62.9	-40.6	173.9	47.4	0	0	0	0	112.9	L81 V86 T87 I119 D121 L147 A247	L81-T83 PolarHBondContact O-N 3.42Å; T83-V86 WeakPolarHBondContact O-CG1 3.44Å; T83-T87 VanDerWaalsContact O-CB 3.23Å; T83-T87 WeakPolarHBondContact O-CB 3.47Å; T83-T87 PolarHBondContact O-N 3.36Å; T83-T87 PolarHBondContact O-OG1 2.96Å; T83-I119 HydrophobicContact CG2-CD1 4.36Å; T83-D121 HydrophobicContact CG2-CB 3.62Å; T83-L147 HydrophobicContact CG2-CD1 4.27Å; T83-L147 HydrophobicContact CG2-CD2 4.21Å; T83-A247 HydrophobicContact CG2-CB 4.24Å
84	D	98.8	Very high	98	Very high	53 Å²	53	31.3 Å²	31.3	28%	0.283	18%	0.184	S	C	.	.	H	α-helix	trans	-70.6	-35.1	176.5	-67	-37.9	0	0	0	111.9	A80 L81 A88	A80-D84 HydrophobicContact CB-CB 4.08Å; L81-D84 PolarHBondContact O-N 3.06Å; D84-A88 WeakPolarHBondContact O-CB 3.42Å; D84-A88 PolarHBondContact O-N 3.46Å
85	A	98.8	Very high	98	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.5	-46.6	176.1	0	0	0	0	0	111.9	A72 K75 L76 L81 A82 T87 A88 A89 V239	A72-A85 WeakPolarHBondContact CB-O 3.2Å; K75-A85 HydrophobicContact CB-CB 3.83Å; L76-A85 HydrophobicContact CD2-CB 3.63Å; L76-A85 HydrophobicContact CG-CB 3.79Å; L81-A85 PolarHBondContact O-N 3.14Å; A82-A85 PolarHBondContact O-N 3.47Å; A85-T87 VanDerWaalsContact C-N 3.35Å; A85-A88 PolarHBondContact O-N 3.05Å; A85-A89 PolarHBondContact O-N 2.72Å; A85-A89 VanDerWaalsContact O-N 3.15Å; A85-V239 HydrophobicContact CB-CG1 4.11Å
86	V	98.9	Very high	97.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.5	-38.7	176.3	78.9	0	0	0	0	110.9	A82 T83 A88 A89 L90 I119 A237 V239 A247 A249	A82-V86 PolarHBondContact O-N 3.01Å; T83-V86 WeakPolarHBondContact O-CG1 3.44Å; V86-A88 VanDerWaalsContact C-N 3.34Å; V86-A88 PolarHBondContact O-N 3.2Å; V86-A89 PolarHBondContact O-N 3.1Å; V86-L90 HydrophobicContact CG2-CD2 4.27Å; V86-L90 WeakPolarHBondContact O-CD2 3.45Å; V86-L90 PolarHBondContact O-N 3.45Å; V86-I119 HydrophobicContact CG1-CD1 3.6Å; V86-I119 HydrophobicContact CG1-CG1 4.12Å; V86-A237 HydrophobicContact CG2-CB 3.62Å; V86-A237 VanDerWaalsContact CG2-O 3.28Å; V86-A237 WeakPolarHBondContact CG2-O 3.37Å; V86-V239 HydrophobicContact CB-CB 4.31Å; V86-V239 HydrophobicContact CB-CG2 3.82Å; V86-V239 HydrophobicContact CG2-CG2 4.09Å; V86-A247 HydrophobicContact CB-CB 4.41Å; V86-A247 HydrophobicContact CG1-CB 3.92Å; V86-A249 HydrophobicContact CG1-CB 4.06Å; V86-A249 HydrophobicContact CG2-CB 3.94Å
87	T	98.9	Very high	97.7	Very high	12 Å²	12	26.9 Å²	26.9	7%	0.074	17%	0.17	C	C	.	.	H	α-helix	trans	-59.9	-43.1	173.8	-60.4	0	0	0	0	111.5	T83 A85 A89 L90 V91 I119 V140 N144	T83-T87 VanDerWaalsContact O-CB 3.23Å; T83-T87 WeakPolarHBondContact O-CB 3.47Å; T83-T87 PolarHBondContact O-N 3.36Å; T83-T87 PolarHBondContact O-OG1 2.96Å; A85-T87 VanDerWaalsContact C-N 3.35Å; T87-A89 VanDerWaalsContact C-N 3.34Å; T87-A89 PolarHBondContact O-N 3.31Å; T87-L90 PolarHBondContact O-N 2.96Å; T87-V91 HydrophobicContact CG2-CG2 4.37Å; T87-V91 WeakPolarHBondContact O-CG2 3.22Å; T87-V91 PolarHBondContact O-N 3.17Å; T87-I119 WeakPolarHBondContact OG1-CD1 3.47Å; T87-V140 HydrophobicContact CG2-CG1 4.19Å; T87-V140 HydrophobicContact CG2-CG2 4.5Å; T87-N144 HydrophobicContact CG2-CB 4.05Å; T87-N144 WeakPolarHBondContact OG1-CB 3.38Å; T87-N144 VanDerWaalsContact OG1-CG 3.25Å; T87-N144 PolarHBondContact OG1-OD1 2.97Å
88	A	98.9	Very high	97.5	Very high	18 Å²	18	26.6 Å²	26.6	15%	0.149	17%	0.168	C	C	.	.	H	α-helix	trans	-64.8	-35.7	178.4	0	0	0	0	0	113.1	K71 K75 D84 A85 V86 E92	K71-A88 HydrophobicContact CB-CB 4.32Å; K75-A88 HydrophobicContact CD-CB 4.44Å; K75-A88 HydrophobicContact CG-CB 3.63Å; D84-A88 WeakPolarHBondContact O-CB 3.42Å; D84-A88 PolarHBondContact O-N 3.46Å; A85-A88 PolarHBondContact O-N 3.05Å; V86-A88 VanDerWaalsContact C-N 3.34Å; V86-A88 PolarHBondContact O-N 3.2Å; A88-E92 PolarHBondContact O-N 2.7Å
89	A	98.9	Very high	97.4	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64.5	-44.9	171.5	0	0	0	0	0	111.7	V46 A68 A72 A85 V86 T87 E92 L93 A237	V46-A89 HydrophobicContact CG1-CB 4.16Å; A68-A89 HydrophobicContact CB-CB 4.21Å; A68-A89 WeakPolarHBondContact CB-O 3.38Å; A68-A89 WeakPolarHBondContact O-CB 3.37Å; A72-A89 HydrophobicContact CB-CB 4.06Å; A85-A89 PolarHBondContact O-N 2.72Å; A85-A89 VanDerWaalsContact O-N 3.15Å; V86-A89 PolarHBondContact O-N 3.1Å; T87-A89 VanDerWaalsContact C-N 3.34Å; T87-A89 PolarHBondContact O-N 3.31Å; A89-E92 PolarHBondContact O-N 3.41Å; A89-L93 WeakPolarHBondContact O-CG 3.34Å; A89-L93 PolarHBondContact O-N 2.88Å; A89-A237 HydrophobicContact CB-CB 4.04Å
90	L	98.8	Very high	97.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.1	-40	179.9	-91.3	-69.4	0	0	0	112.5	V86 T87 E92 L93 E94 V140 V235 A237 A249	V86-L90 HydrophobicContact CG2-CD2 4.27Å; V86-L90 WeakPolarHBondContact O-CD2 3.45Å; V86-L90 PolarHBondContact O-N 3.45Å; T87-L90 PolarHBondContact O-N 2.96Å; L90-E92 VanDerWaalsContact C-N 3.28Å; L90-E92 PolarHBondContact O-N 3.02Å; L90-L93 CarbonylContact O-C 3.5Å; L90-L93 WeakPolarHBondContact O-CB 3.35Å; L90-L93 PolarHBondContact O-N 2.88Å; L90-L93 VanDerWaalsContact O-N 3.1Å; L90-E94 WeakPolarHBondContact O-CB 3.32Å; L90-E94 WeakPolarHBondContact O-CG 3.07Å; L90-E94 PolarHBondContact O-N 2.94Å; L90-V140 HydrophobicContact CB-CB 3.94Å; L90-V140 HydrophobicContact CB-CG1 3.75Å; L90-V140 HydrophobicContact CB-CG2 3.71Å; L90-V140 HydrophobicContact CG-CB 4.49Å; L90-V140 HydrophobicContact CG-CG2 3.99Å; L90-V235 HydrophobicContact CD1-CB 4.5Å; L90-V235 HydrophobicContact CD1-CG2 3.73Å; L90-A237 HydrophobicContact CD2-CB 3.4Å; L90-A249 HydrophobicContact CD2-CB 3.93Å; L90-A249 HydrophobicContact CG-CB 3.92Å
91	V	98.8	Very high	97.4	Very high	36 Å²	36	20.3 Å²	20.3	22%	0.218	11%	0.112	C	C	.	.	H	α-helix	trans	-58	-43	174.9	167.9	0	0	0	0	110.9	T87 L93 E94 D95 N138 V140	T87-V91 HydrophobicContact CG2-CG2 4.37Å; T87-V91 WeakPolarHBondContact O-CG2 3.22Å; T87-V91 PolarHBondContact O-N 3.17Å; V91-L93 VanDerWaalsContact C-N 3.31Å; V91-L93 PolarHBondContact O-N 2.79Å; V91-E94 PolarHBondContact O-N 3.31Å; V91-D95 VanDerWaalsContact O-CB 3.3Å; V91-D95 WeakPolarHBondContact O-CB 3.34Å; V91-D95 VanDerWaalsContact O-CG 3.3Å; V91-D95 PolarHBondContact O-N 3.47Å; V91-N138 HydrophobicContact CG2-CB 4.26Å; V91-V140 HydrophobicContact CG2-CG1 3.81Å
92	E	98.8	Very high	97.3	Very high	27 Å²	27	15.5 Å²	15.5	13%	0.126	9%	0.087	C	C	.	.	H	α-helix	trans	-66.5	-32.9	177.3	-175.7	63.3	-140.1	0	0	112.7	V64 R67 A68 K71 A88 A89 L90	V64-E92 WeakPolarHBondContact CG2-O 3.36Å; R67-E92 HydrophobicContact CB-CG 3.67Å; R67-E92 WeakPolarHBondContact CB-OE1 3.44Å; R67-E92 WeakPolarHBondContact CD-OE1 3.43Å; R67-E92 IonicContact CZ-OE1 3.4Å; R67-E92 IonicContact NE-OE1 3.38Å; R67-E92 PolarHBondContact NE-OE1 2.95Å; R67-E92 IonicContact NH1-OE1 3.52Å; R67-E92 PolarHBondContact NH1-OE1 2.86Å; R67-E92 IonicContact NH2-OE1 3.87Å; R67-E92 PolarHBondContact NH2-OE1 2.97Å; A68-E92 HydrophobicContact CB-CB 4.26Å; A68-E92 HydrophobicContact CB-CG 4.26Å; K71-E92 HydrophobicContact CG-CB 4.09Å; K71-E92 HydrophobicContact CG-CG 4.11Å; A88-E92 PolarHBondContact O-N 2.7Å; A89-E92 PolarHBondContact O-N 3.41Å; L90-E92 VanDerWaalsContact C-N 3.28Å; L90-E92 PolarHBondContact O-N 3.02Å
93	L	98.6	Very high	97.1	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-70.9	-50.9	173.6	-68.9	162.3	0	0	0	110.8	V46 A48 V64 A68 A89 L90 V91 D95 S96 T99 V235	V46-L93 HydrophobicContact CB-CD1 4.27Å; A48-L93 HydrophobicContact CB-CD2 4.33Å; V64-L93 HydrophobicContact CB-CD2 4.49Å; V64-L93 HydrophobicContact CG1-CD2 4.11Å; V64-L93 HydrophobicContact CG2-CD2 3.79Å; A68-L93 HydrophobicContact CB-CD1 4.09Å; A68-L93 HydrophobicContact CB-CD2 3.92Å; A68-L93 HydrophobicContact CB-CG 3.69Å; A89-L93 WeakPolarHBondContact O-CG 3.34Å; A89-L93 PolarHBondContact O-N 2.88Å; L90-L93 CarbonylContact O-C 3.5Å; L90-L93 WeakPolarHBondContact O-CB 3.35Å; L90-L93 PolarHBondContact O-N 2.88Å; L90-L93 VanDerWaalsContact O-N 3.1Å; V91-L93 VanDerWaalsContact C-N 3.31Å; V91-L93 PolarHBondContact O-N 2.79Å; L93-D95 VanDerWaalsContact C-N 3.27Å; L93-D95 PolarHBondContact O-N 3.15Å; L93-S96 VanDerWaalsContact O-CB 3.26Å; L93-S96 WeakPolarHBondContact O-CB 3.32Å; L93-S96 PolarHBondContact O-N 2.71Å; L93-S96 VanDerWaalsContact O-N 3.07Å; L93-T99 PolarHBondContact O-OG1 2.8Å; L93-V235 HydrophobicContact CB-CB 3.76Å; L93-V235 HydrophobicContact CB-CG1 4.01Å; L93-V235 HydrophobicContact CB-CG2 3.84Å; L93-V235 HydrophobicContact CD1-CB 4.07Å; L93-V235 HydrophobicContact CG-CB 4.33Å
94	E	98.3	Very high	96.8	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.6	-29.1	179.2	-74.2	178.5	157.5	0	0	114	L90 V91 S96 A101 M103 N138 P139 V140 S251	L90-E94 WeakPolarHBondContact O-CB 3.32Å; L90-E94 WeakPolarHBondContact O-CG 3.07Å; L90-E94 PolarHBondContact O-N 2.94Å; V91-E94 PolarHBondContact O-N 3.31Å; E94-S96 PolarHBondContact O-N 3.38Å; E94-A101 WeakPolarHBondContact CA-O 3.3Å; E94-A101 HydrophobicContact CG-CB 4.18Å; E94-M103 PolarHBondContact O-N 3.23Å; E94-N138 WeakPolarHBondContact OE2-CA 3.05Å; E94-N138 VanDerWaalsContact OE2-CB 3.22Å; E94-N138 WeakPolarHBondContact OE2-CB 3.07Å; E94-N138 PolarHBondContact OE2-ND2 3.28Å; E94-P139 WeakPolarHBondContact OE1-CD 3.29Å; E94-V140 PolarHBondContact OE1-N 3.42Å; E94-V140 WeakPolarHBondContact OE2-CG1 3.41Å; E94-S251 WeakPolarHBondContact OE1-CB 3.23Å; E94-S251 PolarHBondContact OE1-OG 3.19Å
95	D	97.6	Very high	96.7	Very high	47 Å²	47	14.8 Å²	14.8	25%	0.251	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-12.8	177.6	-83.7	7.7	0	0	0	112.6	V91 L93 K137 N138	V91-D95 VanDerWaalsContact O-CB 3.3Å; V91-D95 WeakPolarHBondContact O-CB 3.34Å; V91-D95 VanDerWaalsContact O-CG 3.3Å; V91-D95 PolarHBondContact O-N 3.47Å; L93-D95 VanDerWaalsContact C-N 3.27Å; L93-D95 PolarHBondContact O-N 3.15Å; D95-K137 WeakPolarHBondContact OD1-CE 3.29Å; D95-K137 IonicContact OD1-NZ 2.85Å; D95-K137 PolarHBondContact OD1-NZ 3.45Å; D95-K137 IonicContact OD2-NZ 3.57Å; D95-K137 PolarHBondContact OD2-NZ 2.77Å; D95-N138 PolarHBondContact OD1-ND2 3.44Å
96	S	95.4	Very high	96.5	Very high	4 Å²	4	15.9 Å²	15.9	3%	0.028	9%	0.089	C	C	.	.			trans	-77.1	124.7	177.9	-179	0	0	0	0	111.2	L93 E94 F98 T99	L93-S96 VanDerWaalsContact O-CB 3.26Å; L93-S96 WeakPolarHBondContact O-CB 3.32Å; L93-S96 PolarHBondContact O-N 2.71Å; L93-S96 VanDerWaalsContact O-N 3.07Å; E94-S96 PolarHBondContact O-N 3.38Å; S96-F98 PolarHBondContact O-N 2.95Å; S96-T99 PolarHBondContact O-N 2.75Å; S96-T99 PolarHBondContact O-OG1 2.78Å
97	P	92.9	Very high	96.4	Very high	48 Å²	48	16.2 Å²	16.2	31%	0.312	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-3.7	179.8	31.8	-37.8	0	0	0	113.8	T189	P97-T189 HydrophobicContact CB-CG2 3.7Å
98	F	90.4	Very high	96.3	Very high	64 Å²	64	15.7 Å²	15.7	28%	0.281	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-13.1	-179.3	-62.2	-68.1	0	0	0	113.4	E60 S96 F191	E60-F98 HydrophobicContact CB-CD2 3.87Å; E60-F98 HydrophobicContact CB-CE2 4.01Å; E60-F98 HydrophobicContact CB-CG 4.24Å; E60-F98 HydrophobicContact CG-CD2 4.26Å; E60-F98 HydrophobicContact CG-CE2 3.9Å; E60-F98 HydrophobicContact CG-CZ 4.03Å; S96-F98 PolarHBondContact O-N 2.95Å; F98-F191 HydrophobicContact CE1-CE2 4.23Å
99	T	93.8	Very high	96.2	Very high	2 Å²	2	17.6 Å²	17.6	1%	0.012	10%	0.095	C	C	.	.	S	Bend	trans	-97.6	143.8	-178.6	48.1	0	0	0	0	110.5	A48 V64 L93 S96 A101 V235	A48-T99 HydrophobicContact CB-CG2 4.42Å; V64-T99 HydrophobicContact CG1-CG2 4.37Å; L93-T99 PolarHBondContact O-OG1 2.8Å; S96-T99 PolarHBondContact O-N 2.75Å; S96-T99 PolarHBondContact O-OG1 2.78Å; T99-A101 PolarHBondContact O-N 3.21Å; T99-V235 HydrophobicContact CG2-CG1 3.56Å
100	N	95.7	Very high	96.2	Very high	7 Å²	7	23 Å²	23	4%	0.037	12%	0.123	C	C	.	.	S	Bend	trans	-83.5	64.5	172.9	173.3	42.8	0	0	0	110.5	N106 D233 S252 G253 G254	N100-N106 VanDerWaalsContact CG-ND2 3.3Å; N100-N106 PolarHBondContact ND2-ND2 3.18Å; N100-N106 WeakPolarHBondContact OD1-CB 3.49Å; N100-N106 PolarHBondContact OD1-N 2.92Å; N100-N106 PolarHBondContact OD1-ND2 3.43Å; N100-D233 HydrophobicContact CB-CB 3.96Å; N100-D233 VanDerWaalsContact CB-O 3.23Å; N100-D233 WeakPolarHBondContact CB-O 3.45Å; N100-D233 PolarHBondContact ND2-O 2.92Å; N100-S252 CarbonylContact O-C 3.58Å; N100-S252 WeakPolarHBondContact O-CA 3.48Å; N100-G253 PolarHBondContact O-N 3.49Å; N100-G253 WeakPolarHBondContact OD1-CA 3.2Å; N100-G254 PolarHBondContact ND2-O 2.92Å
101	A	96.8	Very high	96	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	-162.5	140.4	175	0	0	0	0	0	109.2	E94 T99 M103 S105 V235	E94-A101 WeakPolarHBondContact CA-O 3.3Å; E94-A101 HydrophobicContact CG-CB 4.18Å; T99-A101 PolarHBondContact O-N 3.21Å; A101-M103 PolarHBondContact O-N 2.85Å; A101-S105 VanDerWaalsContact C-OG 3.29Å; A101-S105 VanDerWaalsContact CA-OG 3.27Å; A101-S105 WeakPolarHBondContact CA-OG 3.39Å; A101-S105 PolarHBondContact N-OG 3.2Å; A101-V235 HydrophobicContact CB-CB 4.43Å; A101-V235 HydrophobicContact CB-CG1 4.26Å; A101-V235 HydrophobicContact CB-CG2 3.42Å; A101-V235 VanDerWaalsContact CB-CG2 3.42Å
102	G	96.9	Very high	96	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	57.5	-120.3	-175.7	0	0	0	0	0	112.5	S105 M187	G102-S105 PolarHBondContact N-OG 3.38Å; G102-S105 WeakPolarHBondContact O-CB 3.26Å; G102-S105 PolarHBondContact O-N 3.31Å; G102-S105 PolarHBondContact O-OG 3.25Å; G102-M187 VanDerWaalsContact O-CE 3.31Å; G102-M187 WeakPolarHBondContact O-CE 3.17Å
103	M	94.9	Very high	95.9	Very high	38 Å²	38	26.7 Å²	26.7	19%	0.187	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	129.8	179.3	-167.8	-172.9	-42.9	0	0	110.6	E94 A101 S105 T189	E94-M103 PolarHBondContact O-N 3.23Å; A101-M103 PolarHBondContact O-N 2.85Å; M103-S105 VanDerWaalsContact C-N 3.34Å; M103-T189 HydrophobicContact CG-CG2 4.25Å
104	G	91.9	Very high	95.9	Very high	8 Å²	8	27.8 Å²	27.8	8%	0.082	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.2	5.1	-176.7	0	0	0	0	0	114.7	M187	G104-M187 PolarHBondContact N-O 2.94Å
105	S	96.3	Very high	95.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-48.4	149.3	167	-80.8	0	0	0	0	112.9	A101 G102 M103 G253	A101-S105 VanDerWaalsContact C-OG 3.29Å; A101-S105 VanDerWaalsContact CA-OG 3.27Å; A101-S105 WeakPolarHBondContact CA-OG 3.39Å; A101-S105 PolarHBondContact N-OG 3.2Å; G102-S105 PolarHBondContact N-OG 3.38Å; G102-S105 WeakPolarHBondContact O-CB 3.26Å; G102-S105 PolarHBondContact O-N 3.31Å; G102-S105 PolarHBondContact O-OG 3.25Å; M103-S105 VanDerWaalsContact C-N 3.34Å; S105-G253 VanDerWaalsContact OG-CA 3.32Å; S105-G253 WeakPolarHBondContact OG-CA 3.33Å
106	N	95.8	Very high	96	Very high	22 Å²	22	25.6 Å²	25.6	12%	0.118	14%	0.138	C	C	.	.	P	Polyproline II helix	trans	-56.5	141.1	172	-78.3	-30.6	0	0	0	110.9	N100 G254 A256	N100-N106 VanDerWaalsContact CG-ND2 3.3Å; N100-N106 PolarHBondContact ND2-ND2 3.18Å; N100-N106 WeakPolarHBondContact OD1-CB 3.49Å; N100-N106 PolarHBondContact OD1-N 2.92Å; N100-N106 PolarHBondContact OD1-ND2 3.43Å; N106-G254 PolarHBondContact ND2-O 2.87Å; N106-A256 HydrophobicContact CB-CB 4.23Å
107	L	96.7	Very high	96.2	Very high	8 Å²	8	25.4 Å²	25.4	4%	0.042	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-84.7	138.7	175.4	-72.8	67.2	0	0	0	109.4	G111 E112 I113 T188 S192 L193 F196 L257	L107-G111 VanDerWaalsContact CD2-O 3.3Å; L107-G111 WeakPolarHBondContact CD2-O 3.49Å; L107-E112 CarbonylContact C-O 3.57Å; L107-E112 WeakPolarHBondContact CA-O 3.41Å; L107-I113 HydrophobicContact CD1-CG1 4.47Å; L107-I113 HydrophobicContact CG-CG1 4.48Å; L107-T188 HydrophobicContact CD1-CG2 4.38Å; L107-T188 HydrophobicContact CD2-CG2 4.34Å; L107-S192 WeakPolarHBondContact CD1-OG 3.38Å; L107-L193 HydrophobicContact CD2-CD1 4.17Å; L107-F196 HydrophobicContact CB-CB 3.98Å; L107-F196 HydrophobicContact CB-CD2 3.64Å; L107-F196 HydrophobicContact CB-CE2 4.39Å; L107-F196 HydrophobicContact CB-CG 3.93Å; L107-F196 HydrophobicContact CD1-CB 4.47Å; L107-F196 HydrophobicContact CD2-CB 3.8Å; L107-F196 HydrophobicContact CD2-CD1 4.08Å; L107-F196 HydrophobicContact CD2-CD2 4.3Å; L107-F196 HydrophobicContact CD2-CG 3.79Å; L107-F196 HydrophobicContact CG-CB 4.31Å; L107-F196 HydrophobicContact CG-CG 4.46Å; L107-L257 PolarHBondContact O-N 2.9Å
108	N	97.1	Very high	96.5	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	12%	0.122	C	C	.	.			trans	-71.8	-178.3	173.9	76.8	9.4	0	0	0	111.1	L110 G111 E112 E114 F196 K258	N108-L110 PolarHBondContact O-N 2.67Å; N108-L110 VanDerWaalsContact O-N 3.13Å; N108-L110 WeakPolarHBondContact OD1-CA 3.41Å; N108-L110 WeakPolarHBondContact OD1-CB 3.37Å; N108-L110 PolarHBondContact OD1-N 2.94Å; N108-G111 PolarHBondContact O-N 3.18Å; N108-G111 PolarHBondContact OD1-N 3.26Å; N108-E112 VanDerWaalsContact CG-O 3.32Å; N108-E112 PolarHBondContact N-O 2.89Å; N108-E112 PolarHBondContact OD1-N 2.56Å; N108-E112 PolarHBondContact OD1-O 3.07Å; N108-E114 PolarHBondContact ND2-OE2 3.48Å; N108-F196 WeakPolarHBondContact O-CE2 3.48Å; N108-K258 HydrophobicContact CB-CG 3.9Å; N108-K258 WeakPolarHBondContact CB-O 3.49Å
109	L	96.8	Very high	96.9	Very high	58 Å²	58	20.1 Å²	20.1	30%	0.304	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-27.8	-176.8	-169.8	62.5	0	0	0	113.9	K200 L203 K258	L109-K200 PolarHBondContact O-NZ 3.1Å; L109-L203 HydrophobicContact CD1-CD2 3.97Å; L109-K258 PolarHBondContact N-O 3.24Å
110	L	97.1	Very high	97.1	Very high	112 Å²	112	20 Å²	20	59%	0.586	11%	0.108	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-5.4	177.5	-60.3	-177.8	0	0	0	113.4	N108 E112 P260	N108-L110 PolarHBondContact O-N 2.67Å; N108-L110 VanDerWaalsContact O-N 3.13Å; N108-L110 WeakPolarHBondContact OD1-CA 3.41Å; N108-L110 WeakPolarHBondContact OD1-CB 3.37Å; N108-L110 PolarHBondContact OD1-N 2.94Å; L110-E112 HydrophobicContact CB-CG 4.2Å; L110-P260 HydrophobicContact CB-CG 4.48Å; L110-P260 HydrophobicContact CD1-CB 4.31Å; L110-P260 HydrophobicContact CD1-CG 3.52Å; L110-P260 HydrophobicContact CG-CG 3.58Å
111	G	96.4	Very high	97.3	Very high	22 Å²	22	20.4 Å²	20.4	23%	0.227	11%	0.11	C	C	.	.	S	Bend	trans	84	19.2	-175.6	0	0	0	0	0	113.4	L107 N108 F196	L107-G111 VanDerWaalsContact CD2-O 3.3Å; L107-G111 WeakPolarHBondContact CD2-O 3.49Å; N108-G111 PolarHBondContact O-N 3.18Å; N108-G111 PolarHBondContact OD1-N 3.26Å; G111-F196 VanDerWaalsContact CA-CZ 3.47Å
112	E	97.3	Very high	97.4	Very high	106 Å²	106	20.5 Å²	20.5	50%	0.495	11%	0.111	S	C	.	.			trans	-106.5	158.6	-178.7	-58	174.2	156.8	0	0	111	L107 N108 L110	L107-E112 CarbonylContact C-O 3.57Å; L107-E112 WeakPolarHBondContact CA-O 3.41Å; N108-E112 VanDerWaalsContact CG-O 3.32Å; N108-E112 PolarHBondContact N-O 2.89Å; N108-E112 PolarHBondContact OD1-N 2.56Å; N108-E112 PolarHBondContact OD1-O 3.07Å; L110-E112 HydrophobicContact CB-CG 4.2Å
113	I	97.9	Very high	97.4	Very high	14 Å²	14	26.4 Å²	26.4	7%	0.072	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-98.6	128.9	175.6	-70.7	169.9	0	0	0	109.1	L107 S134 M187	L107-I113 HydrophobicContact CD1-CG1 4.47Å; L107-I113 HydrophobicContact CG-CG1 4.48Å; I113-S134 WeakPolarHBondContact O-CB 3.42Å; I113-M187 HydrophobicContact CD1-CB 3.71Å; I113-M187 WeakPolarHBondContact CD1-O 3.36Å; I113-M187 HydrophobicContact CG2-CE 4.37Å
114	E	98.5	Very high	97.6	Very high	22 Å²	22	26.9 Å²	26.9	10%	0.103	14%	0.144	C	C	.	.			trans	-133.7	115.4	173.8	-76.4	178.4	119.5	0	0	108.7	N108 G253 K258 P260 G261	N108-E114 PolarHBondContact ND2-OE2 3.48Å; E114-G253 VanDerWaalsContact O-O 3.12Å; E114-K258 WeakPolarHBondContact O-CE 3.28Å; E114-K258 PolarHBondContact O-NZ 3.43Å; E114-P260 VanDerWaalsContact OE2-CA 3.3Å; E114-P260 WeakPolarHBondContact OE2-CA 3.41Å; E114-G261 PolarHBondContact OE1-N 2.93Å; E114-G261 PolarHBondContact OE2-N 3Å
115	C	98.6	Very high	97.9	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.007	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	151.1	-175.5	-58.4	0	0	0	0	112.4	A132 L133 P139 S252	C115-A132 PolarHBondContact O-N 3.02Å; C115-L133 PolarHBondContact N-O 2.98Å; C115-L133 PolarHBondContact O-N 3.29Å; C115-P139 HydrophobicContact CB-CB 4.02Å; C115-P139 HydrophobicContact CB-CG 3.32Å; C115-S252 CarbonylContact C-O 3.58Å; C115-S252 VanDerWaalsContact CA-O 3.29Å; C115-S252 WeakPolarHBondContact CA-O 3.45Å
116	D	98.9	Very high	98	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130.9	173.9	-60.8	-34.6	0	0	0	108.1	V130 G131 A132 S251 S252 K258 G264 A266 A267	D116-V130 WeakPolarHBondContact CA-O 3.35Å; D116-G131 VanDerWaalsContact OD1-CA 3.25Å; D116-G131 WeakPolarHBondContact OD1-CA 3.48Å; D116-A132 PolarHBondContact OD1-N 3.14Å; D116-S251 CarbonylContact O-C 3.51Å; D116-S251 WeakPolarHBondContact O-CA 3.35Å; D116-S252 PolarHBondContact N-O 3.44Å; D116-S252 PolarHBondContact O-N 2.74Å; D116-K258 IonicContact OD2-NZ 3.41Å; D116-G264 PolarHBondContact OD2-N 3.31Å; D116-A266 HydrophobicContact CB-CB 3.93Å; D116-A266 WeakPolarHBondContact O-CB 3.47Å; D116-A267 HydrophobicContact CB-CB 3.97Å
117	A	98.9	Very high	98.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	150.3	177.2	0	0	0	0	0	112.2	A129 V130 P139 V250 A266	A117-A129 CarbonylContact O-C 3.53Å; A117-A129 VanDerWaalsContact O-CA 3.24Å; A117-A129 WeakPolarHBondContact O-CA 3.3Å; A117-V130 HydrophobicContact CB-CG2 4.12Å; A117-V130 PolarHBondContact N-O 2.97Å; A117-V130 PolarHBondContact O-N 3.06Å; A117-P139 HydrophobicContact CB-CB 3.65Å; A117-V250 VanDerWaalsContact CA-O 3.26Å; A117-V250 WeakPolarHBondContact CA-O 3.43Å; A117-V250 WeakPolarHBondContact CB-O 3.4Å; A117-A266 CarbonylContact C-O 3.43Å; A117-A266 WeakPolarHBondContact CA-O 3.35Å
118	S	98.9	Very high	98.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	159.5	176.1	60	0	0	0	0	112.6	F127 G128 A249 V250 A266	S118-F127 VanDerWaalsContact CB-CE2 3.49Å; S118-F127 VanDerWaalsContact CB-CZ 3.5Å; S118-G128 CarbonylContact C-O 3.49Å; S118-G128 VanDerWaalsContact CA-O 3.25Å; S118-G128 WeakPolarHBondContact CA-O 3.46Å; S118-A249 CarbonylContact O-C 3.45Å; S118-A249 VanDerWaalsContact O-CA 3.24Å; S118-A249 WeakPolarHBondContact O-CA 3.47Å; S118-A249 WeakPolarHBondContact O-CB 3.27Å; S118-V250 PolarHBondContact N-O 3.44Å; S118-V250 PolarHBondContact O-N 3.05Å; S118-V250 WeakPolarHBondContact OG-CG1 3.37Å; S118-A266 WeakPolarHBondContact CB-O 3.41Å; S118-A266 PolarHBondContact N-O 2.79Å; S118-A266 PolarHBondContact OG-O 3.3Å
119	I	98.9	Very high	98.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	144.9	179.3	-178.6	169.9	0	0	0	110	T83 V86 T87 F127 G128 A143 N144 L147 A248 A249	T83-I119 HydrophobicContact CG2-CD1 4.36Å; V86-I119 HydrophobicContact CG1-CD1 3.6Å; V86-I119 HydrophobicContact CG1-CG1 4.12Å; T87-I119 WeakPolarHBondContact OG1-CD1 3.47Å; I119-F127 WeakPolarHBondContact O-CA 3.21Å; I119-F127 VanDerWaalsContact O-CD2 3.28Å; I119-F127 WeakPolarHBondContact O-CD2 3.45Å; I119-G128 PolarHBondContact N-O 2.82Å; I119-G128 PolarHBondContact O-N 2.98Å; I119-A143 VanDerWaalsContact CG2-C 3.47Å; I119-A143 HydrophobicContact CG2-CB 3.92Å; I119-N144 HydrophobicContact CD1-CB 4.21Å; I119-N144 HydrophobicContact CG2-CB 4.37Å; I119-L147 HydrophobicContact CG1-CD1 4.21Å; I119-L147 HydrophobicContact CG2-CB 4.29Å; I119-L147 HydrophobicContact CG2-CD1 3.99Å; I119-A248 CarbonylContact C-O 3.54Å; I119-A248 WeakPolarHBondContact CA-O 3.22Å; I119-A248 WeakPolarHBondContact CG1-O 3.47Å; I119-A249 HydrophobicContact CB-CB 3.92Å; I119-A249 HydrophobicContact CD1-CB 4.33Å; I119-A249 HydrophobicContact CG1-CB 3.97Å
120	M	98.9	Very high	98.5	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	139.2	177.2	-163.6	168.1	178.2	0	0	110.9	N126 F127 A247 A248 Y269 W274 A275	M120-N126 WeakPolarHBondContact CA-O 3.33Å; M120-F127 HydrophobicContact CB-CD2 4.23Å; M120-A247 WeakPolarHBondContact O-CA 3.44Å; M120-A248 PolarHBondContact N-O 2.82Å; M120-A248 PolarHBondContact O-N 3.37Å; M120-A248 VanDerWaalsContact O-N 3.14Å; M120-Y269 HydrophobicContact CE-CE2 3.83Å; M120-Y269 WeakPolarHBondContact CE-OH 3.01Å; M120-Y269 HydrophobicContact SD-CE2 3.93Å; M120-W274 HydrophobicContact CE-CD2 4.11Å; M120-W274 HydrophobicContact CE-CE3 4.07Å; M120-W274 HydrophobicContact CE-CH2 4.07Å; M120-W274 HydrophobicContact CE-CZ2 4.05Å; M120-W274 HydrophobicContact CE-CZ3 4.07Å; M120-W274 HydrophobicContact SD-CD2 3.83Å; M120-W274 HydrophobicContact SD-CE3 3.66Å; M120-W274 HydrophobicContact SD-CG 4.26Å; M120-W274 HydrophobicContact SD-CZ3 4.15Å; M120-A275 HydrophobicContact CB-CB 4.05Å; M120-A275 WeakPolarHBondContact CE-O 3.39Å; M120-A275 HydrophobicContact CG-CB 4.22Å; M120-A275 WeakPolarHBondContact O-CB 3.45Å; M120-A275 PolarHBondContact SD-N 3.05Å
121	D	98.9	Very high	98.6	Very high	14 Å²	14	24.5 Å²	24.5	8%	0.075	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	120.4	175	173.4	35.6	0	0	0	110.4	T83 K123 S124 L125 N126 L147 Q151	T83-D121 HydrophobicContact CG2-CB 3.62Å; D121-K123 VanDerWaalsContact C-N 3.28Å; D121-K123 PolarHBondContact O-N 3.45Å; D121-K123 PolarHBondContact OD1-N 3.1Å; D121-S124 WeakPolarHBondContact OD2-CB 3.5Å; D121-S124 PolarHBondContact OD2-N 3.07Å; D121-S124 PolarHBondContact OD2-OG 3.37Å; D121-L125 WeakPolarHBondContact O-CA 3.16Å; D121-L125 PolarHBondContact O-N 2.89Å; D121-N126 PolarHBondContact N-O 2.92Å; D121-L147 HydrophobicContact CB-CD1 4.08Å; D121-L147 HydrophobicContact CB-CD2 4.37Å; D121-Q151 PolarHBondContact OD2-NE2 3.48Å
122	G	98.8	Very high	98.7	Very high	2 Å²	2	23.8 Å²	23.8	2%	0.021	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-23.9	179.4	0	0	0	0	0	113.8	L125 V246 A275 N277	G122-L125 WeakPolarHBondContact O-CD2 3.38Å; G122-V246 WeakPolarHBondContact CA-O 3.28Å; G122-V246 PolarHBondContact N-O 2.87Å; G122-A275 WeakPolarHBondContact CA-O 3.36Å; G122-N277 VanDerWaalsContact C-CG 3.42Å; G122-N277 VanDerWaalsContact C-OD1 3.31Å; G122-N277 VanDerWaalsContact O-CB 3.23Å; G122-N277 WeakPolarHBondContact O-CB 3.42Å; G122-N277 PolarHBondContact O-N 3.16Å
123	K	98.6	Very high	98.7	Very high	125 Å²	125	18.8 Å²	18.8	54%	0.543	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-48.5	-178.3	-172.1	177.5	-168.6	161.7	0	112.4	D121 E243 N245 N277	D121-K123 VanDerWaalsContact C-N 3.28Å; D121-K123 PolarHBondContact O-N 3.45Å; D121-K123 PolarHBondContact OD1-N 3.1Å; K123-E243 IonicContact NZ-OE2 3.8Å; K123-E243 PolarHBondContact NZ-OE2 3.32Å; K123-N245 HydrophobicContact CB-CB 4.43Å; K123-N245 WeakPolarHBondContact CD-OD1 3.43Å; K123-N277 WeakPolarHBondContact CA-ND2 3.38Å
124	S	98.4	Very high	98.7	Very high	48 Å²	48	20.7 Å²	20.7	34%	0.336	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-11.6	-179.5	67	0	0	0	0	114.2	D121 N126 Q151	D121-S124 WeakPolarHBondContact OD2-CB 3.5Å; D121-S124 PolarHBondContact OD2-N 3.07Å; D121-S124 PolarHBondContact OD2-OG 3.37Å; S124-N126 PolarHBondContact O-N 3.21Å; S124-N126 VanDerWaalsContact O-N 3.16Å; S124-N126 PolarHBondContact OG-N 3.03Å; S124-Q151 PolarHBondContact OG-NE2 2.91Å
125	L	98.6	Very high	98.7	Very high	88 Å²	88	20.7 Å²	20.7	46%	0.461	12%	0.118	S	C	.	.			trans	61.1	11.8	-171.6	-49.3	-179.8	0	0	0	114.1	D121 G122 E276	D121-L125 WeakPolarHBondContact O-CA 3.16Å; D121-L125 PolarHBondContact O-N 2.89Å; G122-L125 WeakPolarHBondContact O-CD2 3.38Å; L125-E276 HydrophobicContact CD2-CB 4.3Å; L125-E276 HydrophobicContact CD2-CG 3.79Å
126	N	98.6	Very high	98.7	Very high	55 Å²	55	20.8 Å²	20.8	29%	0.294	12%	0.118	S	C	.	.			trans	-72.7	154	175.4	-90.5	-59.3	0	0	0	111.8	M120 D121 S124 L147 Q151	M120-N126 WeakPolarHBondContact CA-O 3.33Å; D121-N126 PolarHBondContact N-O 2.92Å; S124-N126 PolarHBondContact O-N 3.21Å; S124-N126 VanDerWaalsContact O-N 3.16Å; S124-N126 PolarHBondContact OG-N 3.03Å; N126-L147 HydrophobicContact CB-CG 4.13Å; N126-L147 WeakPolarHBondContact O-CD1 3.31Å; N126-Q151 HydrophobicContact CB-CG 4.17Å; N126-Q151 WeakPolarHBondContact ND2-CG 3.33Å
127	F	98.9	Very high	98.6	Very high	16 Å²	16	23.8 Å²	23.8	7%	0.07	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	145.1	-177	176	-101.2	0	0	0	110.1	S118 I119 M120 A129 C163 Y269	S118-F127 VanDerWaalsContact CB-CE2 3.49Å; S118-F127 VanDerWaalsContact CB-CZ 3.5Å; I119-F127 WeakPolarHBondContact O-CA 3.21Å; I119-F127 VanDerWaalsContact O-CD2 3.28Å; I119-F127 WeakPolarHBondContact O-CD2 3.45Å; M120-F127 HydrophobicContact CB-CD2 4.23Å; F127-A129 HydrophobicContact CD1-CB 4.36Å; F127-A129 HydrophobicContact CE1-CB 3.39Å; F127-A129 HydrophobicContact CZ-CB 3.51Å; F127-C163 HydrophobicContact CD1-CB 4.45Å; F127-C163 WeakPolarHBondContact O-CB 3.49Å; F127-Y269 HydrophobicContact CB-CD2 3.96Å; F127-Y269 HydrophobicContact CB-CE2 3.94Å; F127-Y269 AromaticContact CD1-CD2 3.86Å; F127-Y269 HydrophobicContact CD1-CD2 3.86Å; F127-Y269 AromaticContact CD2-CD2 3.62Å; F127-Y269 HydrophobicContact CD2-CD2 3.62Å; F127-Y269 HydrophobicContact CD2-CE2 4.16Å; F127-Y269 HydrophobicContact CE1-CD2 4.16Å; F127-Y269 AromaticContact CE2-CD2 3.94Å; F127-Y269 HydrophobicContact CE2-CD2 3.94Å; F127-Y269 AromaticContact CG-CD2 3.55Å; F127-Y269 HydrophobicContact CG-CD2 3.55Å; F127-Y269 HydrophobicContact CG-CE2 4.03Å; F127-Y269 HydrophobicContact CZ-CD2 4.19Å
128	G	98.9	Very high	98.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	139.5	170.9	0	0	0	0	0	110.4	S118 I119 A143 C163	S118-G128 CarbonylContact C-O 3.49Å; S118-G128 VanDerWaalsContact CA-O 3.25Å; S118-G128 WeakPolarHBondContact CA-O 3.46Å; I119-G128 PolarHBondContact N-O 2.82Å; I119-G128 PolarHBondContact O-N 2.98Å; G128-A143 WeakPolarHBondContact CA-O 3.34Å; G128-C163 CarbonylContact C-O 3.56Å; G128-C163 WeakPolarHBondContact CA-O 3.48Å
129	A	98.9	Very high	98.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	155.8	-179.2	0	0	0	0	0	113.9	A117 F127 L146 C163 F164 L165 A267	A117-A129 CarbonylContact O-C 3.53Å; A117-A129 VanDerWaalsContact O-CA 3.24Å; A117-A129 WeakPolarHBondContact O-CA 3.3Å; F127-A129 HydrophobicContact CD1-CB 4.36Å; F127-A129 HydrophobicContact CE1-CB 3.39Å; F127-A129 HydrophobicContact CZ-CB 3.51Å; A129-L146 WeakPolarHBondContact O-CD1 3.44Å; A129-C163 PolarHBondContact N-O 2.95Å; A129-F164 HydrophobicContact CB-CB 4.47Å; A129-F164 HydrophobicContact CB-CD2 3.7Å; A129-F164 HydrophobicContact CB-CE2 4.37Å; A129-F164 HydrophobicContact CB-CG 4.38Å; A129-F164 WeakPolarHBondContact O-CA 3.34Å; A129-L165 PolarHBondContact O-N 3Å; A129-A267 WeakPolarHBondContact CB-O 3.36Å
130	V	98.9	Very high	98.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	145.7	170	-66.6	0	0	0	0	110.7	D116 A117 L133 P139 V142 L146 L165 A170 A267	D116-V130 WeakPolarHBondContact CA-O 3.35Å; A117-V130 HydrophobicContact CB-CG2 4.12Å; A117-V130 PolarHBondContact N-O 2.97Å; A117-V130 PolarHBondContact O-N 3.06Å; V130-L133 HydrophobicContact CB-CB 4.26Å; V130-L133 HydrophobicContact CB-CD2 4.06Å; V130-L133 HydrophobicContact CG1-CD2 4.3Å; V130-L133 HydrophobicContact CG2-CB 4.29Å; V130-L133 HydrophobicContact CG2-CD2 3.75Å; V130-P139 HydrophobicContact CG2-CB 4.13Å; V130-V142 HydrophobicContact CG1-CB 3.81Å; V130-V142 HydrophobicContact CG1-CG1 3.52Å; V130-L146 HydrophobicContact CG1-CD1 3.9Å; V130-L165 VanDerWaalsContact CA-O 3.23Å; V130-L165 WeakPolarHBondContact CA-O 3.31Å; V130-A170 HydrophobicContact CG1-CB 4.24Å; V130-A267 WeakPolarHBondContact O-CB 3.23Å
131	G	98.8	Very high	98.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	147	178.6	0	0	0	0	0	111.9	D116 L133 L165 V166 G167	D116-G131 VanDerWaalsContact OD1-CA 3.25Å; D116-G131 WeakPolarHBondContact OD1-CA 3.48Å; G131-L133 PolarHBondContact O-N 2.9Å; G131-L133 VanDerWaalsContact O-N 3.08Å; G131-L165 PolarHBondContact N-O 3.23Å; G131-L165 VanDerWaalsContact N-O 3.08Å; G131-V166 CarbonylContact O-C 3.54Å; G131-V166 WeakPolarHBondContact O-CA 3.12Å; G131-V166 VanDerWaalsContact O-CB 3.28Å; G131-V166 WeakPolarHBondContact O-CB 3.49Å; G131-G167 PolarHBondContact O-N 3.01Å
132	A	98.6	Very high	98.6	Very high	6 Å²	6	25.7 Å²	25.7	5%	0.05	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	48.1	35.8	-174.2	0	0	0	0	0	113.1	C115 D116 G167 V263	C115-A132 PolarHBondContact O-N 3.02Å; D116-A132 PolarHBondContact OD1-N 3.14Å; A132-G167 WeakPolarHBondContact O-CA 3.2Å; A132-V263 HydrophobicContact CB-CG2 4.17Å
133	L	98.8	Very high	98.6	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.01	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	124	-177.3	176	64.7	0	0	0	110	C115 V130 G131 I136 P139 V142 A170	C115-L133 PolarHBondContact N-O 2.98Å; C115-L133 PolarHBondContact O-N 3.29Å; V130-L133 HydrophobicContact CB-CB 4.26Å; V130-L133 HydrophobicContact CB-CD2 4.06Å; V130-L133 HydrophobicContact CG1-CD2 4.3Å; V130-L133 HydrophobicContact CG2-CB 4.29Å; V130-L133 HydrophobicContact CG2-CD2 3.75Å; G131-L133 PolarHBondContact O-N 2.9Å; G131-L133 VanDerWaalsContact O-N 3.08Å; L133-I136 HydrophobicContact CD1-CG1 3.93Å; L133-I136 HydrophobicContact CD2-CB 3.99Å; L133-I136 HydrophobicContact CD2-CG1 4.05Å; L133-I136 HydrophobicContact CD2-CG2 4.46Å; L133-I136 HydrophobicContact CG-CB 4.3Å; L133-I136 HydrophobicContact CG-CG1 4.19Å; L133-P139 HydrophobicContact CD2-CB 4.31Å; L133-V142 HydrophobicContact CD2-CB 4.36Å; L133-V142 HydrophobicContact CD2-CG2 3.89Å; L133-A170 HydrophobicContact CD1-CB 3.91Å
134	S	98.2	Very high	98.6	Very high	53 Å²	53	20.5 Å²	20.5	37%	0.371	12%	0.122	S	C	.	.			trans	-114.6	166	172	66	0	0	0	0	110.7	I113 I136 Y171	I113-S134 WeakPolarHBondContact O-CB 3.42Å; S134-I136 VanDerWaalsContact C-N 3.26Å; S134-I136 PolarHBondContact O-N 3.22Å; S134-Y171 WeakPolarHBondContact O-CD2 3.4Å
135	G	97.5	Very high	98.6	Very high	22 Å²	22	22 Å²	22	23%	0.227	12%	0.12	C	C	.	.	S	Bend	trans	71.9	8.9	172.3	0	0	0	0	0	116.2	S181 C182	G135-S181 CarbonylContact O-C 3.44Å; G135-S181 VanDerWaalsContact O-CA 3.29Å; G135-S181 WeakPolarHBondContact O-CA 3.29Å; G135-C182 PolarHBondContact O-N 3.42Å
136	I	98.5	Very high	98.7	Very high	3 Å²	3	17.9 Å²	17.9	2%	0.015	10%	0.099	C	C	.	.	B	Isolated β-bridge	trans	-120.8	133.2	174.4	-59.3	-62.3	0	0	0	109.4	L133 S134 V142 Y171 A174 I179 M187	L133-I136 HydrophobicContact CD1-CG1 3.93Å; L133-I136 HydrophobicContact CD2-CB 3.99Å; L133-I136 HydrophobicContact CD2-CG1 4.05Å; L133-I136 HydrophobicContact CD2-CG2 4.46Å; L133-I136 HydrophobicContact CG-CB 4.3Å; L133-I136 HydrophobicContact CG-CG1 4.19Å; S134-I136 VanDerWaalsContact C-N 3.26Å; S134-I136 PolarHBondContact O-N 3.22Å; I136-V142 HydrophobicContact CG1-CG2 4.43Å; I136-V142 HydrophobicContact CG2-CG2 3.8Å; I136-Y171 HydrophobicContact CD1-CD2 3.85Å; I136-Y171 HydrophobicContact CD1-CE2 4.05Å; I136-Y171 HydrophobicContact CG1-CD2 4.02Å; I136-A174 HydrophobicContact CD1-CB 3.79Å; I136-A174 HydrophobicContact CG1-CB 4.11Å; I136-I179 HydrophobicContact CG2-CG2 3.99Å; I136-M187 VanDerWaalsContact O-CE 3.25Å; I136-M187 WeakPolarHBondContact O-CE 3.42Å
137	K	97.8	Very high	98.7	Very high	64 Å²	64	15.2 Å²	15.2	28%	0.278	9%	0.085	S	C	.	.	S	Bend	trans	-64.2	-45.2	-177.6	-169.5	-175.7	173.1	-136.6	0	112.7	D95 P139 C182 M187	D95-K137 WeakPolarHBondContact OD1-CE 3.29Å; D95-K137 IonicContact OD1-NZ 2.85Å; D95-K137 PolarHBondContact OD1-NZ 3.45Å; D95-K137 IonicContact OD2-NZ 3.57Å; D95-K137 PolarHBondContact OD2-NZ 2.77Å; K137-P139 WeakPolarHBondContact O-CD 3.48Å; K137-C182 HydrophobicContact CB-CB 3.85Å; K137-M187 HydrophobicContact CB-SD 4.44Å; K137-M187 HydrophobicContact CG-SD 4.46Å
138	N	98.6	Very high	98.6	Very high	22 Å²	22	16.1 Å²	16.1	12%	0.118	9%	0.092	C	C	.	.			trans	-123.8	86.5	-172.2	-61.7	108.8	0	0	0	111.2	V91 E94 D95 V140 S141	V91-N138 HydrophobicContact CG2-CB 4.26Å; E94-N138 WeakPolarHBondContact OE2-CA 3.05Å; E94-N138 VanDerWaalsContact OE2-CB 3.22Å; E94-N138 WeakPolarHBondContact OE2-CB 3.07Å; E94-N138 PolarHBondContact OE2-ND2 3.28Å; D95-N138 PolarHBondContact OD1-ND2 3.44Å; N138-V140 PolarHBondContact O-N 2.97Å; N138-S141 VanDerWaalsContact O-CB 3.32Å; N138-S141 WeakPolarHBondContact O-CB 3.4Å; N138-S141 PolarHBondContact O-N 3.2Å
139	P	98.8	Very high	98.6	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-49.4	-39.6	177.3	-29.4	34.5	0	0	0	114.1	E94 C115 A117 V130 L133 K137 S141 V142 A143	E94-P139 WeakPolarHBondContact OE1-CD 3.29Å; C115-P139 HydrophobicContact CB-CB 4.02Å; C115-P139 HydrophobicContact CB-CG 3.32Å; A117-P139 HydrophobicContact CB-CB 3.65Å; V130-P139 HydrophobicContact CG2-CB 4.13Å; L133-P139 HydrophobicContact CD2-CB 4.31Å; K137-P139 WeakPolarHBondContact O-CD 3.48Å; P139-S141 PolarHBondContact O-N 2.96Å; P139-V142 PolarHBondContact O-N 3.11Å; P139-V142 VanDerWaalsContact O-N 3.07Å; P139-A143 PolarHBondContact O-N 3.05Å
140	V	98.9	Very high	98.5	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-58.7	-30.5	177.1	74.7	0	0	0	0	113	T87 L90 V91 E94 N138 V142 A143 N144 A249	T87-V140 HydrophobicContact CG2-CG1 4.19Å; T87-V140 HydrophobicContact CG2-CG2 4.5Å; L90-V140 HydrophobicContact CB-CB 3.94Å; L90-V140 HydrophobicContact CB-CG1 3.75Å; L90-V140 HydrophobicContact CB-CG2 3.71Å; L90-V140 HydrophobicContact CG-CB 4.49Å; L90-V140 HydrophobicContact CG-CG2 3.99Å; V91-V140 HydrophobicContact CG2-CG1 3.81Å; E94-V140 PolarHBondContact OE1-N 3.42Å; E94-V140 WeakPolarHBondContact OE2-CG1 3.41Å; N138-V140 PolarHBondContact O-N 2.97Å; V140-V142 VanDerWaalsContact C-N 3.31Å; V140-V142 PolarHBondContact O-N 2.93Å; V140-A143 PolarHBondContact O-N 3.24Å; V140-N144 WeakPolarHBondContact O-CB 3.43Å; V140-N144 PolarHBondContact O-N 3.46Å; V140-A249 HydrophobicContact CG2-CB 4.18Å
141	S	98.9	Very high	98.3	Very high	34 Å²	34	22 Å²	22	24%	0.238	13%	0.125	C	C	.	.	H	α-helix	trans	-69.1	-33.1	179.6	-62.7	0	0	0	0	111.4	N138 P139 R145	N138-S141 VanDerWaalsContact O-CB 3.32Å; N138-S141 WeakPolarHBondContact O-CB 3.4Å; N138-S141 PolarHBondContact O-N 3.2Å; P139-S141 PolarHBondContact O-N 2.96Å; S141-R145 WeakPolarHBondContact O-CB 3.25Å; S141-R145 PolarHBondContact O-N 3.07Å
142	V	98.9	Very high	98.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-70.9	-44.2	174	-168.1	0	0	0	0	110.2	V130 L133 I136 P139 V140 N144 R145 L146 W173 A174 I179	V130-V142 HydrophobicContact CG1-CB 3.81Å; V130-V142 HydrophobicContact CG1-CG1 3.52Å; L133-V142 HydrophobicContact CD2-CB 4.36Å; L133-V142 HydrophobicContact CD2-CG2 3.89Å; I136-V142 HydrophobicContact CG1-CG2 4.43Å; I136-V142 HydrophobicContact CG2-CG2 3.8Å; P139-V142 PolarHBondContact O-N 3.11Å; P139-V142 VanDerWaalsContact O-N 3.07Å; V140-V142 VanDerWaalsContact C-N 3.31Å; V140-V142 PolarHBondContact O-N 2.93Å; V142-N144 PolarHBondContact O-N 2.78Å; V142-R145 PolarHBondContact O-N 2.81Å; V142-L146 HydrophobicContact CG1-CD1 4.48Å; V142-L146 WeakPolarHBondContact O-CG 3.46Å; V142-L146 PolarHBondContact O-N 3.42Å; V142-W173 HydrophobicContact CG1-CE3 3.94Å; V142-W173 HydrophobicContact CG1-CZ3 4Å; V142-A174 HydrophobicContact CB-CB 4.45Å; V142-A174 HydrophobicContact CG1-CB 3.87Å; V142-A174 HydrophobicContact CG2-CB 3.68Å; V142-I179 HydrophobicContact CB-CD1 4.15Å; V142-I179 HydrophobicContact CG1-CD1 4.4Å; V142-I179 HydrophobicContact CG2-CD1 3.84Å; V142-I179 HydrophobicContact CG2-CG2 4.24Å
143	A	98.9	Very high	97.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59	-46.4	175.3	0	0	0	0	0	112	I119 G128 P139 V140 R145 L146 L147	I119-A143 VanDerWaalsContact CG2-C 3.47Å; I119-A143 HydrophobicContact CG2-CB 3.92Å; G128-A143 WeakPolarHBondContact CA-O 3.34Å; P139-A143 PolarHBondContact O-N 3.05Å; V140-A143 PolarHBondContact O-N 3.24Å; A143-R145 VanDerWaalsContact C-N 3.34Å; A143-R145 PolarHBondContact O-N 2.81Å; A143-L146 PolarHBondContact O-N 2.91Å; A143-L147 PolarHBondContact O-N 3.2Å
144	N	98.9	Very high	97.1	Very high	18 Å²	18	37.8 Å²	37.8	10%	0.096	20%	0.202	C	C	.	.	H	α-helix	trans	-62.8	-40.9	175.8	-173.2	52	0	0	0	111.6	T87 I119 V140 V142 L146 L147 C148	T87-N144 HydrophobicContact CG2-CB 4.05Å; T87-N144 WeakPolarHBondContact OG1-CB 3.38Å; T87-N144 VanDerWaalsContact OG1-CG 3.25Å; T87-N144 PolarHBondContact OG1-OD1 2.97Å; I119-N144 HydrophobicContact CD1-CB 4.21Å; I119-N144 HydrophobicContact CG2-CB 4.37Å; V140-N144 WeakPolarHBondContact O-CB 3.43Å; V140-N144 PolarHBondContact O-N 3.46Å; V142-N144 PolarHBondContact O-N 2.78Å; N144-L146 PolarHBondContact O-N 2.97Å; N144-L147 WeakPolarHBondContact O-CB 3.41Å; N144-L147 PolarHBondContact O-N 3.33Å; N144-C148 PolarHBondContact O-N 3.18Å; N144-C148 PolarHBondContact O-SG 3.08Å
145	R	98.8	Very high	96.5	Very high	79 Å²	79	38.8 Å²	38.8	30%	0.298	20%	0.203	S	C	.	.	H	α-helix	trans	-65.1	-39.9	177.3	-172.2	56.3	-178.8	-75	-6.8	111.9	S141 V142 A143 L147 C148 E149 W173 H177 I179	S141-R145 WeakPolarHBondContact O-CB 3.25Å; S141-R145 PolarHBondContact O-N 3.07Å; V142-R145 PolarHBondContact O-N 2.81Å; A143-R145 VanDerWaalsContact C-N 3.34Å; A143-R145 PolarHBondContact O-N 2.81Å; R145-L147 VanDerWaalsContact C-N 3.34Å; R145-C148 PolarHBondContact O-N 2.94Å; R145-E149 IonicContact CZ-OE1 2.73Å; R145-E149 IonicContact NE-OE1 2.74Å; R145-E149 PolarHBondContact NE-OE1 3.16Å; R145-E149 IonicContact NH2-OE1 3.45Å; R145-E149 PolarHBondContact NH2-OE1 3.05Å; R145-E149 VanDerWaalsContact NH2-OE1 3.15Å; R145-E149 WeakPolarHBondContact O-CG 3.47Å; R145-E149 PolarHBondContact O-N 3.17Å; R145-W173 HydrophobicContact CB-CH2 4.04Å; R145-W173 HydrophobicContact CB-CZ3 4.02Å; R145-W173 HydrophobicContact CG-CH2 3.64Å; R145-W173 HydrophobicContact CG-CZ3 3.88Å; R145-H177 HydrophobicContact CG-CB 4.31Å; R145-H177 PolarHBondContact NH1-O 3.04Å; R145-H177 PolarHBondContact NH2-CD2 3.13Å; R145-I179 HydrophobicContact CB-CD1 3.98Å; R145-I179 HydrophobicContact CG-CD1 4.35Å
146	L	98.8	Very high	95.8	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-45.1	173.7	-76.4	165.7	0	0	0	111.4	A129 V130 V142 A143 N144 C148 E149 G150 P162 L165 W173	A129-L146 WeakPolarHBondContact O-CD1 3.44Å; V130-L146 HydrophobicContact CG1-CD1 3.9Å; V142-L146 HydrophobicContact CG1-CD1 4.48Å; V142-L146 WeakPolarHBondContact O-CG 3.46Å; V142-L146 PolarHBondContact O-N 3.42Å; A143-L146 PolarHBondContact O-N 2.91Å; N144-L146 PolarHBondContact O-N 2.97Å; L146-C148 PolarHBondContact O-N 2.86Å; L146-E149 PolarHBondContact O-N 2.76Å; L146-G150 PolarHBondContact O-N 3.42Å; L146-P162 WeakPolarHBondContact CD2-O 3.32Å; L146-L165 HydrophobicContact CD1-CD1 4.46Å; L146-L165 HydrophobicContact CD1-CG 4.42Å; L146-L165 HydrophobicContact CD2-CD1 3.79Å; L146-L165 HydrophobicContact CD2-CG 4.19Å; L146-W173 HydrophobicContact CB-CH2 4.29Å; L146-W173 HydrophobicContact CD2-CD2 4Å; L146-W173 HydrophobicContact CD2-CE3 4.06Å; L146-W173 HydrophobicContact CD2-CH2 3.53Å; L146-W173 HydrophobicContact CD2-CZ2 3.47Å; L146-W173 VanDerWaalsContact CD2-CZ2 3.47Å; L146-W173 HydrophobicContact CD2-CZ3 3.85Å; L146-W173 HydrophobicContact CG-CE3 4.22Å; L146-W173 HydrophobicContact CG-CH2 3.66Å; L146-W173 HydrophobicContact CG-CZ2 4.15Å; L146-W173 HydrophobicContact CG-CZ3 3.72Å
147	L	98.6	Very high	95.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-57.8	-48.8	174.7	-176.7	157.6	0	0	0	111.2	T83 I119 D121 N126 A143 N144 R145 E149 G150 Q151	T83-L147 HydrophobicContact CG2-CD1 4.27Å; T83-L147 HydrophobicContact CG2-CD2 4.21Å; I119-L147 HydrophobicContact CG1-CD1 4.21Å; I119-L147 HydrophobicContact CG2-CB 4.29Å; I119-L147 HydrophobicContact CG2-CD1 3.99Å; D121-L147 HydrophobicContact CB-CD1 4.08Å; D121-L147 HydrophobicContact CB-CD2 4.37Å; N126-L147 HydrophobicContact CB-CG 4.13Å; N126-L147 WeakPolarHBondContact O-CD1 3.31Å; A143-L147 PolarHBondContact O-N 3.2Å; N144-L147 WeakPolarHBondContact O-CB 3.41Å; N144-L147 PolarHBondContact O-N 3.33Å; R145-L147 VanDerWaalsContact C-N 3.34Å; L147-E149 PolarHBondContact O-N 3.03Å; L147-G150 PolarHBondContact O-N 2.94Å; L147-Q151 HydrophobicContact CD2-CG 4.3Å; L147-Q151 PolarHBondContact O-N 3.36Å
148	C	98.3	Very high	95	Very high	34 Å²	34	46 Å²	46	23%	0.23	27%	0.271	C	S	.	.	H	α-helix	trans	-62.7	-41.9	179	-65.7	0	0	0	0	112.8	N144 R145 L146 G150 Q151 K152	N144-C148 PolarHBondContact O-N 3.18Å; N144-C148 PolarHBondContact O-SG 3.08Å; R145-C148 PolarHBondContact O-N 2.94Å; L146-C148 PolarHBondContact O-N 2.86Å; C148-G150 VanDerWaalsContact C-N 3.32Å; C148-Q151 PolarHBondContact O-N 2.74Å; C148-K152 PolarHBondContact O-N 3.29Å
149	E	97.7	Very high	94.8	Very high	29 Å²	29	52.5 Å²	52.5	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-66.1	-35.9	175.2	-64.8	-56.6	146.9	0	0	111.3	R145 L146 L147 Q151 K152 W173	R145-E149 IonicContact CZ-OE1 2.73Å; R145-E149 IonicContact NE-OE1 2.74Å; R145-E149 PolarHBondContact NE-OE1 3.16Å; R145-E149 IonicContact NH2-OE1 3.45Å; R145-E149 PolarHBondContact NH2-OE1 3.05Å; R145-E149 VanDerWaalsContact NH2-OE1 3.15Å; R145-E149 WeakPolarHBondContact O-CG 3.47Å; R145-E149 PolarHBondContact O-N 3.17Å; L146-E149 PolarHBondContact O-N 2.76Å; L147-E149 PolarHBondContact O-N 3.03Å; E149-Q151 VanDerWaalsContact C-N 3.31Å; E149-Q151 PolarHBondContact O-N 2.91Å; E149-K152 PolarHBondContact O-N 3.42Å; E149-K152 IonicContact OE1-NZ 3.45Å; E149-K152 PolarHBondContact OE1-NZ 3.2Å; E149-K152 WeakPolarHBondContact OE2-CD 3.41Å; E149-K152 WeakPolarHBondContact OE2-CE 3.46Å; E149-K152 IonicContact OE2-NZ 2.71Å; E149-K152 PolarHBondContact OE2-NZ 3.29Å; E149-W173 HydrophobicContact CB-CZ2 4.37Å; E149-W173 HydrophobicContact CG-CH2 4.07Å; E149-W173 HydrophobicContact CG-CZ2 3.87Å
150	G	96.8	Very high	94.6	Very high	19 Å²	19	59.5 Å²	59.5	20%	0.196	33%	0.329	C	S	.	.	H	α-helix	trans	-57.8	-40.5	171.7	0	0	0	0	0	113.3	L146 L147 C148 K152 G153	L146-G150 PolarHBondContact O-N 3.42Å; L147-G150 PolarHBondContact O-N 2.94Å; C148-G150 VanDerWaalsContact C-N 3.32Å; G150-K152 VanDerWaalsContact C-N 3.29Å; G150-K152 PolarHBondContact O-N 3.05Å; G150-G153 PolarHBondContact O-N 3.25Å
151	Q	95.1	Very high	94.5	Very high	75 Å²	75	60.2 Å²	60.2	35%	0.35	33%	0.334	S	S	.	.	H	α-helix	trans	-69.3	-21.2	178.4	-73.2	179.7	-23.9	0	0	114.1	D121 S124 N126 L147 C148 E149 G153	D121-Q151 PolarHBondContact OD2-NE2 3.48Å; S124-Q151 PolarHBondContact OG-NE2 2.91Å; N126-Q151 HydrophobicContact CB-CG 4.17Å; N126-Q151 WeakPolarHBondContact ND2-CG 3.33Å; L147-Q151 HydrophobicContact CD2-CG 4.3Å; L147-Q151 PolarHBondContact O-N 3.36Å; C148-Q151 PolarHBondContact O-N 2.74Å; E149-Q151 VanDerWaalsContact C-N 3.31Å; E149-Q151 PolarHBondContact O-N 2.91Å; Q151-G153 PolarHBondContact O-N 3.49Å
152	K	94.8	Very high	94.4	Very high	146 Å²	146	61.2 Å²	61.2	64%	0.635	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-10.7	176.2	-64.2	179.5	-167.2	169.3	0	113	C148 E149 G150	C148-K152 PolarHBondContact O-N 3.29Å; E149-K152 PolarHBondContact O-N 3.42Å; E149-K152 IonicContact OE1-NZ 3.45Å; E149-K152 PolarHBondContact OE1-NZ 3.2Å; E149-K152 WeakPolarHBondContact OE2-CD 3.41Å; E149-K152 WeakPolarHBondContact OE2-CE 3.46Å; E149-K152 IonicContact OE2-NZ 2.71Å; E149-K152 PolarHBondContact OE2-NZ 3.29Å; G150-K152 VanDerWaalsContact C-N 3.29Å; G150-K152 PolarHBondContact O-N 3.05Å
153	G	87.6	Confident	94.4	Very high	34 Å²	34	64.6 Å²	64.6	35%	0.351	36%	0.362	S	S	.	.			trans	96.1	-153.9	176.9	0	0	0	0	0	113.1	G150 Q151 P161	G150-G153 PolarHBondContact O-N 3.25Å; Q151-G153 PolarHBondContact O-N 3.49Å; G153-P161 VanDerWaalsContact O-CD 3.29Å; G153-P161 WeakPolarHBondContact O-CD 3.07Å; G153-P161 WeakPolarHBondContact O-CG 3.37Å
154	K	88.6	Confident	94.4	Very high	160 Å²	160	68.4 Å²	68.4	70%	0.696	38%	0.379	S	S	*	.			trans	-70.5	139.3	-172.6	-65.8	178.1	177.3	-176.1	0	111.7	G158 R159	K154-G158 WeakPolarHBondContact CD-O 3.2Å; K154-R159 CarbonylContact C-O 3.59Å; K154-R159 WeakPolarHBondContact CA-O 3.46Å
155	L	86.4	Confident	94.4	Very high	75 Å²	75	69.3 Å²	69.3	39%	0.393	38%	0.384	S	S	.	.			trans	-71.8	176.9	167.5	-57.2	179.3	0	0	0	111.3	A157 G158 R159 P161	L155-A157 PolarHBondContact O-N 2.87Å; L155-G158 PolarHBondContact O-N 3.2Å; L155-R159 HydrophobicContact CB-CB 4.31Å; L155-R159 PolarHBondContact N-O 3Å; L155-R159 PolarHBondContact O-N 3.31Å; L155-P161 HydrophobicContact CD1-CB 4.38Å; L155-P161 HydrophobicContact CD2-CB 4.4Å; L155-P161 HydrophobicContact CD2-CG 4.04Å; L155-P161 HydrophobicContact CG-CB 4.26Å; L155-P161 HydrophobicContact CG-CG 3.89Å
156	S	83	Confident	94.4	Very high	97 Å²	97	69.1 Å²	69.1	68%	0.678	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-49	139.6	171.5	-47.8	0	0	0	0	111.9	G158 R159	S156-G158 PolarHBondContact O-N 3.15Å; S156-R159 PolarHBondContact O-NE 3.21Å; S156-R159 VanDerWaalsContact O-NE 3.14Å
157	A	86.9	Confident	94.4	Very high	103 Å²	103	70 Å²	70	85%	0.851	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	63	23.3	-171.8	0	0	0	0	0	114.7	L155 R159	L155-A157 PolarHBondContact O-N 2.87Å; A157-R159 VanDerWaalsContact C-N 3.26Å; A157-R159 PolarHBondContact O-N 3.18Å
158	G	91.4	Very high	94.4	Very high	40 Å²	40	74.8 Å²	74.8	41%	0.412	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	74.5	14	173.7	0	0	0	0	0	114.6	K154 L155 S156	K154-G158 WeakPolarHBondContact CD-O 3.2Å; L155-G158 PolarHBondContact O-N 3.2Å; S156-G158 PolarHBondContact O-N 3.15Å
159	R	94.1	Very high	94.4	Very high	158 Å²	158	75.3 Å²	75.3	60%	0.596	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-72.6	142	-177.6	-63.1	-178	-66.5	169.3	3.3	111	K154 L155 S156 A157	K154-R159 CarbonylContact C-O 3.59Å; K154-R159 WeakPolarHBondContact CA-O 3.46Å; L155-R159 HydrophobicContact CB-CB 4.31Å; L155-R159 PolarHBondContact N-O 3Å; L155-R159 PolarHBondContact O-N 3.31Å; S156-R159 PolarHBondContact O-NE 3.21Å; S156-R159 VanDerWaalsContact O-NE 3.14Å; A157-R159 VanDerWaalsContact C-N 3.26Å; A157-R159 PolarHBondContact O-N 3.18Å
160	I	94.6	Very high	94.5	Very high	147 Å²	147	73.9 Å²	73.9	75%	0.754	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-74.8	131.5	174.2	-59.8	174	0	0	0	108.3
161	P	96.9	Very high	94.6	Very high	16 Å²	16	76.1 Å²	76.1	10%	0.104	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-58.2	148	174.4	-22.2	31.2	0	0	0	112.5	G153 L155 C163	G153-P161 VanDerWaalsContact O-CD 3.29Å; G153-P161 WeakPolarHBondContact O-CD 3.07Å; G153-P161 WeakPolarHBondContact O-CG 3.37Å; L155-P161 HydrophobicContact CD1-CB 4.38Å; L155-P161 HydrophobicContact CD2-CB 4.4Å; L155-P161 HydrophobicContact CD2-CG 4.04Å; L155-P161 HydrophobicContact CG-CB 4.26Å; L155-P161 HydrophobicContact CG-CG 3.89Å; P161-C163 PolarHBondContact O-N 3.22Å
162	P	98.1	Very high	94.7	Very high	55 Å²	55	79.8 Å²	79.8	36%	0.357	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-62.6	132.6	173.7	-19	31.2	0	0	0	111.5	L146 L165	L146-P162 WeakPolarHBondContact CD2-O 3.32Å; P162-L165 HydrophobicContact CB-CD2 3.79Å; P162-L165 HydrophobicContact CB-CG 4.11Å; P162-L165 HydrophobicContact CG-CD2 4.3Å
163	C	98.4	Very high	94.9	Very high	70 Å²	70	74.7 Å²	74.7	47%	0.473	42%	0.418	S	S	.	.	S	Bend	trans	-100.1	-12.1	170.8	62.1	0	0	0	0	113.1	F127 G128 A129 P161	F127-C163 HydrophobicContact CD1-CB 4.45Å; F127-C163 WeakPolarHBondContact O-CB 3.49Å; G128-C163 CarbonylContact C-O 3.56Å; G128-C163 WeakPolarHBondContact CA-O 3.48Å; A129-C163 PolarHBondContact N-O 2.95Å; P161-C163 PolarHBondContact O-N 3.22Å
164	F	98.9	Very high	95.4	Very high	81 Å²	81	73.1 Å²	73.1	36%	0.355	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	125.2	179.2	-179.9	-144.6	0	0	0	110.3	A129 V166 V263 A267	A129-F164 HydrophobicContact CB-CB 4.47Å; A129-F164 HydrophobicContact CB-CD2 3.7Å; A129-F164 HydrophobicContact CB-CE2 4.37Å; A129-F164 HydrophobicContact CB-CG 4.38Å; A129-F164 WeakPolarHBondContact O-CA 3.34Å; F164-V166 HydrophobicContact CD2-CG1 4.39Å; F164-V166 HydrophobicContact CE1-CG1 4.05Å; F164-V166 HydrophobicContact CE2-CG1 3.58Å; F164-V166 HydrophobicContact CZ-CG1 3.38Å; F164-V263 HydrophobicContact CZ-CG1 4.33Å; F164-A267 HydrophobicContact CE2-CB 3.76Å; F164-A267 HydrophobicContact CZ-CB 4.07Å
165	L	98.9	Very high	95.9	Very high	37 Å²	37	68.3 Å²	68.3	19%	0.194	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	152.3	175.5	-65.1	178.7	0	0	0	110.2	A129 V130 G131 L146 P162 A170 W173	A129-L165 PolarHBondContact O-N 3Å; V130-L165 VanDerWaalsContact CA-O 3.23Å; V130-L165 WeakPolarHBondContact CA-O 3.31Å; G131-L165 PolarHBondContact N-O 3.23Å; G131-L165 VanDerWaalsContact N-O 3.08Å; L146-L165 HydrophobicContact CD1-CD1 4.46Å; L146-L165 HydrophobicContact CD1-CG 4.42Å; L146-L165 HydrophobicContact CD2-CD1 3.79Å; L146-L165 HydrophobicContact CD2-CG 4.19Å; P162-L165 HydrophobicContact CB-CD2 3.79Å; P162-L165 HydrophobicContact CB-CG 4.11Å; P162-L165 HydrophobicContact CG-CD2 4.3Å; L165-A170 HydrophobicContact CB-CB 3.71Å; L165-W173 HydrophobicContact CD1-CB 3.66Å; L165-W173 HydrophobicContact CD1-CD2 3.9Å; L165-W173 HydrophobicContact CD1-CG 3.48Å; L165-W173 VanDerWaalsContact CD1-CG 3.48Å
166	V	98.9	Very high	96.5	Very high	75 Å²	75	71.1 Å²	71.1	46%	0.455	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	157.3	179.8	-60.3	0	0	0	0	113.4	G131 F164 G169 A170	G131-V166 CarbonylContact O-C 3.54Å; G131-V166 WeakPolarHBondContact O-CA 3.12Å; G131-V166 VanDerWaalsContact O-CB 3.28Å; G131-V166 WeakPolarHBondContact O-CB 3.49Å; F164-V166 HydrophobicContact CD2-CG1 4.39Å; F164-V166 HydrophobicContact CE1-CG1 4.05Å; F164-V166 HydrophobicContact CE2-CG1 3.58Å; F164-V166 HydrophobicContact CZ-CG1 3.38Å; V166-G169 PolarHBondContact O-N 3.49Å; V166-A170 PolarHBondContact O-N 3.33Å
167	G	98.5	Very high	97.2	Very high	19 Å²	19	68.9 Å²	68.9	20%	0.196	38%	0.379	C	S	.	.	H	α-helix	trans	53.7	-139.8	170.3	0	0	0	0	0	114.2	G131 A132 G169 A170 Y171	G131-G167 PolarHBondContact O-N 3.01Å; A132-G167 WeakPolarHBondContact O-CA 3.2Å; G167-G169 PolarHBondContact O-N 2.83Å; G167-A170 WeakPolarHBondContact O-CB 3.24Å; G167-A170 PolarHBondContact O-N 3.17Å; G167-A170 VanDerWaalsContact O-N 3.1Å; G167-Y171 PolarHBondContact O-N 2.9Å
168	E	98.6	Very high	97.7	Very high	101 Å²	101	67 Å²	67	47%	0.472	37%	0.37	S	S	.	.	H	α-helix	trans	-58.4	-34.4	-178.9	178	60.7	-168.2	0	0	113.1	Y171 R172	E168-Y171 PolarHBondContact O-N 3.45Å; E168-R172 HydrophobicContact CG-CG 4.46Å; E168-R172 WeakPolarHBondContact O-CG 3.36Å; E168-R172 PolarHBondContact O-N 3.46Å; E168-R172 WeakPolarHBondContact OE1-CG 3.36Å; E168-R172 IonicContact OE1-CZ 3.15Å; E168-R172 IonicContact OE1-NE 2.71Å; E168-R172 PolarHBondContact OE1-NE 3.28Å; E168-R172 IonicContact OE1-NH2 2.77Å; E168-R172 PolarHBondContact OE1-NH2 3.05Å
169	G	98.7	Very high	98.1	Very high	44 Å²	44	66.2 Å²	66.2	45%	0.454	36%	0.356	S	S	.	.	H	α-helix	trans	-64.1	-40.8	177	0	0	0	0	0	112.2	V166 G167 W173	V166-G169 PolarHBondContact O-N 3.49Å; G167-G169 PolarHBondContact O-N 2.83Å; G169-W173 VanDerWaalsContact O-CB 3.29Å; G169-W173 WeakPolarHBondContact O-CB 3.47Å; G169-W173 PolarHBondContact O-N 3.49Å; G169-W173 VanDerWaalsContact O-N 3.09Å
170	A	98.8	Very high	97.9	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-67.1	-41.5	174.1	0	0	0	0	0	112	V130 L133 L165 V166 G167 W173 A174	V130-A170 HydrophobicContact CG1-CB 4.24Å; L133-A170 HydrophobicContact CD1-CB 3.91Å; L165-A170 HydrophobicContact CB-CB 3.71Å; V166-A170 PolarHBondContact O-N 3.33Å; G167-A170 WeakPolarHBondContact O-CB 3.24Å; G167-A170 PolarHBondContact O-N 3.17Å; G167-A170 VanDerWaalsContact O-N 3.1Å; A170-W173 PolarHBondContact O-N 3.29Å; A170-A174 WeakPolarHBondContact O-CB 3.47Å; A170-A174 PolarHBondContact O-N 3.23Å
171	Y	98.8	Very high	98	Very high	65 Å²	65	59.7 Å²	59.7	26%	0.255	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-51.9	176.7	171.3	-101.1	0	0	0	111.8	S134 I136 G167 E168 W173 A174 V175	S134-Y171 WeakPolarHBondContact O-CD2 3.4Å; I136-Y171 HydrophobicContact CD1-CD2 3.85Å; I136-Y171 HydrophobicContact CD1-CE2 4.05Å; I136-Y171 HydrophobicContact CG1-CD2 4.02Å; G167-Y171 PolarHBondContact O-N 2.9Å; E168-Y171 PolarHBondContact O-N 3.45Å; Y171-W173 VanDerWaalsContact C-N 3.34Å; Y171-W173 PolarHBondContact O-N 2.93Å; Y171-A174 WeakPolarHBondContact O-CB 3.48Å; Y171-A174 PolarHBondContact O-N 2.94Å; Y171-A174 VanDerWaalsContact O-N 3.16Å; Y171-V175 HydrophobicContact CD2-CG2 4.43Å; Y171-V175 HydrophobicContact CE1-CG2 4.15Å; Y171-V175 HydrophobicContact CE2-CG2 3.94Å; Y171-V175 WeakPolarHBondContact O-CG2 3.35Å; Y171-V175 PolarHBondContact O-N 3.19Å
172	R	98.7	Very high	97.8	Very high	152 Å²	152	59.5 Å²	59.5	57%	0.574	34%	0.344	S	S	*	.	H	α-helix	trans	-59.1	-46.9	178.2	-72.2	-174.7	179.9	-136.5	-3.6	111.8	E168 A174 V175 D176	E168-R172 HydrophobicContact CG-CG 4.46Å; E168-R172 WeakPolarHBondContact O-CG 3.36Å; E168-R172 PolarHBondContact O-N 3.46Å; E168-R172 WeakPolarHBondContact OE1-CG 3.36Å; E168-R172 IonicContact OE1-CZ 3.15Å; E168-R172 IonicContact OE1-NE 2.71Å; E168-R172 PolarHBondContact OE1-NE 3.28Å; E168-R172 IonicContact OE1-NH2 2.77Å; E168-R172 PolarHBondContact OE1-NH2 3.05Å; R172-A174 VanDerWaalsContact C-N 3.27Å; R172-A174 PolarHBondContact O-N 3.07Å; R172-V175 PolarHBondContact O-N 2.93Å; R172-D176 WeakPolarHBondContact O-CB 3.23Å; R172-D176 PolarHBondContact O-N 3Å
173	W	98.8	Very high	97.6	Very high	40 Å²	40	59.8 Å²	59.8	15%	0.152	35%	0.346	C	S	.	.	H	α-helix	trans	-57.9	-42.8	177.6	-171.8	96.1	0	0	0	111.5	V142 R145 L146 E149 L165 G169 A170 Y171 D176 H177	V142-W173 HydrophobicContact CG1-CE3 3.94Å; V142-W173 HydrophobicContact CG1-CZ3 4Å; R145-W173 HydrophobicContact CB-CH2 4.04Å; R145-W173 HydrophobicContact CB-CZ3 4.02Å; R145-W173 HydrophobicContact CG-CH2 3.64Å; R145-W173 HydrophobicContact CG-CZ3 3.88Å; L146-W173 HydrophobicContact CB-CH2 4.29Å; L146-W173 HydrophobicContact CD2-CD2 4Å; L146-W173 HydrophobicContact CD2-CE3 4.06Å; L146-W173 HydrophobicContact CD2-CH2 3.53Å; L146-W173 HydrophobicContact CD2-CZ2 3.47Å; L146-W173 VanDerWaalsContact CD2-CZ2 3.47Å; L146-W173 HydrophobicContact CD2-CZ3 3.85Å; L146-W173 HydrophobicContact CG-CE3 4.22Å; L146-W173 HydrophobicContact CG-CH2 3.66Å; L146-W173 HydrophobicContact CG-CZ2 4.15Å; L146-W173 HydrophobicContact CG-CZ3 3.72Å; E149-W173 HydrophobicContact CB-CZ2 4.37Å; E149-W173 HydrophobicContact CG-CH2 4.07Å; E149-W173 HydrophobicContact CG-CZ2 3.87Å; L165-W173 HydrophobicContact CD1-CB 3.66Å; L165-W173 HydrophobicContact CD1-CD2 3.9Å; L165-W173 HydrophobicContact CD1-CG 3.48Å; L165-W173 VanDerWaalsContact CD1-CG 3.48Å; G169-W173 VanDerWaalsContact O-CB 3.29Å; G169-W173 WeakPolarHBondContact O-CB 3.47Å; G169-W173 PolarHBondContact O-N 3.49Å; G169-W173 VanDerWaalsContact O-N 3.09Å; A170-W173 PolarHBondContact O-N 3.29Å; Y171-W173 VanDerWaalsContact C-N 3.34Å; Y171-W173 PolarHBondContact O-N 2.93Å; W173-D176 PolarHBondContact O-N 3.19Å; W173-H177 AromaticContact CD1-CE1 3.66Å; W173-H177 AromaticContact CD2-CE1 3.71Å; W173-H177 AromaticContact CD2-ND1 3.56Å; W173-H177 AromaticContact CE2-CE1 3.2Å; W173-H177 AromaticContact CE2-ND1 3.52Å; W173-H177 AromaticContact CE2-NE2 3.54Å; W173-H177 AromaticContact CE3-ND1 3.97Å; W173-H177 AromaticContact CG-CE1 3.98Å; W173-H177 AromaticContact CG-ND1 3.93Å; W173-H177 AromaticContact CH2-CD2 3.89Å; W173-H177 AromaticContact CZ2-CD2 3.65Å; W173-H177 AromaticContact CZ2-CE1 3.6Å; W173-H177 AromaticContact CZ2-CG 3.97Å; W173-H177 AromaticContact CZ2-ND1 3.92Å; W173-H177 AromaticContact CZ2-NE2 3.42Å; W173-H177 WeakPolarHBondContact CZ2-NE2 3.43Å; W173-H177 HydrophobicContact CZ3-CB 4.4Å; W173-H177 AromaticContact NE1-CE1 3.18Å; W173-H177 PolarHBondContact NE1-CE1 3.16Å; W173-H177 AromaticContact NE1-ND1 3.83Å; W173-H177 AromaticContact NE1-NE2 3.72Å; W173-H177 WeakPolarHBondContact O-CB 3.35Å; W173-H177 PolarHBondContact O-N 2.59Å; W173-H177 VanDerWaalsContact O-N 3.08Å; W173-H177 PolarHBondContact O-ND1 3.33Å
174	A	98.7	Very high	97.2	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-60.6	-47.7	176.9	0	0	0	0	0	112.1	I136 V142 A170 Y171 R172 H177 G178 I179	I136-A174 HydrophobicContact CD1-CB 3.79Å; I136-A174 HydrophobicContact CG1-CB 4.11Å; V142-A174 HydrophobicContact CB-CB 4.45Å; V142-A174 HydrophobicContact CG1-CB 3.87Å; V142-A174 HydrophobicContact CG2-CB 3.68Å; A170-A174 WeakPolarHBondContact O-CB 3.47Å; A170-A174 PolarHBondContact O-N 3.23Å; Y171-A174 WeakPolarHBondContact O-CB 3.48Å; Y171-A174 PolarHBondContact O-N 2.94Å; Y171-A174 VanDerWaalsContact O-N 3.16Å; R172-A174 VanDerWaalsContact C-N 3.27Å; R172-A174 PolarHBondContact O-N 3.07Å; A174-H177 CarbonylContact O-C 3.56Å; A174-H177 PolarHBondContact O-N 2.89Å; A174-G178 PolarHBondContact O-N 2.85Å; A174-I179 HydrophobicContact CB-CB 4.14Å; A174-I179 HydrophobicContact CB-CD1 4.29Å; A174-I179 WeakPolarHBondContact O-CB 3.3Å; A174-I179 PolarHBondContact O-N 3.37Å
175	V	98.5	Very high	96.7	Very high	60 Å²	60	63.4 Å²	63.4	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-62.6	-44.6	178.1	174.3	0	0	0	0	111.3	Y171 R172 H177 G178	Y171-V175 HydrophobicContact CD2-CG2 4.43Å; Y171-V175 HydrophobicContact CE1-CG2 4.15Å; Y171-V175 HydrophobicContact CE2-CG2 3.94Å; Y171-V175 WeakPolarHBondContact O-CG2 3.35Å; Y171-V175 PolarHBondContact O-N 3.19Å; R172-V175 PolarHBondContact O-N 2.93Å; V175-H177 PolarHBondContact O-N 3.44Å; V175-G178 PolarHBondContact O-N 3.37Å
176	D	98.4	Very high	96.4	Very high	133 Å²	133	65.7 Å²	65.7	71%	0.711	38%	0.381	S	S	*	.	H	α-helix	trans	-61.5	-25.9	177.4	-69.4	-15.2	0	0	0	112.3	R172 W173	R172-D176 WeakPolarHBondContact O-CB 3.23Å; R172-D176 PolarHBondContact O-N 3Å; W173-D176 PolarHBondContact O-N 3.19Å
177	H	98.2	Very high	96.1	Very high	50 Å²	50	62.3 Å²	62.3	23%	0.231	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	9.1	176.6	-70.5	69.2	0	0	0	113.1	R145 W173 A174 V175	R145-H177 HydrophobicContact CG-CB 4.31Å; R145-H177 PolarHBondContact NH1-O 3.04Å; R145-H177 PolarHBondContact NH2-CD2 3.13Å; W173-H177 AromaticContact CD1-CE1 3.66Å; W173-H177 AromaticContact CD2-CE1 3.71Å; W173-H177 AromaticContact CD2-ND1 3.56Å; W173-H177 AromaticContact CE2-CE1 3.2Å; W173-H177 AromaticContact CE2-ND1 3.52Å; W173-H177 AromaticContact CE2-NE2 3.54Å; W173-H177 AromaticContact CE3-ND1 3.97Å; W173-H177 AromaticContact CG-CE1 3.98Å; W173-H177 AromaticContact CG-ND1 3.93Å; W173-H177 AromaticContact CH2-CD2 3.89Å; W173-H177 AromaticContact CZ2-CD2 3.65Å; W173-H177 AromaticContact CZ2-CE1 3.6Å; W173-H177 AromaticContact CZ2-CG 3.97Å; W173-H177 AromaticContact CZ2-ND1 3.92Å; W173-H177 AromaticContact CZ2-NE2 3.42Å; W173-H177 WeakPolarHBondContact CZ2-NE2 3.43Å; W173-H177 HydrophobicContact CZ3-CB 4.4Å; W173-H177 AromaticContact NE1-CE1 3.18Å; W173-H177 PolarHBondContact NE1-CE1 3.16Å; W173-H177 AromaticContact NE1-ND1 3.83Å; W173-H177 AromaticContact NE1-NE2 3.72Å; W173-H177 WeakPolarHBondContact O-CB 3.35Å; W173-H177 PolarHBondContact O-N 2.59Å; W173-H177 VanDerWaalsContact O-N 3.08Å; W173-H177 PolarHBondContact O-ND1 3.33Å; A174-H177 CarbonylContact O-C 3.56Å; A174-H177 PolarHBondContact O-N 2.89Å; V175-H177 PolarHBondContact O-N 3.44Å
178	G	98.1	Very high	95.9	Very high	65 Å²	65	63.1 Å²	63.1	67%	0.67	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	17.6	175.7	0	0	0	0	0	114.6	A174 V175	A174-G178 PolarHBondContact O-N 2.85Å; V175-G178 PolarHBondContact O-N 3.37Å
179	I	98.1	Very high	95.6	Very high	22 Å²	22	59.2 Å²	59.2	11%	0.113	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-81.5	124.6	174.1	-58.4	177	0	0	0	108.4	I136 V142 R145 A174 S181	I136-I179 HydrophobicContact CG2-CG2 3.99Å; V142-I179 HydrophobicContact CB-CD1 4.15Å; V142-I179 HydrophobicContact CG1-CD1 4.4Å; V142-I179 HydrophobicContact CG2-CD1 3.84Å; V142-I179 HydrophobicContact CG2-CG2 4.24Å; R145-I179 HydrophobicContact CB-CD1 3.98Å; R145-I179 HydrophobicContact CG-CD1 4.35Å; A174-I179 HydrophobicContact CB-CB 4.14Å; A174-I179 HydrophobicContact CB-CD1 4.29Å; A174-I179 WeakPolarHBondContact O-CB 3.3Å; A174-I179 PolarHBondContact O-N 3.37Å; I179-S181 PolarHBondContact O-N 3.08Å
180	P	90.1	Very high	95.3	Very high	101 Å²	101	67.8 Å²	67.8	66%	0.656	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-63.6	129.2	-174.1	-24.1	34.2	0	0	0	113.6
181	S	96.1	Very high	94.7	Very high	67 Å²	67	74.2 Å²	74.2	47%	0.469	39%	0.392	S	S	.	.	B	Isolated β-bridge	trans	-68.8	144.8	167.7	60.2	0	0	0	0	111.3	G135 I179	G135-S181 CarbonylContact O-C 3.44Å; G135-S181 VanDerWaalsContact O-CA 3.29Å; G135-S181 WeakPolarHBondContact O-CA 3.29Å; I179-S181 PolarHBondContact O-N 3.08Å
182	C	94.4	Very high	94.3	Very high	12 Å²	12	71.5 Å²	71.5	8%	0.081	38%	0.382	C	S	.	.			trans	-121.8	120	179.5	-165.7	0	0	0	0	110.6	G135 K137 M187	G135-C182 PolarHBondContact O-N 3.42Å; K137-C182 HydrophobicContact CB-CB 3.85Å; C182-M187 HydrophobicContact CB-CG 4.05Å; C182-M187 HydrophobicContact CB-SD 3.93Å; C182-M187 VanDerWaalsContact SG-SD 3.62Å
183	P	92.5	Very high	94.1	Very high	61 Å²	61	67.5 Å²	67.5	40%	0.396	37%	0.372	S	S	.	.			trans	-58.3	145.5	174.6	-28.7	36.8	0	0	0	113.7	N185 I186 M187	P183-N185 WeakPolarHBondContact CB-OD1 3.41Å; P183-N185 PolarHBondContact O-N 3.24Å; P183-N185 VanDerWaalsContact O-N 3.15Å; P183-I186 HydrophobicContact CG-CD1 4.37Å; P183-I186 PolarHBondContact O-N 2.95Å; P183-M187 PolarHBondContact O-N 3.12Å
184	P	89.8	Confident	93.7	Very high	98 Å²	98	68 Å²	68	64%	0.636	38%	0.384	S	S	*	.	H	α-helix	trans	-55.4	-34.6	-179.5	-28.2	35.1	0	0	0	114.6	I186 M187 T188	P184-I186 PolarHBondContact O-N 3.24Å; P184-M187 PolarHBondContact O-N 3.25Å; P184-T188 WeakPolarHBondContact O-CB 3.33Å; P184-T188 PolarHBondContact O-N 2.99Å; P184-T188 PolarHBondContact O-OG1 2.88Å
185	N	90	Very high	93.3	Very high	130 Å²	130	69.3 Å²	69.3	70%	0.695	40%	0.396	S	S	*	.	H	α-helix	trans	-68	-17.3	179.4	65.1	-62.1	0	0	0	114	P183	P183-N185 WeakPolarHBondContact CB-OD1 3.41Å; P183-N185 PolarHBondContact O-N 3.24Å; P183-N185 VanDerWaalsContact O-N 3.15Å
186	I	91.6	Very high	93.1	Very high	84 Å²	84	67.9 Å²	67.9	43%	0.431	39%	0.385	S	S	.	.	H	α-helix	trans	-89.1	-40	172.4	-57.9	-176	0	0	0	109.9	P183 P184	P183-I186 HydrophobicContact CG-CD1 4.37Å; P183-I186 PolarHBondContact O-N 2.95Å; P184-I186 PolarHBondContact O-N 3.24Å
187	M	92.7	Very high	92.9	Very high	5 Å²	5	68.1 Å²	68.1	3%	0.025	38%	0.379	C	S	.	.	H	α-helix	trans	-67.5	-40.1	179.5	-66.5	-64.2	-74.8	0	0	112.7	G102 G104 I113 I136 K137 C182 P183 P184	G102-M187 VanDerWaalsContact O-CE 3.31Å; G102-M187 WeakPolarHBondContact O-CE 3.17Å; G104-M187 PolarHBondContact N-O 2.94Å; I113-M187 HydrophobicContact CD1-CB 3.71Å; I113-M187 WeakPolarHBondContact CD1-O 3.36Å; I113-M187 HydrophobicContact CG2-CE 4.37Å; I136-M187 VanDerWaalsContact O-CE 3.25Å; I136-M187 WeakPolarHBondContact O-CE 3.42Å; K137-M187 HydrophobicContact CB-SD 4.44Å; K137-M187 HydrophobicContact CG-SD 4.46Å; C182-M187 HydrophobicContact CB-CG 4.05Å; C182-M187 HydrophobicContact CB-SD 3.93Å; C182-M187 VanDerWaalsContact SG-SD 3.62Å; P183-M187 PolarHBondContact O-N 3.12Å; P184-M187 PolarHBondContact O-N 3.25Å
188	T	94.6	Very high	92.7	Very high	35 Å²	35	73.3 Å²	73.3	22%	0.215	40%	0.397	C	S	.	.	S	Bend	trans	-80.9	120.6	-179.9	-58.4	0	0	0	0	111	L107 P184 L193	L107-T188 HydrophobicContact CD1-CG2 4.38Å; L107-T188 HydrophobicContact CD2-CG2 4.34Å; P184-T188 WeakPolarHBondContact O-CB 3.33Å; P184-T188 PolarHBondContact O-N 2.99Å; P184-T188 PolarHBondContact O-OG1 2.88Å; T188-L193 HydrophobicContact CG2-CB 3.9Å
189	T	92.4	Very high	92.3	Very high	19 Å²	19	71.7 Å²	71.7	12%	0.117	37%	0.373	C	S	.	.			trans	-92	160.9	176.1	71.7	0	0	0	0	110.5	P97 M103 F191 S192 L193	P97-T189 HydrophobicContact CB-CG2 3.7Å; M103-T189 HydrophobicContact CG-CG2 4.25Å; T189-F191 PolarHBondContact O-N 3.14Å; T189-F191 PolarHBondContact OG1-N 2.94Å; T189-S192 PolarHBondContact N-OG 3Å; T189-S192 VanDerWaalsContact N-OG 3.12Å; T189-S192 PolarHBondContact O-N 3.25Å; T189-S192 PolarHBondContact O-OG 3.37Å; T189-S192 PolarHBondContact OG1-N 2.9Å; T189-S192 VanDerWaalsContact OG1-N 3.08Å; T189-S192 PolarHBondContact OG1-OG 2.89Å; T189-L193 WeakPolarHBondContact O-CB 3.32Å; T189-L193 PolarHBondContact O-N 3.26Å
190	R	91.4	Very high	92	Very high	224 Å²	224	73.8 Å²	73.8	85%	0.845	38%	0.381	S	S	*	.	H	α-helix	trans	-56.7	-32.6	171.8	-69.9	179.4	64.1	-165.5	-0.4	111.8	A194	R190-A194 VanDerWaalsContact O-CB 3.27Å; R190-A194 WeakPolarHBondContact O-CB 3.28Å; R190-A194 PolarHBondContact O-N 2.85Å; R190-A194 VanDerWaalsContact O-N 3.13Å
191	F	86.8	Confident	92.1	Very high	136 Å²	136	78.3 Å²	78.3	60%	0.596	39%	0.385	S	S	*	.	H	α-helix	trans	-72	-48.5	179.3	-57.7	-62.8	0	0	0	111.8	F98 T189 L193 A194 A195	F98-F191 HydrophobicContact CE1-CE2 4.23Å; T189-F191 PolarHBondContact O-N 3.14Å; T189-F191 PolarHBondContact OG1-N 2.94Å; F191-L193 PolarHBondContact O-N 2.85Å; F191-A194 PolarHBondContact O-N 2.85Å; F191-A195 PolarHBondContact O-N 3.39Å
192	S	91.3	Very high	91.8	Very high	7 Å²	7	79.9 Å²	79.9	5%	0.049	38%	0.383	C	S	.	.	H	α-helix	trans	-66.9	-38.5	-179.6	66.8	0	0	0	0	111.7	L107 T189 A194 A195 F196	L107-S192 WeakPolarHBondContact CD1-OG 3.38Å; T189-S192 PolarHBondContact N-OG 3Å; T189-S192 VanDerWaalsContact N-OG 3.12Å; T189-S192 PolarHBondContact O-N 3.25Å; T189-S192 PolarHBondContact O-OG 3.37Å; T189-S192 PolarHBondContact OG1-N 2.9Å; T189-S192 VanDerWaalsContact OG1-N 3.08Å; T189-S192 PolarHBondContact OG1-OG 2.89Å; S192-A194 PolarHBondContact O-N 3.46Å; S192-A195 PolarHBondContact O-N 2.83Å; S192-F196 WeakPolarHBondContact O-CB 3.19Å; S192-F196 PolarHBondContact O-N 2.84Å
193	L	93.7	Very high	91.5	Very high	68 Å²	68	82.4 Å²	82.4	36%	0.356	40%	0.396	S	S	.	.	H	α-helix	trans	-64.4	-39.9	174.1	-176.2	60.8	0	0	0	112.9	L107 T188 T189 F191 F196 K197	L107-L193 HydrophobicContact CD2-CD1 4.17Å; T188-L193 HydrophobicContact CG2-CB 3.9Å; T189-L193 WeakPolarHBondContact O-CB 3.32Å; T189-L193 PolarHBondContact O-N 3.26Å; F191-L193 PolarHBondContact O-N 2.85Å; L193-F196 HydrophobicContact CD1-CD1 4.43Å; L193-F196 PolarHBondContact O-N 2.82Å; L193-K197 WeakPolarHBondContact O-CG 3.45Å; L193-K197 PolarHBondContact O-N 2.94Å; L193-K197 VanDerWaalsContact O-N 3.1Å
194	A	91.3	Very high	91.3	Very high	50 Å²	50	83.4 Å²	83.4	41%	0.413	40%	0.395	S	S	.	.	H	α-helix	trans	-67.5	-39.4	176.5	0	0	0	0	0	111.9	R190 F191 S192 R198	R190-A194 VanDerWaalsContact O-CB 3.27Å; R190-A194 WeakPolarHBondContact O-CB 3.28Å; R190-A194 PolarHBondContact O-N 2.85Å; R190-A194 VanDerWaalsContact O-N 3.13Å; F191-A194 PolarHBondContact O-N 2.85Å; S192-A194 PolarHBondContact O-N 3.46Å; A194-R198 WeakPolarHBondContact O-CB 3.43Å; A194-R198 PolarHBondContact O-N 3.42Å; A194-R198 VanDerWaalsContact O-N 3.13Å
195	A	90.1	Very high	91.3	Very high	29 Å²	29	84 Å²	84	24%	0.24	39%	0.392	C	S	.	.	H	α-helix	trans	-62.3	-45.2	173.7	0	0	0	0	0	111.2	F191 S192 K197 R198 N199	F191-A195 PolarHBondContact O-N 3.39Å; S192-A195 PolarHBondContact O-N 2.83Å; A195-K197 PolarHBondContact O-N 2.96Å; A195-R198 WeakPolarHBondContact O-CB 3.24Å; A195-R198 PolarHBondContact O-N 2.91Å; A195-N199 WeakPolarHBondContact O-CB 3.29Å; A195-N199 VanDerWaalsContact O-CG 3.26Å; A195-N199 PolarHBondContact O-N 3.05Å; A195-N199 PolarHBondContact O-OD1 3.22Å
196	F	93.9	Very high	91	Very high	30 Å²	30	80.4 Å²	80.4	13%	0.132	38%	0.381	C	S	.	.	H	α-helix	trans	-55.4	-52.1	175.4	172.6	-106.4	0	0	0	112.6	L107 N108 G111 S192 L193 R198 N199 K200 L257	L107-F196 HydrophobicContact CB-CB 3.98Å; L107-F196 HydrophobicContact CB-CD2 3.64Å; L107-F196 HydrophobicContact CB-CE2 4.39Å; L107-F196 HydrophobicContact CB-CG 3.93Å; L107-F196 HydrophobicContact CD1-CB 4.47Å; L107-F196 HydrophobicContact CD2-CB 3.8Å; L107-F196 HydrophobicContact CD2-CD1 4.08Å; L107-F196 HydrophobicContact CD2-CD2 4.3Å; L107-F196 HydrophobicContact CD2-CG 3.79Å; L107-F196 HydrophobicContact CG-CB 4.31Å; L107-F196 HydrophobicContact CG-CG 4.46Å; N108-F196 WeakPolarHBondContact O-CE2 3.48Å; G111-F196 VanDerWaalsContact CA-CZ 3.47Å; S192-F196 WeakPolarHBondContact O-CB 3.19Å; S192-F196 PolarHBondContact O-N 2.84Å; L193-F196 HydrophobicContact CD1-CD1 4.43Å; L193-F196 PolarHBondContact O-N 2.82Å; F196-R198 VanDerWaalsContact C-N 3.27Å; F196-R198 PolarHBondContact O-N 3.09Å; F196-N199 PolarHBondContact O-N 3.15Å; F196-K200 HydrophobicContact CE1-CD 4.15Å; F196-K200 HydrophobicContact CE2-CD 3.98Å; F196-K200 HydrophobicContact CZ-CD 3.53Å; F196-K200 WeakPolarHBondContact O-CB 3.21Å; F196-K200 PolarHBondContact O-N 3.29Å; F196-L257 HydrophobicContact CD2-CD2 3.48Å; F196-L257 VanDerWaalsContact CD2-CD2 3.48Å; F196-L257 HydrophobicContact CE2-CD2 3.45Å; F196-L257 VanDerWaalsContact CE2-CD2 3.45Å
197	K	94.8	Very high	90.7	Very high	137 Å²	137	81.3 Å²	81.3	60%	0.596	38%	0.383	S	S	*	.	H	α-helix	trans	-58.8	-40.1	178.9	-71.2	177.6	-178.6	-177	0	112.2	L193 A195 R201	L193-K197 WeakPolarHBondContact O-CG 3.45Å; L193-K197 PolarHBondContact O-N 2.94Å; L193-K197 VanDerWaalsContact O-N 3.1Å; A195-K197 PolarHBondContact O-N 2.96Å; K197-R201 WeakPolarHBondContact O-CB 3.27Å; K197-R201 PolarHBondContact O-N 3.47Å; K197-R201 VanDerWaalsContact O-N 3.15Å
198	R	92.8	Very high	90	Very high	159 Å²	159	88.8 Å²	88.8	60%	0.6	41%	0.411	S	S	*	.	H	α-helix	trans	-65.3	-49.7	177.5	-172.8	-169.1	-51.4	174.9	3.8	111.3	A194 A195 F196 K200 R201 K202	A194-R198 WeakPolarHBondContact O-CB 3.43Å; A194-R198 PolarHBondContact O-N 3.42Å; A194-R198 VanDerWaalsContact O-N 3.13Å; A195-R198 WeakPolarHBondContact O-CB 3.24Å; A195-R198 PolarHBondContact O-N 2.91Å; F196-R198 VanDerWaalsContact C-N 3.27Å; F196-R198 PolarHBondContact O-N 3.09Å; R198-K200 VanDerWaalsContact C-N 3.34Å; R198-K200 PolarHBondContact O-N 2.85Å; R198-R201 PolarHBondContact O-N 3.46Å; R198-K202 PolarHBondContact O-N 2.82Å
199	N	90.7	Very high	89.2	Confident	32 Å²	32	90.2 Å²	90.2	17%	0.171	42%	0.42	C	S	.	.	H	α-helix	trans	-65.9	-40.1	-177.7	-67	-4.6	0	0	0	110.7	A195 F196 R201 K202 L203 L257	A195-N199 WeakPolarHBondContact O-CB 3.29Å; A195-N199 VanDerWaalsContact O-CG 3.26Å; A195-N199 PolarHBondContact O-N 3.05Å; A195-N199 PolarHBondContact O-OD1 3.22Å; F196-N199 PolarHBondContact O-N 3.15Å; N199-R201 PolarHBondContact O-N 3.18Å; N199-K202 WeakPolarHBondContact O-CB 3.5Å; N199-K202 PolarHBondContact O-N 2.86Å; N199-K202 VanDerWaalsContact O-N 3.17Å; N199-L203 PolarHBondContact O-N 2.99Å; N199-L257 HydrophobicContact CB-CD1 3.65Å; N199-L257 HydrophobicContact CB-CG 4.05Å
200	K	92.1	Very high	88	Confident	65 Å²	65	95.6 Å²	95.6	28%	0.283	44%	0.444	S	S	.	.	H	α-helix	trans	-63.4	-42	177.9	-166.6	146.6	-172.3	167	0	111.8	L109 F196 R198 K202 L203 E204 L257	L109-K200 PolarHBondContact O-NZ 3.1Å; F196-K200 HydrophobicContact CE1-CD 4.15Å; F196-K200 HydrophobicContact CE2-CD 3.98Å; F196-K200 HydrophobicContact CZ-CD 3.53Å; F196-K200 WeakPolarHBondContact O-CB 3.21Å; F196-K200 PolarHBondContact O-N 3.29Å; R198-K200 VanDerWaalsContact C-N 3.34Å; R198-K200 PolarHBondContact O-N 2.85Å; K200-K202 VanDerWaalsContact C-N 3.34Å; K200-K202 PolarHBondContact O-N 3.31Å; K200-L203 PolarHBondContact O-N 3Å; K200-E204 WeakPolarHBondContact O-CG 3.34Å; K200-E204 PolarHBondContact O-N 3.46Å; K200-L257 HydrophobicContact CB-CD2 4.47Å
201	R	92.3	Very high	86.6	Confident	196 Å²	196	89.1 Å²	89.1	74%	0.74	43%	0.429	S	S	*	.	H	α-helix	trans	-63.3	-37.6	173.3	-172.7	175.9	-178.6	-179.9	0.5	112.8	K197 R198 N199 L205	K197-R201 WeakPolarHBondContact O-CB 3.27Å; K197-R201 PolarHBondContact O-N 3.47Å; K197-R201 VanDerWaalsContact O-N 3.15Å; R198-R201 PolarHBondContact O-N 3.46Å; N199-R201 PolarHBondContact O-N 3.18Å; R201-L205 WeakPolarHBondContact O-CB 3.45Å; R201-L205 PolarHBondContact O-N 2.91Å; R201-L205 VanDerWaalsContact O-N 3.11Å
202	K	88.8	Confident	85.2	Confident	100 Å²	100	87 Å²	87	44%	0.435	42%	0.424	S	S	.	.	H	α-helix	trans	-64.8	-43.7	174.9	-75.8	-173.7	170.3	-163.8	0	111.4	R198 N199 K200 L205 A206 E226	R198-K202 PolarHBondContact O-N 2.82Å; N199-K202 WeakPolarHBondContact O-CB 3.5Å; N199-K202 PolarHBondContact O-N 2.86Å; N199-K202 VanDerWaalsContact O-N 3.17Å; K200-K202 VanDerWaalsContact C-N 3.34Å; K200-K202 PolarHBondContact O-N 3.31Å; K202-L205 PolarHBondContact O-N 2.88Å; K202-A206 PolarHBondContact O-N 2.92Å; K202-E226 IonicContact NZ-OE2 3.77Å; K202-E226 PolarHBondContact NZ-OE2 2.86Å
203	L	88.5	Confident	83.3	Confident	65 Å²	65	92.8 Å²	92.8	34%	0.34	45%	0.448	S	S	.	.	H	α-helix	trans	-60.5	-50.6	176.8	-176.2	66.5	0	0	0	111.3	L109 N199 K200 L205 A206 E207 L257	L109-L203 HydrophobicContact CD1-CD2 3.97Å; N199-L203 PolarHBondContact O-N 2.99Å; K200-L203 PolarHBondContact O-N 3Å; L203-L205 VanDerWaalsContact C-N 3.25Å; L203-L205 PolarHBondContact O-N 2.72Å; L203-A206 PolarHBondContact O-N 2.67Å; L203-A206 VanDerWaalsContact O-N 3.1Å; L203-E207 WeakPolarHBondContact O-CG 3.5Å; L203-E207 PolarHBondContact O-N 3.2Å; L203-L257 HydrophobicContact CB-CD1 4.32Å; L203-L257 HydrophobicContact CD2-CD1 4.23Å
204	E	89.2	Confident	81.4	Confident	83 Å²	83	96.1 Å²	96.1	39%	0.388	47%	0.465	S	S	.	.	H	α-helix	trans	-59.3	-35.1	177.5	-71.1	170.8	-169.2	0	0	112.7	K200 R208	K200-E204 WeakPolarHBondContact O-CG 3.34Å; K200-E204 PolarHBondContact O-N 3.46Å; E204-R208 VanDerWaalsContact O-CG 3.26Å; E204-R208 WeakPolarHBondContact O-CG 3.32Å; E204-R208 PolarHBondContact O-N 2.92Å
205	L	88.3	Confident	79.4	Confident	110 Å²	110	101.2 Å²	101.2	58%	0.576	48%	0.48	S	S	*	.	H	α-helix	trans	-70	-42.9	175.8	-174	66.5	0	0	0	111.3	R201 K202 L203 R208 V209	R201-L205 WeakPolarHBondContact O-CB 3.45Å; R201-L205 PolarHBondContact O-N 2.91Å; R201-L205 VanDerWaalsContact O-N 3.11Å; K202-L205 PolarHBondContact O-N 2.88Å; L203-L205 VanDerWaalsContact C-N 3.25Å; L203-L205 PolarHBondContact O-N 2.72Å; L205-R208 PolarHBondContact O-N 2.9Å; L205-V209 VanDerWaalsContact O-CG2 3.26Å; L205-V209 WeakPolarHBondContact O-CG2 3.45Å; L205-V209 PolarHBondContact O-N 2.78Å
206	A	84.4	Confident	77.3	Confident	55 Å²	55	105.9 Å²	105.9	46%	0.455	50%	0.501	S	S	.	.	H	α-helix	trans	-63.4	-42.7	177.7	0	0	0	0	0	111.8	K202 L203 R208 V209 E210	K202-A206 PolarHBondContact O-N 2.92Å; L203-A206 PolarHBondContact O-N 2.67Å; L203-A206 VanDerWaalsContact O-N 3.1Å; A206-R208 PolarHBondContact O-N 2.91Å; A206-V209 PolarHBondContact O-N 3.32Å; A206-E210 WeakPolarHBondContact O-CB 3.38Å; A206-E210 PolarHBondContact O-N 3.11Å
207	E	84.3	Confident	75.1	Confident	103 Å²	103	114 Å²	114	48%	0.481	54%	0.536	S	S	.	.	H	α-helix	trans	-62.8	-39.3	176.8	-72.1	175.4	171.7	0	0	112.2	L203 E210 T211	L203-E207 WeakPolarHBondContact O-CG 3.5Å; L203-E207 PolarHBondContact O-N 3.2Å; E207-E210 PolarHBondContact O-N 2.6Å; E207-T211 WeakPolarHBondContact O-CB 3.42Å; E207-T211 PolarHBondContact O-N 3.45Å; E207-T211 PolarHBondContact O-OG1 2.97Å
208	R	79.4	Confident	72.9	Confident	162 Å²	162	116.6 Å²	116.6	61%	0.611	55%	0.547	S	S	*	.	H	α-helix	trans	-64.4	-46.3	174.1	-72.6	172.6	-167.6	-165.6	4.1	111.6	E204 L205 A206 E210 T211 D212	E204-R208 VanDerWaalsContact O-CG 3.26Å; E204-R208 WeakPolarHBondContact O-CG 3.32Å; E204-R208 PolarHBondContact O-N 2.92Å; L205-R208 PolarHBondContact O-N 2.9Å; A206-R208 PolarHBondContact O-N 2.91Å; R208-E210 VanDerWaalsContact C-N 3.34Å; R208-E210 PolarHBondContact O-N 3.4Å; R208-T211 WeakPolarHBondContact O-CB 3.47Å; R208-T211 PolarHBondContact O-N 3.47Å; R208-D212 WeakPolarHBondContact O-CB 3.29Å; R208-D212 VanDerWaalsContact O-CG 3.28Å; R208-D212 PolarHBondContact O-N 3.44Å
209	V	76.1	Confident	70.4	Confident	64 Å²	64	119.7 Å²	119.7	39%	0.388	56%	0.559	S	S	.	*	H	α-helix	trans	-61	-45.1	177.1	172.5	0	0	0	0	110	L205 A206 T211 D212 F213	L205-V209 VanDerWaalsContact O-CG2 3.26Å; L205-V209 WeakPolarHBondContact O-CG2 3.45Å; L205-V209 PolarHBondContact O-N 2.78Å; A206-V209 PolarHBondContact O-N 3.32Å; V209-T211 VanDerWaalsContact C-N 3.34Å; V209-T211 PolarHBondContact O-N 3.33Å; V209-D212 CarbonylContact O-C 3.52Å; V209-D212 PolarHBondContact O-N 3.48Å; V209-F213 HydrophobicContact CG1-CD2 3.35Å; V209-F213 HydrophobicContact CG1-CE2 3.4Å; V209-F213 VanDerWaalsContact O-CB 3.29Å; V209-F213 WeakPolarHBondContact O-CB 3.06Å; V209-F213 WeakPolarHBondContact O-CD2 3.35Å; V209-F213 PolarHBondContact O-N 3.4Å
210	E	68.1	Low	68	Low	133 Å²	133	129.2 Å²	129.2	62%	0.621	59%	0.592	S	S	*	*	H	α-helix	trans	-62.4	-40.3	177.3	-168.2	167.4	-160.3	0	0	112.3	A206 E207 R208 D212 F213 I214	A206-E210 WeakPolarHBondContact O-CB 3.38Å; A206-E210 PolarHBondContact O-N 3.11Å; E207-E210 PolarHBondContact O-N 2.6Å; R208-E210 VanDerWaalsContact C-N 3.34Å; R208-E210 PolarHBondContact O-N 3.4Å; E210-D212 PolarHBondContact O-N 3.09Å; E210-F213 PolarHBondContact O-N 3.31Å; E210-I214 WeakPolarHBondContact O-CG1 3.41Å; E210-I214 PolarHBondContact O-N 3.14Å
211	T	61.4	Low	65.8	Low	88 Å²	88	135.8 Å²	135.8	54%	0.54	62%	0.624	S	S	.	*	H	α-helix	trans	-62	-41.9	174.2	-52.9	0	0	0	0	111.7	E207 R208 V209	E207-T211 WeakPolarHBondContact O-CB 3.42Å; E207-T211 PolarHBondContact O-N 3.45Å; E207-T211 PolarHBondContact O-OG1 2.97Å; R208-T211 WeakPolarHBondContact O-CB 3.47Å; R208-T211 PolarHBondContact O-N 3.47Å; V209-T211 VanDerWaalsContact C-N 3.34Å; V209-T211 PolarHBondContact O-N 3.33Å
212	D	58	Low	63.1	Low	91 Å²	91	132 Å²	132	49%	0.487	63%	0.628	S	S	.	*	H	α-helix	trans	-73.3	-31.6	176.9	-67.5	-20.5	0	0	0	112.2	R208 V209 E210 Q215 L216	R208-D212 WeakPolarHBondContact O-CB 3.29Å; R208-D212 VanDerWaalsContact O-CG 3.28Å; R208-D212 PolarHBondContact O-N 3.44Å; V209-D212 CarbonylContact O-C 3.52Å; V209-D212 PolarHBondContact O-N 3.48Å; E210-D212 PolarHBondContact O-N 3.09Å; D212-Q215 WeakPolarHBondContact O-CB 3.4Å; D212-Q215 PolarHBondContact O-N 2.93Å; D212-Q215 VanDerWaalsContact O-N 3.16Å; D212-L216 PolarHBondContact O-N 3.43Å; D212-L216 VanDerWaalsContact O-N 3.14Å
213	F	52.2	Low	60.9	Low	128 Å²	128	132.6 Å²	132.6	56%	0.561	64%	0.644	S	S	*	*	H	α-helix	trans	-74.1	-28	176.9	-96.3	-97.9	0	0	0	112.9	V209 E210 Q215 L216	V209-F213 HydrophobicContact CG1-CD2 3.35Å; V209-F213 HydrophobicContact CG1-CE2 3.4Å; V209-F213 VanDerWaalsContact O-CB 3.29Å; V209-F213 WeakPolarHBondContact O-CB 3.06Å; V209-F213 WeakPolarHBondContact O-CD2 3.35Å; V209-F213 PolarHBondContact O-N 3.4Å; E210-F213 PolarHBondContact O-N 3.31Å; F213-Q215 PolarHBondContact O-N 2.78Å; F213-L216 CarbonylContact O-C 3.57Å; F213-L216 PolarHBondContact O-N 3.46Å
214	I	53.1	Low	58.3	Low	138 Å²	138	138.2 Å²	138.2	71%	0.708	67%	0.669	S	S	*	*	H	α-helix	trans	-64.7	-26.8	168.3	-69.5	168.2	0	0	0	110.6	E210	E210-I214 WeakPolarHBondContact O-CG1 3.41Å; E210-I214 PolarHBondContact O-N 3.14Å
215	Q	49.8	Very low	55.8	Low	158 Å²	158	142.8 Å²	142.8	74%	0.738	69%	0.687	S	S	*	*	H	α-helix	trans	-83.2	-23.8	172	-69.7	-175.8	-8	0	0	114.1	D212 F213	D212-Q215 WeakPolarHBondContact O-CB 3.4Å; D212-Q215 PolarHBondContact O-N 2.93Å; D212-Q215 VanDerWaalsContact O-N 3.16Å; F213-Q215 PolarHBondContact O-N 2.78Å
216	L	45.8	Very low	53.5	Low	127 Å²	127	144.1 Å²	144.1	67%	0.665	69%	0.691	S	S	*	*			trans	-121.5	67.6	-177.7	-84.6	122.6	0	0	0	113	D212 F213 K218	D212-L216 PolarHBondContact O-N 3.43Å; D212-L216 VanDerWaalsContact O-N 3.14Å; F213-L216 CarbonylContact O-C 3.57Å; F213-L216 PolarHBondContact O-N 3.46Å; L216-K218 VanDerWaalsContact C-N 3.33Å; L216-K218 PolarHBondContact O-N 3.06Å
217	K	48.1	Very low	51.6	Low	201 Å²	201	146.1 Å²	146.1	87%	0.874	69%	0.694	S	S	*	*			trans	-63.7	87.3	164.8	-99.3	-173.8	176.9	176.1	0	111.4
218	K	47.9	Very low	49.8	Very low	191 Å²	191	146.4 Å²	146.4	83%	0.83	70%	0.699	S	S	*	*			trans	158.8	103.6	148.9	-97.1	174.3	174.6	174.6	0	110.1	L216	L216-K218 VanDerWaalsContact C-N 3.33Å; L216-K218 PolarHBondContact O-N 3.06Å
219	R	39.2	Very low	48.3	Very low	223 Å²	223	139.5 Å²	139.5	84%	0.842	68%	0.675	S	S	*	*				157.8	122.2	125.4	-90.6	168.1	152.9	-178.8	-7	112.4
220	R	40.5	Very low	47	Very low	232 Å²	232	138.5 Å²	138.5	88%	0.875	68%	0.678	S	S	*	*			trans	61.1	111.1	147.9	-61.5	-178.9	105.7	156.3	2.9	118.1
221	Q	46.8	Very low	46.6	Very low	203 Å²	203	133.2 Å²	133.2	95%	0.949	66%	0.655	S	S	*	*			trans	-51.6	129.9	155.2	-76.9	168.4	-25.7	0	0	110.8
222	S	36.1	Very low	46.8	Very low	118 Å²	118	129.7 Å²	129.7	83%	0.825	63%	0.632	S	S	*	*			trans	-133.7	126.8	156.9	54	0	0	0	0	108.9
223	S	42.8	Very low	47.7	Very low	111 Å²	111	125.7 Å²	125.7	78%	0.776	61%	0.611	S	S	*	*			trans	-82.3	123.5	-174.4	49.7	0	0	0	0	112.3
224	E	33.5	Very low	49.6	Very low	184 Å²	184	119.7 Å²	119.7	86%	0.86	59%	0.585	S	S	*	*			trans	-136.8	89.8	149.7	-74	-173.8	164.8	0	0	107.1	E226	E224-E226 VanDerWaalsContact C-N 3.3Å; E224-E226 PolarHBondContact O-N 3.44Å
225	K	35.3	Very low	51.7	Low	178 Å²	178	113.2 Å²	113.2	77%	0.774	55%	0.552	S	S	*	*			trans	-74.6	87.4	169.5	-80.2	-173.2	176	-175	0	107.1	D337	K225-D337 IonicContact NZ-OD2 3.66Å
226	E	40.9	Very low	54.1	Low	139 Å²	139	105.7 Å²	105.7	65%	0.65	52%	0.517	S	S	*	.			trans	-68.4	128.3	161.1	-82.5	-167	153.6	0	0	108.6	K202 E224 D228	K202-E226 IonicContact NZ-OE2 3.77Å; K202-E226 PolarHBondContact NZ-OE2 2.86Å; E224-E226 VanDerWaalsContact C-N 3.3Å; E224-E226 PolarHBondContact O-N 3.44Å; E226-D228 PolarHBondContact O-N 2.85Å
227	N	43.7	Very low	56.6	Low	96 Å²	96	99.6 Å²	99.6	51%	0.513	49%	0.485	S	S	.	.			trans	-59	95.1	-176.7	-85.5	1.7	0	0	0	112.6	S229 E375	N227-S229 PolarHBondContact O-N 2.83Å; N227-E375 PolarHBondContact ND2-OE1 2.8Å
228	D	47.7	Very low	59	Low	109 Å²	109	90 Å²	90	58%	0.583	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-76.2	9.3	171.7	-160.8	31	0	0	0	112.9	E226 G230 T231	E226-D228 PolarHBondContact O-N 2.85Å; D228-G230 PolarHBondContact O-N 2.95Å; D228-G230 VanDerWaalsContact O-N 3.12Å; D228-T231 WeakPolarHBondContact O-CB 3.29Å; D228-T231 WeakPolarHBondContact O-CG2 3.43Å; D228-T231 PolarHBondContact O-N 2.99Å; D228-T231 PolarHBondContact O-OG1 3.21Å; D228-T231 WeakPolarHBondContact OD1-CG2 3.48Å
229	S	47.3	Very low	61.4	Low	18 Å²	18	81 Å²	81	13%	0.126	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-69	-6.6	-176.2	49.8	0	0	0	0	114.8	Y52 N227 T231	Y52-S229 WeakPolarHBondContact CB-OG 3.42Å; N227-S229 PolarHBondContact O-N 2.83Å; S229-T231 PolarHBondContact O-N 2.97Å
230	G	49.8	Very low	64.3	Low	43 Å²	43	70.3 Å²	70.3	44%	0.443	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-70.5	-7	168.8	0	0	0	0	0	114	D228	D228-G230 PolarHBondContact O-N 2.95Å; D228-G230 VanDerWaalsContact O-N 3.12Å
231	T	58	Low	67	Low	21 Å²	21	59.9 Å²	59.9	13%	0.129	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-87.2	-3.5	179.1	58.4	0	0	0	0	114.2	D228 S229 A256	D228-T231 WeakPolarHBondContact O-CB 3.29Å; D228-T231 WeakPolarHBondContact O-CG2 3.43Å; D228-T231 PolarHBondContact O-N 2.99Å; D228-T231 PolarHBondContact O-OG1 3.21Å; D228-T231 WeakPolarHBondContact OD1-CG2 3.48Å; S229-T231 PolarHBondContact O-N 2.97Å; T231-A256 HydrophobicContact CG2-CB 3.89Å
232	L	66.4	Low	69.3	Low	14 Å²	14	51.7 Å²	51.7	7%	0.073	29%	0.287	C	S	.	.			trans	-105.5	0.3	-170	-59.5	174.2	0	0	0	114.3	T234 L255 S291 G292 C293 L340	L232-T234 PolarHBondContact O-N 3.02Å; L232-L255 HydrophobicContact CD2-CD2 4.12Å; L232-S291 PolarHBondContact O-OG 3.3Å; L232-G292 PolarHBondContact O-N 2.8Å; L232-C293 HydrophobicContact CD2-CB 4.02Å; L232-L340 HydrophobicContact CD1-CB 4.11Å; L232-L340 HydrophobicContact CD1-CD1 3.57Å; L232-L340 HydrophobicContact CD1-CG 4.44Å
233	D	77.6	Confident	72.1	Confident	8 Å²	8	50.1 Å²	50.1	4%	0.043	27%	0.267	C	S	.	.			trans	-67.1	128.7	-176.9	-71.1	-3.2	0	0	0	110.1	Y61 N100	Y61-D233 PolarHBondContact OH-OD2 3.23Å; N100-D233 HydrophobicContact CB-CB 3.96Å; N100-D233 VanDerWaalsContact CB-O 3.23Å; N100-D233 WeakPolarHBondContact CB-O 3.45Å; N100-D233 PolarHBondContact ND2-O 2.92Å
234	T	90.9	Very high	74.6	Confident	2 Å²	2	45 Å²	45	1%	0.012	23%	0.231	C	C	.	.			trans	-141.2	160.1	169.6	71.3	0	0	0	0	108.6	H47 G49 L232 S252 T290 S291	H47-T234 PolarHBondContact CE1-O 3.29Å; H47-T234 PolarHBondContact ND1-O 3.48Å; H47-T234 VanDerWaalsContact ND1-O 3.07Å; G49-T234 WeakPolarHBondContact CA-O 3.46Å; G49-T234 PolarHBondContact N-O 3.01Å; L232-T234 PolarHBondContact O-N 3.02Å; T234-S252 VanDerWaalsContact CG2-OG 3.25Å; T234-S252 WeakPolarHBondContact CG2-OG 3.44Å; T234-T290 PolarHBondContact OG1-O 3.5Å; T234-S291 PolarHBondContact N-OG 3.13Å; T234-S291 WeakPolarHBondContact OG1-CA 3.46Å; T234-S291 WeakPolarHBondContact OG1-CB 3.46Å; T234-S291 PolarHBondContact OG1-OG 3.28Å
235	V	98.5	Very high	77.7	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	151.3	-178.3	-57	0	0	0	0	110.4	L90 L93 T99 A101 V250 S251	L90-V235 HydrophobicContact CD1-CB 4.5Å; L90-V235 HydrophobicContact CD1-CG2 3.73Å; L93-V235 HydrophobicContact CB-CB 3.76Å; L93-V235 HydrophobicContact CB-CG1 4.01Å; L93-V235 HydrophobicContact CB-CG2 3.84Å; L93-V235 HydrophobicContact CD1-CB 4.07Å; L93-V235 HydrophobicContact CG-CB 4.33Å; T99-V235 HydrophobicContact CG2-CG1 3.56Å; A101-V235 HydrophobicContact CB-CB 4.43Å; A101-V235 HydrophobicContact CB-CG1 4.26Å; A101-V235 HydrophobicContact CB-CG2 3.42Å; A101-V235 VanDerWaalsContact CB-CG2 3.42Å; V235-V250 CarbonylContact O-C 3.52Å; V235-V250 WeakPolarHBondContact O-CA 3.38Å; V235-V250 WeakPolarHBondContact O-CG2 3.15Å; V235-S251 PolarHBondContact N-O 3.11Å; V235-S251 PolarHBondContact O-N 3.06Å
236	G	98.8	Very high	80.7	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.9	165.1	-178.2	0	0	0	0	0	113.1	V46 H47 A249 S289	V46-G236 CarbonylContact C-O 3.55Å; V46-G236 VanDerWaalsContact CA-O 3.29Å; V46-G236 WeakPolarHBondContact CA-O 3.4Å; H47-G236 PolarHBondContact CE1-N 3.3Å; H47-G236 VanDerWaalsContact CE1-N 3.26Å; H47-G236 PolarHBondContact N-O 2.84Å; H47-G236 VanDerWaalsContact NE2-CA 3.33Å; H47-G236 WeakPolarHBondContact NE2-CA 3.14Å; H47-G236 PolarHBondContact NE2-N 3.19Å; H47-G236 PolarHBondContact O-N 3.36Å; G236-A249 CarbonylContact C-O 3.58Å; G236-A249 WeakPolarHBondContact CA-O 3.32Å; G236-S289 WeakPolarHBondContact CA-OG 3.23Å
237	A	98.9	Very high	83.5	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	152.3	-176.5	0	0	0	0	0	111.5	L45 V46 V86 A89 L90 A248 A249	L45-A237 CarbonylContact O-C 3.57Å; L45-A237 VanDerWaalsContact O-CA 3.3Å; L45-A237 WeakPolarHBondContact O-CA 3.24Å; V46-A237 HydrophobicContact CB-CB 4.26Å; V46-A237 HydrophobicContact CG1-CB 3.71Å; V86-A237 HydrophobicContact CG2-CB 3.62Å; V86-A237 VanDerWaalsContact CG2-O 3.28Å; V86-A237 WeakPolarHBondContact CG2-O 3.37Å; A89-A237 HydrophobicContact CB-CB 4.04Å; L90-A237 HydrophobicContact CD2-CB 3.4Å; A237-A248 WeakPolarHBondContact O-CA 3.16Å; A237-A249 PolarHBondContact N-O 3.41Å; A237-A249 PolarHBondContact O-N 3.4Å
238	V	98.9	Very high	86.1	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	137.9	170.7	-62.5	0	0	0	0	108.5	V44 L45 A247 A248 A287 I344 L346	V44-V238 WeakPolarHBondContact CA-O 3.34Å; L45-V238 HydrophobicContact CB-CG2 3.79Å; L45-V238 HydrophobicContact CD2-CG2 4.34Å; L45-V238 HydrophobicContact CG-CG2 4.3Å; L45-V238 PolarHBondContact N-O 3.35Å; L45-V238 PolarHBondContact O-N 2.78Å; V238-A247 WeakPolarHBondContact CA-O 3.34Å; V238-A248 HydrophobicContact CG1-CB 4.02Å; V238-A287 HydrophobicContact CB-CB 3.81Å; V238-A287 HydrophobicContact CG1-CB 3.9Å; V238-I344 HydrophobicContact CG1-CD1 4.34Å; V238-I344 HydrophobicContact CG1-CG1 4.18Å; V238-I344 HydrophobicContact CG2-CD1 4.13Å; V238-I344 HydrophobicContact CG2-CG1 4.27Å; V238-L346 HydrophobicContact CB-CB 4.11Å; V238-L346 HydrophobicContact CG2-CB 3.64Å; V238-L346 HydrophobicContact CG2-CD1 4.42Å
239	V	98.9	Very high	88.6	Confident	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	147	-174.5	172.5	0	0	0	0	109.8	F43 V44 A72 L76 A82 A85 V86 V246 A247	F43-V239 WeakPolarHBondContact O-CA 3.4Å; V44-V239 HydrophobicContact CB-CG2 4.06Å; V44-V239 HydrophobicContact CG2-CG2 3.73Å; A72-V239 HydrophobicContact CB-CG2 4.35Å; L76-V239 HydrophobicContact CD1-CG1 3.8Å; L76-V239 HydrophobicContact CD2-CG1 3.93Å; L76-V239 HydrophobicContact CG-CG1 4.29Å; A82-V239 HydrophobicContact CB-CG1 4.44Å; A85-V239 HydrophobicContact CB-CG1 4.11Å; V86-V239 HydrophobicContact CB-CB 4.31Å; V86-V239 HydrophobicContact CB-CG2 3.82Å; V86-V239 HydrophobicContact CG2-CG2 4.09Å; V239-V246 CarbonylContact O-C 3.49Å; V239-V246 WeakPolarHBondContact O-CA 3.32Å; V239-A247 PolarHBondContact N-O 3Å; V239-A247 PolarHBondContact O-N 3.07Å
240	V	98.7	Very high	91	Very high	0 Å²	0	11 Å²	11	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	133.6	162.4	66.2	0	0	0	0	109.8	G42 F43 N245 V246 L346 V366 L415	G42-V240 VanDerWaalsContact CA-O 3.31Å; G42-V240 WeakPolarHBondContact CA-O 3.39Å; F43-V240 HydrophobicContact CB-CG1 3.8Å; F43-V240 PolarHBondContact N-O 3.35Å; F43-V240 PolarHBondContact O-N 3.07Å; V240-N245 WeakPolarHBondContact CA-O 3.43Å; V240-V246 HydrophobicContact CB-CG1 3.96Å; V240-V246 HydrophobicContact CG2-CG1 3.82Å; V240-L346 HydrophobicContact CB-CD1 4.01Å; V240-L346 HydrophobicContact CB-CD2 3.79Å; V240-L346 HydrophobicContact CG1-CD1 3.77Å; V240-L346 HydrophobicContact CG1-CD2 4.03Å; V240-L346 HydrophobicContact CG1-CG 4.46Å; V240-L346 HydrophobicContact CG2-CD2 4.49Å; V240-V366 HydrophobicContact CG1-CG1 4.29Å; V240-V366 HydrophobicContact CG1-CG2 3.88Å; V240-L415 HydrophobicContact CG1-CD1 3.91Å
241	D	97.4	Very high	93.4	Very high	12 Å²	12	9 Å²	9	6%	0.064	5%	0.046	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	177.2	175.4	70.6	17.3	0	0	0	112.5	L76 E243 G244 N245 L364	L76-D241 HydrophobicContact CD2-CB 3.88Å; D241-E243 PolarHBondContact O-N 2.65Å; D241-E243 VanDerWaalsContact OD1-C 3.31Å; D241-E243 VanDerWaalsContact OD1-CA 3.3Å; D241-E243 WeakPolarHBondContact OD1-CA 3.29Å; D241-E243 WeakPolarHBondContact OD1-CB 3.5Å; D241-E243 PolarHBondContact OD1-N 2.82Å; D241-G244 PolarHBondContact O-N 2.85Å; D241-G244 PolarHBondContact OD1-N 2.96Å; D241-N245 PolarHBondContact N-O 2.95Å; D241-N245 PolarHBondContact OD1-N 2.93Å; D241-N245 PolarHBondContact OD1-ND2 2.85Å; D241-N245 WeakPolarHBondContact OD2-CB 3.25Å; D241-N245 PolarHBondContact OD2-ND2 2.75Å; D241-L364 WeakPolarHBondContact O-CD1 3.21Å
242	H	94.6	Very high	95.3	Very high	32 Å²	32	8.1 Å²	8.1	15%	0.148	4%	0.04	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-17	177.6	65.1	87.2	0	0	0	113.9	R40 G41 G244	R40-H242 PolarHBondContact NH1-NE2 2.86Å; G41-H242 WeakPolarHBondContact O-CB 3.34Å; G41-H242 PolarHBondContact O-N 3.21Å; H242-G244 VanDerWaalsContact C-N 3.35Å
243	E	94.9	Very high	96.8	Very high	85 Å²	85	7.4 Å²	7.4	40%	0.397	4%	0.037	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	0.1	175.9	-60.7	-176.1	-179.2	0	0	111.8	K123 D241 N245 R350	K123-E243 IonicContact NZ-OE2 3.8Å; K123-E243 PolarHBondContact NZ-OE2 3.32Å; D241-E243 PolarHBondContact O-N 2.65Å; D241-E243 VanDerWaalsContact OD1-C 3.31Å; D241-E243 VanDerWaalsContact OD1-CA 3.3Å; D241-E243 WeakPolarHBondContact OD1-CA 3.29Å; D241-E243 WeakPolarHBondContact OD1-CB 3.5Å; D241-E243 PolarHBondContact OD1-N 2.82Å; E243-N245 VanDerWaalsContact C-N 3.27Å; E243-N245 WeakPolarHBondContact CB-ND2 3.26Å; E243-N245 PolarHBondContact O-N 2.93Å; E243-N245 PolarHBondContact OE2-ND2 3.37Å; E243-N245 VanDerWaalsContact OE2-ND2 3.08Å; E243-R350 PolarHBondContact O-NH1 2.71Å; E243-R350 PolarHBondContact O-NH2 3.05Å
244	G	96.3	Very high	97.6	Very high	2 Å²	2	7.6 Å²	7.6	2%	0.021	4%	0.04	C	C	.	.			trans	74.4	16.6	-176.5	0	0	0	0	0	113.6	D241 H242 S285	D241-G244 PolarHBondContact O-N 2.85Å; D241-G244 PolarHBondContact OD1-N 2.96Å; H242-G244 VanDerWaalsContact C-N 3.35Å; G244-S285 PolarHBondContact O-OG 3.46Å
245	N	98.5	Very high	97.8	Very high	12 Å²	12	9.7 Å²	9.7	6%	0.064	5%	0.051	C	C	.	.			trans	-79.4	132	169.2	-49.7	-59.8	0	0	0	109	K123 V240 D241 E243 N277	K123-N245 HydrophobicContact CB-CB 4.43Å; K123-N245 WeakPolarHBondContact CD-OD1 3.43Å; V240-N245 WeakPolarHBondContact CA-O 3.43Å; D241-N245 PolarHBondContact N-O 2.95Å; D241-N245 PolarHBondContact OD1-N 2.93Å; D241-N245 PolarHBondContact OD1-ND2 2.85Å; D241-N245 WeakPolarHBondContact OD2-CB 3.25Å; D241-N245 PolarHBondContact OD2-ND2 2.75Å; E243-N245 VanDerWaalsContact C-N 3.27Å; E243-N245 WeakPolarHBondContact CB-ND2 3.26Å; E243-N245 PolarHBondContact O-N 2.93Å; E243-N245 PolarHBondContact OE2-ND2 3.37Å; E243-N245 VanDerWaalsContact OE2-ND2 3.08Å; N245-N277 WeakPolarHBondContact CA-OD1 3.15Å; N245-N277 PolarHBondContact OD1-ND2 2.78Å
246	V	98.9	Very high	97.6	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	149.9	179.8	-62.5	0	0	0	0	111.7	G122 V239 V240 A275 N277 T286 A287 L346	G122-V246 WeakPolarHBondContact CA-O 3.28Å; G122-V246 PolarHBondContact N-O 2.87Å; V239-V246 CarbonylContact O-C 3.49Å; V239-V246 WeakPolarHBondContact O-CA 3.32Å; V240-V246 HydrophobicContact CB-CG1 3.96Å; V240-V246 HydrophobicContact CG2-CG1 3.82Å; V246-A275 HydrophobicContact CG2-CB 4.4Å; V246-N277 WeakPolarHBondContact CG2-OD1 3.2Å; V246-N277 PolarHBondContact N-OD1 3.2Å; V246-T286 WeakPolarHBondContact CG2-O 3.31Å; V246-A287 HydrophobicContact CB-CB 3.96Å; V246-A287 HydrophobicContact CG2-CB 4.31Å; V246-L346 HydrophobicContact CG1-CD2 3.85Å
247	A	98.9	Very high	97.4	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	150.3	172.1	0	0	0	0	0	110.3	A82 T83 V86 M120 V238 V239	A82-A247 HydrophobicContact CB-CB 3.78Å; T83-A247 HydrophobicContact CG2-CB 4.24Å; V86-A247 HydrophobicContact CB-CB 4.41Å; V86-A247 HydrophobicContact CG1-CB 3.92Å; M120-A247 WeakPolarHBondContact O-CA 3.44Å; V238-A247 WeakPolarHBondContact CA-O 3.34Å; V239-A247 PolarHBondContact N-O 3Å; V239-A247 PolarHBondContact O-N 3.07Å
248	A	98.9	Very high	97.2	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	144.7	178.5	0	0	0	0	0	110.7	I119 M120 A237 V238 C273 W274 A275 A287 V288	I119-A248 CarbonylContact C-O 3.54Å; I119-A248 WeakPolarHBondContact CA-O 3.22Å; I119-A248 WeakPolarHBondContact CG1-O 3.47Å; M120-A248 PolarHBondContact N-O 2.82Å; M120-A248 PolarHBondContact O-N 3.37Å; M120-A248 VanDerWaalsContact O-N 3.14Å; A237-A248 WeakPolarHBondContact O-CA 3.16Å; V238-A248 HydrophobicContact CG1-CB 4.02Å; A248-C273 HydrophobicContact CB-CB 3.93Å; A248-W274 WeakPolarHBondContact CB-O 3.43Å; A248-A275 HydrophobicContact CB-CB 4.14Å; A248-A287 HydrophobicContact CB-CB 4.13Å; A248-V288 WeakPolarHBondContact CB-O 3.27Å
249	A	98.9	Very high	97.2	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	152.1	174.2	0	0	0	0	0	111.7	V86 L90 S118 I119 V140 G236 A237 S289	V86-A249 HydrophobicContact CG1-CB 4.06Å; V86-A249 HydrophobicContact CG2-CB 3.94Å; L90-A249 HydrophobicContact CD2-CB 3.93Å; L90-A249 HydrophobicContact CG-CB 3.92Å; S118-A249 CarbonylContact O-C 3.45Å; S118-A249 VanDerWaalsContact O-CA 3.24Å; S118-A249 WeakPolarHBondContact O-CA 3.47Å; S118-A249 WeakPolarHBondContact O-CB 3.27Å; I119-A249 HydrophobicContact CB-CB 3.92Å; I119-A249 HydrophobicContact CD1-CB 4.33Å; I119-A249 HydrophobicContact CG1-CB 3.97Å; V140-A249 HydrophobicContact CG2-CB 4.18Å; G236-A249 CarbonylContact C-O 3.58Å; G236-A249 WeakPolarHBondContact CA-O 3.32Å; A237-A249 PolarHBondContact N-O 3.41Å; A237-A249 PolarHBondContact O-N 3.4Å; A249-S289 PolarHBondContact O-OG 2.93Å
250	V	98.9	Very high	97.2	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	147.4	178.5	65.1	0	0	0	0	110.3	A117 S118 V235 A266 C273 T290	A117-V250 VanDerWaalsContact CA-O 3.26Å; A117-V250 WeakPolarHBondContact CA-O 3.43Å; A117-V250 WeakPolarHBondContact CB-O 3.4Å; S118-V250 PolarHBondContact N-O 3.44Å; S118-V250 PolarHBondContact O-N 3.05Å; S118-V250 WeakPolarHBondContact OG-CG1 3.37Å; V235-V250 CarbonylContact O-C 3.52Å; V235-V250 WeakPolarHBondContact O-CA 3.38Å; V235-V250 WeakPolarHBondContact O-CG2 3.15Å; V250-A266 HydrophobicContact CG1-CB 4.02Å; V250-A266 WeakPolarHBondContact CG1-O 3.37Å; V250-A266 HydrophobicContact CG2-CB 4.14Å; V250-C273 HydrophobicContact CB-CB 4.43Å; V250-C273 HydrophobicContact CG1-CB 4.12Å; V250-T290 WeakPolarHBondContact CG2-O 3.43Å
251	S	98.8	Very high	97.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	144.9	175.9	-172.3	0	0	0	0	111.6	E94 D116 V235	E94-S251 WeakPolarHBondContact OE1-CB 3.23Å; E94-S251 PolarHBondContact OE1-OG 3.19Å; D116-S251 CarbonylContact O-C 3.51Å; D116-S251 WeakPolarHBondContact O-CA 3.35Å; V235-S251 PolarHBondContact N-O 3.11Å; V235-S251 PolarHBondContact O-N 3.06Å
252	S	98.4	Very high	97.2	Very high	2 Å²	2	25 Å²	25	1%	0.014	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	147.3	-173.7	-176.8	0	0	0	0	112.7	N100 C115 D116 T234 G254	N100-S252 CarbonylContact O-C 3.58Å; N100-S252 WeakPolarHBondContact O-CA 3.48Å; C115-S252 CarbonylContact C-O 3.58Å; C115-S252 VanDerWaalsContact CA-O 3.29Å; C115-S252 WeakPolarHBondContact CA-O 3.45Å; D116-S252 PolarHBondContact N-O 3.44Å; D116-S252 PolarHBondContact O-N 2.74Å; T234-S252 VanDerWaalsContact CG2-OG 3.25Å; T234-S252 WeakPolarHBondContact CG2-OG 3.44Å; S252-G254 VanDerWaalsContact C-N 3.35Å; S252-G254 PolarHBondContact OG-N 2.94Å
253	G	97.3	Very high	97.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.144	C	C	.	.			trans	-84.3	-9.4	163.3	0	0	0	0	0	113.7	N100 S105 E114 K258	N100-G253 PolarHBondContact O-N 3.49Å; N100-G253 WeakPolarHBondContact OD1-CA 3.2Å; S105-G253 VanDerWaalsContact OG-CA 3.32Å; S105-G253 WeakPolarHBondContact OG-CA 3.33Å; E114-G253 VanDerWaalsContact O-O 3.12Å; G253-K258 WeakPolarHBondContact O-CE 3.41Å; G253-K258 PolarHBondContact O-NZ 3.09Å; G253-K258 VanDerWaalsContact O-NZ 3.08Å
254	G	95.9	Very high	97.5	Very high	11 Å²	11	21.8 Å²	21.8	11%	0.113	13%	0.128	C	C	.	.			trans	75.5	-169.2	-173.7	0	0	0	0	0	113.3	N100 N106 S252	N100-G254 PolarHBondContact ND2-O 2.92Å; N106-G254 PolarHBondContact ND2-O 2.87Å; S252-G254 VanDerWaalsContact C-N 3.35Å; S252-G254 PolarHBondContact OG-N 2.94Å
255	L	94.3	Very high	97.7	Very high	47 Å²	47	21.9 Å²	21.9	25%	0.246	13%	0.128	C	C	.	.	S	Bend	trans	-67.9	145.7	179.9	-59.6	-173.2	0	0	0	111.1	L232 K258 R262	L232-L255 HydrophobicContact CD2-CD2 4.12Å; L255-K258 WeakPolarHBondContact O-CB 3.45Å; L255-K258 PolarHBondContact O-N 2.92Å; L255-R262 VanDerWaalsContact CB-NH1 3.28Å; L255-R262 VanDerWaalsContact CD1-NH2 3.35Å
256	A	93.6	Very high	97.7	Very high	19 Å²	19	21.3 Å²	21.3	16%	0.157	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	141.4	167.1	0	0	0	0	0	111	N106 T231 K258	N106-A256 HydrophobicContact CB-CB 4.23Å; T231-A256 HydrophobicContact CG2-CB 3.89Å; A256-K258 PolarHBondContact O-N 3.46Å; A256-K258 VanDerWaalsContact O-N 3.11Å
257	L	94.9	Very high	97.7	Very high	31 Å²	31	21.4 Å²	21.4	16%	0.162	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	22.4	-178.3	-55.5	-178.9	0	0	0	114.6	L107 F196 N199 K200 L203	L107-L257 PolarHBondContact O-N 2.9Å; F196-L257 HydrophobicContact CD2-CD2 3.48Å; F196-L257 VanDerWaalsContact CD2-CD2 3.48Å; F196-L257 HydrophobicContact CE2-CD2 3.45Å; F196-L257 VanDerWaalsContact CE2-CD2 3.45Å; N199-L257 HydrophobicContact CB-CD1 3.65Å; N199-L257 HydrophobicContact CB-CG 4.05Å; K200-L257 HydrophobicContact CB-CD2 4.47Å; L203-L257 HydrophobicContact CB-CD1 4.32Å; L203-L257 HydrophobicContact CD2-CD1 4.23Å
258	K	95.9	Very high	97.7	Very high	8 Å²	8	23.9 Å²	23.9	4%	0.035	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-54.5	148.1	172.6	69.5	-178.6	-174.6	-179.5	0	110.5	N108 L109 E114 D116 G253 L255 A256 R262	N108-K258 HydrophobicContact CB-CG 3.9Å; N108-K258 WeakPolarHBondContact CB-O 3.49Å; L109-K258 PolarHBondContact N-O 3.24Å; E114-K258 WeakPolarHBondContact O-CE 3.28Å; E114-K258 PolarHBondContact O-NZ 3.43Å; D116-K258 IonicContact OD2-NZ 3.41Å; G253-K258 WeakPolarHBondContact O-CE 3.41Å; G253-K258 PolarHBondContact O-NZ 3.09Å; G253-K258 VanDerWaalsContact O-NZ 3.08Å; L255-K258 WeakPolarHBondContact O-CB 3.45Å; L255-K258 PolarHBondContact O-N 2.92Å; A256-K258 PolarHBondContact O-N 3.46Å; A256-K258 VanDerWaalsContact O-N 3.11Å; K258-R262 HydrophobicContact CB-CB 4.26Å; K258-R262 HydrophobicContact CD-CB 4.27Å; K258-R262 HydrophobicContact CG-CB 4.49Å; K258-R262 PolarHBondContact NZ-O 2.78Å
259	H	98.1	Very high	97.7	Very high	137 Å²	137	29.5 Å²	29.5	63%	0.634	16%	0.161	S	C	*	.	P	Polyproline II helix	trans	-59.3	137.9	168.5	-170.1	-74.1	0	0	0	109.3	R262	H259-R262 WeakPolarHBondContact O-CB 3.34Å; H259-R262 PolarHBondContact O-N 3.01Å
260	P	98.5	Very high	97.7	Very high	35 Å²	35	29.6 Å²	29.6	23%	0.227	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	140.5	175	-26.4	33.5	0	0	0	112.4	L110 E114 R262	L110-P260 HydrophobicContact CB-CG 4.48Å; L110-P260 HydrophobicContact CD1-CB 4.31Å; L110-P260 HydrophobicContact CD1-CG 3.52Å; L110-P260 HydrophobicContact CG-CG 3.58Å; E114-P260 VanDerWaalsContact OE2-CA 3.3Å; E114-P260 WeakPolarHBondContact OE2-CA 3.41Å; P260-R262 PolarHBondContact O-N 2.8Å
261	G	98.1	Very high	97.6	Very high	46 Å²	46	30 Å²	30	47%	0.474	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	1.1	-175.6	0	0	0	0	0	115.2	E114 V263	E114-G261 PolarHBondContact OE1-N 2.93Å; E114-G261 PolarHBondContact OE2-N 3Å; G261-V263 PolarHBondContact O-N 2.92Å
262	R	98.5	Very high	97.6	Very high	58 Å²	58	30 Å²	30	22%	0.219	16%	0.164	C	C	.	.			trans	-69.7	124	171.4	175.2	167.5	169	-121	4.3	110.6	L255 K258 H259 P260 E295	L255-R262 VanDerWaalsContact CB-NH1 3.28Å; L255-R262 VanDerWaalsContact CD1-NH2 3.35Å; K258-R262 HydrophobicContact CB-CB 4.26Å; K258-R262 HydrophobicContact CD-CB 4.27Å; K258-R262 HydrophobicContact CG-CB 4.49Å; K258-R262 PolarHBondContact NZ-O 2.78Å; H259-R262 WeakPolarHBondContact O-CB 3.34Å; H259-R262 PolarHBondContact O-N 3.01Å; P260-R262 PolarHBondContact O-N 2.8Å; R262-E295 IonicContact CZ-OE1 2.78Å; R262-E295 VanDerWaalsContact CZ-OE1 3.32Å; R262-E295 IonicContact NE-OE1 3.09Å; R262-E295 PolarHBondContact NE-OE1 3.1Å; R262-E295 IonicContact NH2-OE1 2.9Å; R262-E295 PolarHBondContact NH2-OE1 3.4Å
263	V	98.8	Very high	97.7	Very high	42 Å²	42	29.9 Å²	29.9	26%	0.255	16%	0.164	S	C	.	.			trans	-107.1	129.4	177.3	179.3	0	0	0	0	109.8	A132 F164 G261 A267	A132-V263 HydrophobicContact CB-CG2 4.17Å; F164-V263 HydrophobicContact CZ-CG1 4.33Å; G261-V263 PolarHBondContact O-N 2.92Å; V263-A267 HydrophobicContact CG1-CB 3.54Å
264	G	98.1	Very high	97.8	Very high	7 Å²	7	30.3 Å²	30.3	7%	0.072	17%	0.165	C	C	.	.			trans	-97.3	-169.6	176.2	0	0	0	0	0	114.1	D116 A266 A267	D116-G264 PolarHBondContact OD2-N 3.31Å; G264-A266 PolarHBondContact O-N 3.35Å; G264-A267 PolarHBondContact O-N 3.03Å
265	Q	98.7	Very high	97.9	Very high	5 Å²	5	29.8 Å²	29.8	2%	0.023	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-60	-30.7	-177.4	89.9	-67.1	-0	0	0	113.5	A267 L268 C271 G272 L297 V298	Q265-A267 PolarHBondContact O-N 2.89Å; Q265-A267 VanDerWaalsContact O-N 3.11Å; Q265-L268 PolarHBondContact O-N 2.95Å; Q265-C271 HydrophobicContact CB-CB 4.08Å; Q265-G272 VanDerWaalsContact O-CA 3.23Å; Q265-G272 WeakPolarHBondContact O-CA 3.15Å; Q265-G272 PolarHBondContact O-N 3.19Å; Q265-G272 VanDerWaalsContact O-N 3.11Å; Q265-L297 HydrophobicContact CB-CB 3.84Å; Q265-L297 HydrophobicContact CB-CD1 4.44Å; Q265-L297 HydrophobicContact CG-CB 3.91Å; Q265-L297 HydrophobicContact CG-CD1 3.64Å; Q265-L297 HydrophobicContact CG-CG 4.43Å; Q265-V298 HydrophobicContact CB-CG2 3.65Å
266	A	98.8	Very high	98.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-64.9	-17.9	-172	0	0	0	0	0	113.2	D116 A117 S118 V250 G264	D116-A266 HydrophobicContact CB-CB 3.93Å; D116-A266 WeakPolarHBondContact O-CB 3.47Å; A117-A266 CarbonylContact C-O 3.43Å; A117-A266 WeakPolarHBondContact CA-O 3.35Å; S118-A266 WeakPolarHBondContact CB-O 3.41Å; S118-A266 PolarHBondContact N-O 2.79Å; S118-A266 PolarHBondContact OG-O 3.3Å; V250-A266 HydrophobicContact CG1-CB 4.02Å; V250-A266 WeakPolarHBondContact CG1-O 3.37Å; V250-A266 HydrophobicContact CG2-CB 4.14Å; G264-A266 PolarHBondContact O-N 3.35Å
267	A	98.8	Very high	98.4	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.008	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-99.5	-12	174.1	0	0	0	0	0	113.7	D116 A129 V130 F164 V263 G264 Q265	D116-A267 HydrophobicContact CB-CB 3.97Å; A129-A267 WeakPolarHBondContact CB-O 3.36Å; V130-A267 WeakPolarHBondContact O-CB 3.23Å; F164-A267 HydrophobicContact CE2-CB 3.76Å; F164-A267 HydrophobicContact CZ-CB 4.07Å; V263-A267 HydrophobicContact CG1-CB 3.54Å; G264-A267 PolarHBondContact O-N 3.03Å; Q265-A267 PolarHBondContact O-N 2.89Å; Q265-A267 VanDerWaalsContact O-N 3.11Å
268	L	98.9	Very high	98.5	Very high	52 Å²	52	32.3 Å²	32.3	27%	0.272	17%	0.173	S	C	.	.	S	Bend	trans	-96.6	126.5	-167.8	-65.3	177.1	0	0	0	111.6	Q265 G270 C271 G272 V298	Q265-L268 PolarHBondContact O-N 2.95Å; L268-G270 PolarHBondContact O-N 3.03Å; L268-C271 HydrophobicContact CB-CB 3.96Å; L268-C271 WeakPolarHBondContact O-CB 3.42Å; L268-C271 PolarHBondContact O-N 2.95Å; L268-G272 PolarHBondContact O-N 2.92Å; L268-V298 HydrophobicContact CD1-CB 4.37Å; L268-V298 HydrophobicContact CD1-CG1 3.86Å; L268-V298 HydrophobicContact CD1-CG2 3.51Å
269	Y	98.9	Very high	98.6	Very high	119 Å²	119	34 Å²	34	47%	0.467	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	131.7	177.7	-174.9	-110.4	0	0	0	111.5	M120 F127 C271 W274	M120-Y269 HydrophobicContact CE-CE2 3.83Å; M120-Y269 WeakPolarHBondContact CE-OH 3.01Å; M120-Y269 HydrophobicContact SD-CE2 3.93Å; F127-Y269 HydrophobicContact CB-CD2 3.96Å; F127-Y269 HydrophobicContact CB-CE2 3.94Å; F127-Y269 AromaticContact CD1-CD2 3.86Å; F127-Y269 HydrophobicContact CD1-CD2 3.86Å; F127-Y269 AromaticContact CD2-CD2 3.62Å; F127-Y269 HydrophobicContact CD2-CD2 3.62Å; F127-Y269 HydrophobicContact CD2-CE2 4.16Å; F127-Y269 HydrophobicContact CE1-CD2 4.16Å; F127-Y269 AromaticContact CE2-CD2 3.94Å; F127-Y269 HydrophobicContact CE2-CD2 3.94Å; F127-Y269 AromaticContact CG-CD2 3.55Å; F127-Y269 HydrophobicContact CG-CD2 3.55Å; F127-Y269 HydrophobicContact CG-CE2 4.03Å; F127-Y269 HydrophobicContact CZ-CD2 4.19Å; Y269-C271 PolarHBondContact O-N 3Å; Y269-W274 HydrophobicContact CD1-CZ3 4.16Å; Y269-W274 HydrophobicContact CD2-CZ3 4.36Å; Y269-W274 AromaticContact CE1-CH2 3.8Å; Y269-W274 HydrophobicContact CE1-CH2 3.8Å; Y269-W274 AromaticContact CE1-CZ3 3.53Å; Y269-W274 HydrophobicContact CE1-CZ3 3.53Å; Y269-W274 HydrophobicContact CE2-CE3 4.45Å; Y269-W274 HydrophobicContact CE2-CH2 4.35Å; Y269-W274 AromaticContact CE2-CZ3 3.76Å; Y269-W274 HydrophobicContact CE2-CZ3 3.76Å; Y269-W274 AromaticContact CZ-CH2 3.54Å; Y269-W274 AromaticContact CZ-CZ3 3.31Å; Y269-W274 WeakPolarHBondContact OH-CH2 3.14Å; Y269-W274 WeakPolarHBondContact OH-CZ3 3.15Å
270	G	98.8	Very high	98.4	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.01	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	-11	-178.2	0	0	0	0	0	115.6	L268 I301 A303 R304	L268-G270 PolarHBondContact O-N 3.03Å; G270-I301 CarbonylContact O-C 3.59Å; G270-I301 VanDerWaalsContact O-CG2 3.29Å; G270-I301 WeakPolarHBondContact O-CG2 3.35Å; G270-A303 WeakPolarHBondContact O-CB 3.5Å; G270-A303 PolarHBondContact O-N 3.46Å; G270-R304 PolarHBondContact O-N 3.23Å
271	C	98.9	Very high	98.2	Very high	9 Å²	9	39.2 Å²	39.2	6%	0.061	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-52.8	-175.7	-52.6	0	0	0	0	111.6	Q265 L268 Y269 T290 V298 A303	Q265-C271 HydrophobicContact CB-CB 4.08Å; L268-C271 HydrophobicContact CB-CB 3.96Å; L268-C271 WeakPolarHBondContact O-CB 3.42Å; L268-C271 PolarHBondContact O-N 2.95Å; Y269-C271 PolarHBondContact O-N 3Å; C271-T290 WeakPolarHBondContact O-CG2 3.08Å; C271-T290 PolarHBondContact O-OG1 3.4Å; C271-V298 HydrophobicContact CB-CG2 4.28Å; C271-A303 WeakPolarHBondContact O-CB 3.42Å
272	G	98.8	Very high	98.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.21	C	C	.	.	S	Bend	trans	-78.8	-49.7	-175.3	0	0	0	0	0	113.7	Q265 L268 T290	Q265-G272 VanDerWaalsContact O-CA 3.23Å; Q265-G272 WeakPolarHBondContact O-CA 3.15Å; Q265-G272 PolarHBondContact O-N 3.19Å; Q265-G272 VanDerWaalsContact O-N 3.11Å; L268-G272 PolarHBondContact O-N 2.92Å; G272-T290 PolarHBondContact O-N 2.8Å; G272-T290 PolarHBondContact O-OG1 2.97Å; G272-T290 VanDerWaalsContact O-OG1 3.11Å
273	C	98.9	Very high	98	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	162.8	176.1	67	0	0	0	0	111.7	A248 V250 V288	A248-C273 HydrophobicContact CB-CB 3.93Å; V250-C273 HydrophobicContact CB-CB 4.43Å; V250-C273 HydrophobicContact CG1-CB 4.12Å; C273-V288 CarbonylContact C-O 3.55Å; C273-V288 WeakPolarHBondContact CA-O 3.37Å; C273-V288 WeakPolarHBondContact CB-O 3.4Å
274	W	98.9	Very high	98	Very high	9 Å²	9	38.5 Å²	38.5	3%	0.034	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	143	173.3	-165.7	-97.2	0	0	0	110.2	M120 A248 Y269 E276 A287 V288 A303 R304	M120-W274 HydrophobicContact CE-CD2 4.11Å; M120-W274 HydrophobicContact CE-CE3 4.07Å; M120-W274 HydrophobicContact CE-CH2 4.07Å; M120-W274 HydrophobicContact CE-CZ2 4.05Å; M120-W274 HydrophobicContact CE-CZ3 4.07Å; M120-W274 HydrophobicContact SD-CD2 3.83Å; M120-W274 HydrophobicContact SD-CE3 3.66Å; M120-W274 HydrophobicContact SD-CG 4.26Å; M120-W274 HydrophobicContact SD-CZ3 4.15Å; A248-W274 WeakPolarHBondContact CB-O 3.43Å; Y269-W274 HydrophobicContact CD1-CZ3 4.16Å; Y269-W274 HydrophobicContact CD2-CZ3 4.36Å; Y269-W274 AromaticContact CE1-CH2 3.8Å; Y269-W274 HydrophobicContact CE1-CH2 3.8Å; Y269-W274 AromaticContact CE1-CZ3 3.53Å; Y269-W274 HydrophobicContact CE1-CZ3 3.53Å; Y269-W274 HydrophobicContact CE2-CE3 4.45Å; Y269-W274 HydrophobicContact CE2-CH2 4.35Å; Y269-W274 AromaticContact CE2-CZ3 3.76Å; Y269-W274 HydrophobicContact CE2-CZ3 3.76Å; Y269-W274 AromaticContact CZ-CH2 3.54Å; Y269-W274 AromaticContact CZ-CZ3 3.31Å; Y269-W274 WeakPolarHBondContact OH-CH2 3.14Å; Y269-W274 WeakPolarHBondContact OH-CZ3 3.15Å; W274-E276 PolarHBondContact NE1-OE2 3.4Å; W274-A287 CarbonylContact O-C 3.45Å; W274-A287 VanDerWaalsContact O-CA 3.28Å; W274-A287 WeakPolarHBondContact O-CA 3.35Å; W274-V288 HydrophobicContact CB-CB 4.46Å; W274-V288 PolarHBondContact N-O 2.98Å; W274-V288 PolarHBondContact O-N 3.21Å; W274-A303 HydrophobicContact CB-CB 4.15Å; W274-R304 HydrophobicContact CD2-CB 4.12Å; W274-R304 HydrophobicContact CD2-CG 4Å; W274-R304 HydrophobicContact CE3-CB 3.97Å; W274-R304 HydrophobicContact CE3-CG 4.04Å; W274-R304 HydrophobicContact CH2-CG 3.97Å; W274-R304 HydrophobicContact CZ2-CG 3.98Å; W274-R304 HydrophobicContact CZ3-CB 4.27Å; W274-R304 HydrophobicContact CZ3-CG 4Å
275	A	98.9	Very high	98	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	129.9	170.9	0	0	0	0	0	109.8	M120 G122 V246 A248 T286 A287	M120-A275 HydrophobicContact CB-CB 4.05Å; M120-A275 WeakPolarHBondContact CE-O 3.39Å; M120-A275 HydrophobicContact CG-CB 4.22Å; M120-A275 WeakPolarHBondContact O-CB 3.45Å; M120-A275 PolarHBondContact SD-N 3.05Å; G122-A275 WeakPolarHBondContact CA-O 3.36Å; V246-A275 HydrophobicContact CG2-CB 4.4Å; A248-A275 HydrophobicContact CB-CB 4.14Å; A275-T286 CarbonylContact C-O 3.07Å; A275-T286 WeakPolarHBondContact CA-O 3.4Å; A275-A287 HydrophobicContact CB-CB 4.47Å
276	E	98.9	Very high	98	Very high	47 Å²	47	38.2 Å²	38.2	22%	0.22	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	119.4	-177.2	-165.8	173.9	168.7	0	0	109.3	L125 W274 N282 S285 T286	L125-E276 HydrophobicContact CD2-CB 4.3Å; L125-E276 HydrophobicContact CD2-CG 3.79Å; W274-E276 PolarHBondContact NE1-OE2 3.4Å; E276-N282 WeakPolarHBondContact CG-ND2 3.33Å; E276-N282 PolarHBondContact O-ND2 3.04Å; E276-S285 CarbonylContact O-C 3.58Å; E276-S285 VanDerWaalsContact O-CA 3.29Å; E276-S285 WeakPolarHBondContact O-CA 3.12Å; E276-T286 PolarHBondContact N-O 3.02Å; E276-T286 PolarHBondContact O-N 3.01Å
277	N	98.8	Very high	98	Very high	26 Å²	26	38.2 Å²	38.2	14%	0.139	22%	0.217	C	C	.	.			trans	-71.5	164.3	175	-80.4	11.3	0	0	0	111.3	G122 K123 N245 V246 G279 N282 S285	G122-N277 VanDerWaalsContact C-CG 3.42Å; G122-N277 VanDerWaalsContact C-OD1 3.31Å; G122-N277 VanDerWaalsContact O-CB 3.23Å; G122-N277 WeakPolarHBondContact O-CB 3.42Å; G122-N277 PolarHBondContact O-N 3.16Å; K123-N277 WeakPolarHBondContact CA-ND2 3.38Å; N245-N277 WeakPolarHBondContact CA-OD1 3.15Å; N245-N277 PolarHBondContact OD1-ND2 2.78Å; V246-N277 WeakPolarHBondContact CG2-OD1 3.2Å; V246-N277 PolarHBondContact N-OD1 3.2Å; N277-G279 PolarHBondContact O-N 3.2Å; N277-N282 PolarHBondContact O-ND2 3.23Å; N277-S285 WeakPolarHBondContact CA-OG 3.21Å
278	T	98.3	Very high	98.1	Very high	77 Å²	77	38.1 Å²	38.1	47%	0.472	22%	0.216	S	C	.	.			trans	-48.5	134.1	169.4	-61.5	0	0	0	0	111.8	N282 P283 S285	T278-N282 CarbonylContact C-O 3.51Å; T278-N282 WeakPolarHBondContact CA-O 3.48Å; T278-N282 WeakPolarHBondContact CG2-O 3.39Å; T278-P283 WeakPolarHBondContact CG2-O 3.48Å; T278-P283 PolarHBondContact OG1-O 2.99Å; T278-S285 PolarHBondContact N-OG 3.25Å; T278-S285 PolarHBondContact OG1-N 2.92Å; T278-S285 PolarHBondContact OG1-OG 3.36Å
279	G	96.4	Very high	98.1	Very high	42 Å²	42	35.7 Å²	35.7	43%	0.433	20%	0.203	S	C	.	.	B	Isolated β-bridge	trans	-151.6	-175	179.3	0	0	0	0	0	111.8	N277 H281 N282	N277-G279 PolarHBondContact O-N 3.2Å; G279-H281 PolarHBondContact O-N 3.02Å; G279-H281 VanDerWaalsContact O-N 3.15Å; G279-N282 PolarHBondContact N-O 2.98Å; G279-N282 CarbonylContact O-C 3.52Å; G279-N282 PolarHBondContact O-N 3.44Å; G279-N282 VanDerWaalsContact O-N 3.09Å; G279-N282 VanDerWaalsContact O-O 3.12Å
280	A	94.6	Very high	98.1	Very high	102 Å²	102	30 Å²	30	84%	0.843	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-32.1	-173.7	0	0	0	0	0	114.4
281	H	95.1	Very high	98	Very high	181 Å²	181	30 Å²	30	84%	0.838	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.7	12	178.3	-55.8	-50.4	0	0	0	112.5	G279	G279-H281 PolarHBondContact O-N 3.02Å; G279-H281 VanDerWaalsContact O-N 3.15Å
282	N	94.9	Very high	97.9	Very high	8 Å²	8	29.7 Å²	29.7	4%	0.043	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-131.2	83.9	-176.1	-162.4	40.5	0	0	0	108	E276 N277 T278 G279 Y284 Q311	E276-N282 WeakPolarHBondContact CG-ND2 3.33Å; E276-N282 PolarHBondContact O-ND2 3.04Å; N277-N282 PolarHBondContact O-ND2 3.23Å; T278-N282 CarbonylContact C-O 3.51Å; T278-N282 WeakPolarHBondContact CA-O 3.48Å; T278-N282 WeakPolarHBondContact CG2-O 3.39Å; G279-N282 PolarHBondContact N-O 2.98Å; G279-N282 CarbonylContact O-C 3.52Å; G279-N282 PolarHBondContact O-N 3.44Å; G279-N282 VanDerWaalsContact O-N 3.09Å; G279-N282 VanDerWaalsContact O-O 3.12Å; N282-Y284 PolarHBondContact ND2-O 3.1Å; N282-Y284 PolarHBondContact O-N 3.38Å; N282-Q311 WeakPolarHBondContact OD1-CG 3.4Å; N282-Q311 PolarHBondContact OD1-NE2 2.74Å; N282-Q311 PolarHBondContact OD1-OE1 3.32Å
283	P	97	Very high	97.8	Very high	75 Å²	75	30.5 Å²	30.5	49%	0.487	19%	0.185	S	C	.	.	S	Bend	trans	-59	-30.3	-175.4	-26	34.6	0	0	0	113.6	T278 Q311	T278-P283 WeakPolarHBondContact CG2-O 3.48Å; T278-P283 PolarHBondContact OG1-O 2.99Å; P283-Q311 VanDerWaalsContact CD-OE1 3.25Å
284	Y	98.5	Very high	97.7	Very high	47 Å²	47	30.7 Å²	30.7	18%	0.184	19%	0.187	C	C	.	.	S	Bend	trans	-114.6	144.3	-177.9	-54.8	-85.9	0	0	0	111.5	N282 T286 Q311 R347 C349	N282-Y284 PolarHBondContact ND2-O 3.1Å; N282-Y284 PolarHBondContact O-N 3.38Å; Y284-T286 PolarHBondContact O-N 3.08Å; Y284-Q311 VanDerWaalsContact N-OE1 3.08Å; Y284-R347 HydrophobicContact CD1-CG 3.91Å; Y284-R347 HydrophobicContact CG-CG 3.75Å; Y284-C349 HydrophobicContact CD1-CB 3.86Å; Y284-C349 HydrophobicContact CE1-CB 4.22Å
285	S	98.8	Very high	97.6	Very high	6 Å²	6	34 Å²	34	4%	0.042	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	121.8	162.7	-66.5	0	0	0	0	108.6	G244 E276 N277 T278 R347 S348	G244-S285 PolarHBondContact O-OG 3.46Å; E276-S285 CarbonylContact O-C 3.58Å; E276-S285 VanDerWaalsContact O-CA 3.29Å; E276-S285 WeakPolarHBondContact O-CA 3.12Å; N277-S285 WeakPolarHBondContact CA-OG 3.21Å; T278-S285 PolarHBondContact N-OG 3.25Å; T278-S285 PolarHBondContact OG1-N 2.92Å; T278-S285 PolarHBondContact OG1-OG 3.36Å; S285-R347 CarbonylContact O-C 3.57Å; S285-R347 WeakPolarHBondContact O-CA 3.3Å; S285-S348 PolarHBondContact N-O 3.2Å; S285-S348 PolarHBondContact O-N 3.08Å
286	T	98.9	Very high	97.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	140.6	-176.2	46.5	0	0	0	0	112.4	V246 A275 E276 Y284 S307 L310 Q311 L346 R347	V246-T286 WeakPolarHBondContact CG2-O 3.31Å; A275-T286 CarbonylContact C-O 3.07Å; A275-T286 WeakPolarHBondContact CA-O 3.4Å; E276-T286 PolarHBondContact N-O 3.02Å; E276-T286 PolarHBondContact O-N 3.01Å; Y284-T286 PolarHBondContact O-N 3.08Å; T286-S307 PolarHBondContact OG1-OG 3.18Å; T286-L310 HydrophobicContact CG2-CB 3.95Å; T286-L310 HydrophobicContact CG2-CD1 4.41Å; T286-Q311 VanDerWaalsContact CG2-NE2 3.25Å; T286-Q311 PolarHBondContact OG1-NE2 2.88Å; T286-L346 CarbonylContact C-O 3.56Å; T286-L346 WeakPolarHBondContact CA-O 3.41Å; T286-R347 HydrophobicContact CG2-CB 4.25Å; T286-R347 HydrophobicContact CG2-CG 3.98Å
287	A	98.9	Very high	97.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	137.6	172.5	0	0	0	0	0	110.7	V238 V246 A248 W274 A275 V345 L346	V238-A287 HydrophobicContact CB-CB 3.81Å; V238-A287 HydrophobicContact CG1-CB 3.9Å; V246-A287 HydrophobicContact CB-CB 3.96Å; V246-A287 HydrophobicContact CG2-CB 4.31Å; A248-A287 HydrophobicContact CB-CB 4.13Å; W274-A287 CarbonylContact O-C 3.45Å; W274-A287 VanDerWaalsContact O-CA 3.28Å; W274-A287 WeakPolarHBondContact O-CA 3.35Å; A275-A287 HydrophobicContact CB-CB 4.47Å; A287-V345 WeakPolarHBondContact O-CA 3.28Å; A287-L346 HydrophobicContact CB-CB 4.47Å; A287-L346 PolarHBondContact N-O 2.83Å; A287-L346 PolarHBondContact O-N 3.06Å
288	V	99	Very high	97.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	139.3	-174.5	-172.4	0	0	0	0	110.2	A248 C273 W274 T290 A303 C306 L310 V343 I344 V345	A248-V288 WeakPolarHBondContact CB-O 3.27Å; C273-V288 CarbonylContact C-O 3.55Å; C273-V288 WeakPolarHBondContact CA-O 3.37Å; C273-V288 WeakPolarHBondContact CB-O 3.4Å; W274-V288 HydrophobicContact CB-CB 4.46Å; W274-V288 PolarHBondContact N-O 2.98Å; W274-V288 PolarHBondContact O-N 3.21Å; V288-T290 HydrophobicContact CG1-CG2 4.48Å; V288-A303 HydrophobicContact CB-CB 4.35Å; V288-A303 HydrophobicContact CG1-CB 4.14Å; V288-C306 HydrophobicContact CG1-CB 4.09Å; V288-C306 HydrophobicContact CG2-CB 4.22Å; V288-L310 HydrophobicContact CG2-CD1 4.32Å; V288-V343 HydrophobicContact CG1-CB 4.45Å; V288-I344 WeakPolarHBondContact CA-O 3.26Å; V288-V345 HydrophobicContact CG1-CG2 4.21Å; V288-V345 HydrophobicContact CG2-CG2 4.25Å
289	S	98.9	Very high	97.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	140.3	169.9	-179.9	0	0	0	0	110.5	H47 G236 A249 V343 I344	H47-S289 PolarHBondContact NE2-OG 2.96Å; G236-S289 WeakPolarHBondContact CA-OG 3.23Å; A249-S289 PolarHBondContact O-OG 2.93Å; S289-V343 WeakPolarHBondContact O-CA 3.49Å; S289-I344 PolarHBondContact N-O 3.08Å; S289-I344 PolarHBondContact O-N 3.37Å
290	T	98.9	Very high	97.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	155.6	-170.8	72.3	0	0	0	0	113.5	T234 V250 C271 G272 V288 L302 A303 G342 V343	T234-T290 PolarHBondContact OG1-O 3.5Å; V250-T290 WeakPolarHBondContact CG2-O 3.43Å; C271-T290 WeakPolarHBondContact O-CG2 3.08Å; C271-T290 PolarHBondContact O-OG1 3.4Å; G272-T290 PolarHBondContact O-N 2.8Å; G272-T290 PolarHBondContact O-OG1 2.97Å; G272-T290 VanDerWaalsContact O-OG1 3.11Å; V288-T290 HydrophobicContact CG1-CG2 4.48Å; T290-L302 HydrophobicContact CG2-CB 4.5Å; T290-A303 HydrophobicContact CG2-CB 3.73Å; T290-G342 CarbonylContact C-O 3.56Å; T290-G342 WeakPolarHBondContact CA-O 3.21Å; T290-V343 HydrophobicContact CG2-CG1 3.83Å
291	S	98.4	Very high	97.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	158.5	173.7	-173.6	0	0	0	0	111.4	A50 L232 T234 G341 G342	A50-S291 PolarHBondContact N-OG 3.08Å; L232-S291 PolarHBondContact O-OG 3.3Å; T234-S291 PolarHBondContact N-OG 3.13Å; T234-S291 WeakPolarHBondContact OG1-CA 3.46Å; T234-S291 WeakPolarHBondContact OG1-CB 3.46Å; T234-S291 PolarHBondContact OG1-OG 3.28Å; S291-G341 CarbonylContact O-C 3.54Å; S291-G341 VanDerWaalsContact O-CA 3.28Å; S291-G341 WeakPolarHBondContact O-CA 3.45Å; S291-G342 PolarHBondContact N-O 2.74Å; S291-G342 PolarHBondContact O-N 3.27Å
292	G	96.2	Very high	98.1	Very high	3 Å²	3	23.3 Å²	23.3	3%	0.031	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	123.5	-145.3	175	0	0	0	0	0	112.4	L232 G294	L232-G292 PolarHBondContact O-N 2.8Å; G292-G294 PolarHBondContact O-N 2.84Å
293	C	96.6	Very high	98.3	Very high	17 Å²	17	22.9 Å²	22.9	12%	0.115	12%	0.117	C	C	.	.			trans	-71.8	113.2	-179.9	179.6	0	0	0	0	110.1	L232 E295 H296 L297 L340	L232-C293 HydrophobicContact CD2-CB 4.02Å; C293-E295 VanDerWaalsContact C-N 3.28Å; C293-E295 PolarHBondContact O-N 3.11Å; C293-H296 HydrophobicContact CB-CB 4.08Å; C293-H296 VanDerWaalsContact CB-ND1 3.34Å; C293-H296 WeakPolarHBondContact CB-ND1 3.5Å; C293-H296 WeakPolarHBondContact O-CB 3.39Å; C293-H296 PolarHBondContact O-N 3.46Å; C293-H296 VanDerWaalsContact SG-CD2 3.53Å; C293-L297 WeakPolarHBondContact O-CG 3.28Å; C293-L297 PolarHBondContact O-N 3.2Å; C293-L340 HydrophobicContact CB-CB 4.36Å; C293-L340 WeakPolarHBondContact CB-O 3.4Å; C293-L340 PolarHBondContact N-O 2.98Å
294	G	96.3	Very high	98.4	Very high	4 Å²	4	24.4 Å²	24.4	4%	0.041	11%	0.113	C	C	.	.	H	α-helix	trans	-52.1	-44.2	-177.6	0	0	0	0	0	113.2	G292 H296 L297 V298	G292-G294 PolarHBondContact O-N 2.84Å; G294-H296 VanDerWaalsContact C-N 3.33Å; G294-H296 PolarHBondContact O-N 3.47Å; G294-L297 PolarHBondContact O-N 2.91Å; G294-V298 WeakPolarHBondContact O-CB 3.1Å; G294-V298 VanDerWaalsContact O-CG2 3.22Å; G294-V298 WeakPolarHBondContact O-CG2 3.25Å; G294-V298 PolarHBondContact O-N 3.2Å
295	E	97.8	Very high	98.4	Very high	78 Å²	78	24.8 Å²	24.8	36%	0.364	12%	0.116	S	C	.	.	H	α-helix	trans	-64	-37.5	-179.5	-53.7	-52.4	146.2	0	0	112.5	R262 C293 R299	R262-E295 IonicContact CZ-OE1 2.78Å; R262-E295 VanDerWaalsContact CZ-OE1 3.32Å; R262-E295 IonicContact NE-OE1 3.09Å; R262-E295 PolarHBondContact NE-OE1 3.1Å; R262-E295 IonicContact NH2-OE1 2.9Å; R262-E295 PolarHBondContact NH2-OE1 3.4Å; C293-E295 VanDerWaalsContact C-N 3.28Å; C293-E295 PolarHBondContact O-N 3.11Å; E295-R299 WeakPolarHBondContact O-CB 3.4Å; E295-R299 WeakPolarHBondContact O-CG 3.3Å; E295-R299 PolarHBondContact O-N 3.43Å
296	H	98.5	Very high	98.4	Very high	12 Å²	12	24.5 Å²	24.5	6%	0.056	11%	0.114	C	C	.	.	H	α-helix	trans	-65.2	-43.3	178.2	-59.9	172.9	0	0	0	111.1	C293 G294 T300 F327 L333 E336 G338 V339 L340	C293-H296 HydrophobicContact CB-CB 4.08Å; C293-H296 VanDerWaalsContact CB-ND1 3.34Å; C293-H296 WeakPolarHBondContact CB-ND1 3.5Å; C293-H296 WeakPolarHBondContact O-CB 3.39Å; C293-H296 PolarHBondContact O-N 3.46Å; C293-H296 VanDerWaalsContact SG-CD2 3.53Å; G294-H296 VanDerWaalsContact C-N 3.33Å; G294-H296 PolarHBondContact O-N 3.47Å; H296-T300 PolarHBondContact O-N 2.9Å; H296-T300 PolarHBondContact O-OG1 3.33Å; H296-F327 HydrophobicContact CB-CE2 3.85Å; H296-F327 HydrophobicContact CB-CZ 3.99Å; H296-L333 HydrophobicContact CB-CD1 3.85Å; H296-L333 HydrophobicContact CB-CD2 4.33Å; H296-E336 IonicContact NE2-OE2 3.94Å; H296-G338 PolarHBondContact CE1-O 2.91Å; H296-V339 HydrophobicContact CB-CG1 4.4Å; H296-L340 PolarHBondContact ND1-N 2.91Å; H296-L340 PolarHBondContact ND1-O 2.91Å
297	L	98.7	Very high	98.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-70.7	-36.3	-178.1	-60	168.7	0	0	0	111.7	Q265 C293 G294 I301 L302 F327	Q265-L297 HydrophobicContact CB-CB 3.84Å; Q265-L297 HydrophobicContact CB-CD1 4.44Å; Q265-L297 HydrophobicContact CG-CB 3.91Å; Q265-L297 HydrophobicContact CG-CD1 3.64Å; Q265-L297 HydrophobicContact CG-CG 4.43Å; C293-L297 WeakPolarHBondContact O-CG 3.28Å; C293-L297 PolarHBondContact O-N 3.2Å; G294-L297 PolarHBondContact O-N 2.91Å; L297-I301 PolarHBondContact O-N 3.41Å; L297-L302 HydrophobicContact CD2-CB 4.15Å; L297-L302 HydrophobicContact CD2-CD2 3.41Å; L297-L302 VanDerWaalsContact CD2-CD2 3.41Å; L297-L302 HydrophobicContact CD2-CG 4.41Å; L297-L302 PolarHBondContact O-N 3.32Å; L297-F327 HydrophobicContact CD2-CE2 3.97Å; L297-F327 HydrophobicContact CD2-CZ 3.87Å
298	V	98.8	Very high	98.4	Very high	37 Å²	37	28.4 Å²	28.4	22%	0.224	13%	0.132	C	C	.	.	H	α-helix	trans	-69.3	-50.4	176.7	171.2	0	0	0	0	111.2	Q265 L268 C271 G294 T300 I301	Q265-V298 HydrophobicContact CB-CG2 3.65Å; L268-V298 HydrophobicContact CD1-CB 4.37Å; L268-V298 HydrophobicContact CD1-CG1 3.86Å; L268-V298 HydrophobicContact CD1-CG2 3.51Å; C271-V298 HydrophobicContact CB-CG2 4.28Å; G294-V298 WeakPolarHBondContact O-CB 3.1Å; G294-V298 VanDerWaalsContact O-CG2 3.22Å; G294-V298 WeakPolarHBondContact O-CG2 3.25Å; G294-V298 PolarHBondContact O-N 3.2Å; V298-T300 PolarHBondContact O-N 3.11Å; V298-T300 VanDerWaalsContact O-N 3.08Å; V298-I301 PolarHBondContact O-N 3.3Å; V298-I301 VanDerWaalsContact O-N 3.12Å
299	R	98.7	Very high	98.4	Very high	106 Å²	106	29.5 Å²	29.5	40%	0.4	14%	0.141	S	C	.	.	H	α-helix	trans	-64.1	-17.5	-177.1	-69.7	172.7	75.5	176.7	3.1	113.2	E295 F332 L333 E336	E295-R299 WeakPolarHBondContact O-CB 3.4Å; E295-R299 WeakPolarHBondContact O-CG 3.3Å; E295-R299 PolarHBondContact O-N 3.43Å; R299-F332 HydrophobicContact CB-CB 4.33Å; R299-F332 PolarHBondContact NE-O 3.3Å; R299-F332 PolarHBondContact NH2-O 3.19Å; R299-L333 HydrophobicContact CB-CD2 3.89Å; R299-E336 IonicContact NH1-OE1 3.2Å; R299-E336 PolarHBondContact NH1-OE1 3.06Å; R299-E336 VanDerWaalsContact NH1-OE1 3.09Å
300	T	98.9	Very high	98.4	Very high	14 Å²	14	29.5 Å²	29.5	9%	0.086	14%	0.141	C	C	.	.	H	α-helix	trans	-110.7	-3.8	177.7	57.6	0	0	0	0	114.1	H296 V298 L302 K326 F327 L333	H296-T300 PolarHBondContact O-N 2.9Å; H296-T300 PolarHBondContact O-OG1 3.33Å; V298-T300 PolarHBondContact O-N 3.11Å; V298-T300 VanDerWaalsContact O-N 3.08Å; T300-L302 PolarHBondContact O-N 3.13Å; T300-K326 WeakPolarHBondContact CG2-O 3.49Å; T300-F327 HydrophobicContact CG2-CD2 4.06Å; T300-F327 WeakPolarHBondContact OG1-CD2 3.2Å; T300-L333 HydrophobicContact CG2-CD1 3.65Å; T300-L333 HydrophobicContact CG2-CG 3.93Å
301	I	98.9	Very high	98.4	Very high	82 Å²	82	31.2 Å²	31.2	42%	0.421	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	46.2	-179.1	-45.1	179.8	0	0	0	110.4	G270 L297 V298 A303 R304 E305	G270-I301 CarbonylContact O-C 3.59Å; G270-I301 VanDerWaalsContact O-CG2 3.29Å; G270-I301 WeakPolarHBondContact O-CG2 3.35Å; L297-I301 PolarHBondContact O-N 3.41Å; V298-I301 PolarHBondContact O-N 3.3Å; V298-I301 VanDerWaalsContact O-N 3.12Å; I301-A303 PolarHBondContact O-N 2.87Å; I301-R304 HydrophobicContact CG2-CB 4.01Å; I301-R304 PolarHBondContact O-N 3.19Å; I301-E305 PolarHBondContact O-N 3.25Å; I301-E305 VanDerWaalsContact O-N 3.1Å
302	L	98.9	Very high	98.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62	-38.7	-157.1	-169.8	64.2	0	0	0	113.6	T290 L297 T300 R304 E305 C306 T322 M323 F327 V343	T290-L302 HydrophobicContact CG2-CB 4.5Å; L297-L302 HydrophobicContact CD2-CB 4.15Å; L297-L302 HydrophobicContact CD2-CD2 3.41Å; L297-L302 VanDerWaalsContact CD2-CD2 3.41Å; L297-L302 HydrophobicContact CD2-CG 4.41Å; L297-L302 PolarHBondContact O-N 3.32Å; T300-L302 PolarHBondContact O-N 3.13Å; L302-R304 VanDerWaalsContact C-N 3.35Å; L302-R304 PolarHBondContact O-N 3Å; L302-E305 PolarHBondContact O-N 3.41Å; L302-C306 WeakPolarHBondContact O-CB 3.2Å; L302-C306 PolarHBondContact O-N 3.15Å; L302-C306 PolarHBondContact O-SG 3.11Å; L302-C306 VanDerWaalsContact O-SG 3.33Å; L302-T322 HydrophobicContact CD1-CG2 4.49Å; L302-M323 HydrophobicContact CD1-SD 4.39Å; L302-M323 HydrophobicContact CD2-SD 4.2Å; L302-F327 HydrophobicContact CD1-CB 3.93Å; L302-F327 HydrophobicContact CD1-CD2 3.92Å; L302-F327 HydrophobicContact CD1-CG 4.02Å; L302-F327 HydrophobicContact CD2-CD1 4.3Å; L302-F327 HydrophobicContact CD2-CD2 3.87Å; L302-F327 HydrophobicContact CD2-CE1 4.31Å; L302-F327 HydrophobicContact CD2-CE2 3.91Å; L302-F327 HydrophobicContact CD2-CG 4.08Å; L302-F327 HydrophobicContact CD2-CZ 4.14Å; L302-F327 HydrophobicContact CG-CD2 4.4Å; L302-V343 HydrophobicContact CD2-CG1 3.59Å; L302-V343 HydrophobicContact CG-CG1 4.07Å
303	A	98.9	Very high	98.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.8	-46.6	-178	0	0	0	0	0	111.9	G270 C271 W274 V288 T290 I301 S307	G270-A303 WeakPolarHBondContact O-CB 3.5Å; G270-A303 PolarHBondContact O-N 3.46Å; C271-A303 WeakPolarHBondContact O-CB 3.42Å; W274-A303 HydrophobicContact CB-CB 4.15Å; V288-A303 HydrophobicContact CB-CB 4.35Å; V288-A303 HydrophobicContact CG1-CB 4.14Å; T290-A303 HydrophobicContact CG2-CB 3.73Å; I301-A303 PolarHBondContact O-N 2.87Å; A303-S307 PolarHBondContact O-N 3.21Å; A303-S307 VanDerWaalsContact O-N 3.15Å
304	R	98.9	Very high	98.5	Very high	106 Å²	106	45 Å²	45	40%	0.4	22%	0.222	S	C	.	.	H	α-helix	trans	-68.9	-42.1	178.6	-171.2	-179	-175.5	-159.3	2	111.7	G270 W274 I301 L302 C306 S307 H308	G270-R304 PolarHBondContact O-N 3.23Å; W274-R304 HydrophobicContact CD2-CB 4.12Å; W274-R304 HydrophobicContact CD2-CG 4Å; W274-R304 HydrophobicContact CE3-CB 3.97Å; W274-R304 HydrophobicContact CE3-CG 4.04Å; W274-R304 HydrophobicContact CH2-CG 3.97Å; W274-R304 HydrophobicContact CZ2-CG 3.98Å; W274-R304 HydrophobicContact CZ3-CB 4.27Å; W274-R304 HydrophobicContact CZ3-CG 4Å; I301-R304 HydrophobicContact CG2-CB 4.01Å; I301-R304 PolarHBondContact O-N 3.19Å; L302-R304 VanDerWaalsContact C-N 3.35Å; L302-R304 PolarHBondContact O-N 3Å; R304-C306 VanDerWaalsContact C-N 3.32Å; R304-C306 PolarHBondContact O-N 3.23Å; R304-S307 WeakPolarHBondContact O-CB 3.2Å; R304-S307 PolarHBondContact O-N 3.37Å; R304-S307 VanDerWaalsContact O-N 3.11Å; R304-H308 PolarHBondContact NE-CE1 3.32Å; R304-H308 VanDerWaalsContact NE-CE1 3.32Å; R304-H308 PolarHBondContact NE-NE2 3Å; R304-H308 PolarHBondContact O-N 3.1Å
305	E	98.9	Very high	98.6	Very high	55 Å²	55	44.8 Å²	44.8	26%	0.257	22%	0.221	S	C	.	.	H	α-helix	trans	-61.5	-41.8	179.9	-167	65.2	-166.8	0	0	111.4	I301 L302 H308 A309 T322 K326	I301-E305 PolarHBondContact O-N 3.25Å; I301-E305 VanDerWaalsContact O-N 3.1Å; L302-E305 PolarHBondContact O-N 3.41Å; E305-H308 PolarHBondContact O-N 3.32Å; E305-A309 PolarHBondContact O-N 3.12Å; E305-T322 HydrophobicContact CG-CG2 4.11Å; E305-K326 HydrophobicContact CG-CB 4Å; E305-K326 HydrophobicContact CG-CG 4.12Å; E305-K326 IonicContact OE1-NZ 2.92Å; E305-K326 PolarHBondContact OE1-NZ 3.19Å
306	C	98.9	Very high	98.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.3	-46.6	171.1	-70.6	0	0	0	0	111.8	V288 L302 R304 H308 A309 L310 L319	V288-C306 HydrophobicContact CG1-CB 4.09Å; V288-C306 HydrophobicContact CG2-CB 4.22Å; L302-C306 WeakPolarHBondContact O-CB 3.2Å; L302-C306 PolarHBondContact O-N 3.15Å; L302-C306 PolarHBondContact O-SG 3.11Å; L302-C306 VanDerWaalsContact O-SG 3.33Å; R304-C306 VanDerWaalsContact C-N 3.32Å; R304-C306 PolarHBondContact O-N 3.23Å; C306-H308 VanDerWaalsContact C-N 3.3Å; C306-H308 PolarHBondContact O-N 2.96Å; C306-A309 PolarHBondContact O-N 3.43Å; C306-L310 WeakPolarHBondContact O-CD1 3.43Å; C306-L310 WeakPolarHBondContact O-CG 3.48Å; C306-L310 PolarHBondContact O-N 3.47Å; C306-L319 HydrophobicContact CB-CD1 4.3Å
307	S	98.9	Very high	98.6	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-57.3	-42.5	178.5	-172.4	0	0	0	0	112.6	T286 A303 R304 Q311	T286-S307 PolarHBondContact OG1-OG 3.18Å; A303-S307 PolarHBondContact O-N 3.21Å; A303-S307 VanDerWaalsContact O-N 3.15Å; R304-S307 WeakPolarHBondContact O-CB 3.2Å; R304-S307 PolarHBondContact O-N 3.37Å; R304-S307 VanDerWaalsContact O-N 3.11Å; S307-Q311 PolarHBondContact O-NE2 3.41Å
308	H	98.9	Very high	98.6	Very high	83 Å²	83	48.4 Å²	48.4	38%	0.384	24%	0.239	S	C	.	.	H	α-helix	trans	-66	-43.5	176.4	-67	169.1	0	0	0	112.1	R304 E305 C306 L310 Q311	R304-H308 PolarHBondContact NE-CE1 3.32Å; R304-H308 VanDerWaalsContact NE-CE1 3.32Å; R304-H308 PolarHBondContact NE-NE2 3Å; R304-H308 PolarHBondContact O-N 3.1Å; E305-H308 PolarHBondContact O-N 3.32Å; C306-H308 VanDerWaalsContact C-N 3.3Å; C306-H308 PolarHBondContact O-N 2.96Å; H308-L310 VanDerWaalsContact C-N 3.29Å; H308-L310 PolarHBondContact O-N 2.76Å; H308-Q311 WeakPolarHBondContact O-CB 3.46Å; H308-Q311 WeakPolarHBondContact O-CG 3.25Å; H308-Q311 PolarHBondContact O-N 2.95Å
309	A	98.8	Very high	98.7	Very high	23 Å²	23	46.6 Å²	46.6	19%	0.19	23%	0.228	C	C	.	.	H	α-helix	trans	-63	-37	179.3	0	0	0	0	0	112.3	E305 C306 Q311 A312 A318 T322	E305-A309 PolarHBondContact O-N 3.12Å; C306-A309 PolarHBondContact O-N 3.43Å; A309-Q311 PolarHBondContact O-N 3.03Å; A309-A312 WeakPolarHBondContact O-CB 3.23Å; A309-A312 PolarHBondContact O-N 2.92Å; A309-A318 HydrophobicContact CB-CB 4.39Å; A309-A318 WeakPolarHBondContact O-CB 3.46Å; A309-T322 WeakPolarHBondContact CB-OG1 3Å
310	L	98.8	Very high	98.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-4.1	-179.2	-70.6	159.1	0	0	0	114.7	T286 V288 C306 H308 A312 A315 V345 R347	T286-L310 HydrophobicContact CG2-CB 3.95Å; T286-L310 HydrophobicContact CG2-CD1 4.41Å; V288-L310 HydrophobicContact CG2-CD1 4.32Å; C306-L310 WeakPolarHBondContact O-CD1 3.43Å; C306-L310 WeakPolarHBondContact O-CG 3.48Å; C306-L310 PolarHBondContact O-N 3.47Å; H308-L310 VanDerWaalsContact C-N 3.29Å; H308-L310 PolarHBondContact O-N 2.76Å; L310-A312 VanDerWaalsContact C-N 3.25Å; L310-A315 HydrophobicContact CD2-CB 3.9Å; L310-V345 HydrophobicContact CD1-CB 4.25Å; L310-V345 HydrophobicContact CD1-CG1 3.14Å; L310-V345 HydrophobicContact CD1-CG2 4.09Å; L310-V345 HydrophobicContact CD2-CG1 3.84Å; L310-V345 HydrophobicContact CG-CG1 4.11Å; L310-R347 WeakPolarHBondContact O-CD 3.48Å; L310-R347 PolarHBondContact O-NH1 3.33Å
311	Q	98.6	Very high	98.7	Very high	36 Å²	36	46.7 Å²	46.7	17%	0.168	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-14	170.5	-54.7	-44.3	-52.3	0	0	113.1	N282 P283 Y284 T286 S307 H308 A309	N282-Q311 WeakPolarHBondContact OD1-CG 3.4Å; N282-Q311 PolarHBondContact OD1-NE2 2.74Å; N282-Q311 PolarHBondContact OD1-OE1 3.32Å; P283-Q311 VanDerWaalsContact CD-OE1 3.25Å; Y284-Q311 VanDerWaalsContact N-OE1 3.08Å; T286-Q311 VanDerWaalsContact CG2-NE2 3.25Å; T286-Q311 PolarHBondContact OG1-NE2 2.88Å; S307-Q311 PolarHBondContact O-NE2 3.41Å; H308-Q311 WeakPolarHBondContact O-CB 3.46Å; H308-Q311 WeakPolarHBondContact O-CG 3.25Å; H308-Q311 PolarHBondContact O-N 2.95Å; A309-Q311 PolarHBondContact O-N 3.03Å
312	A	98.1	Very high	98.7	Very high	50 Å²	50	43 Å²	43	41%	0.413	21%	0.214	S	C	.	.	S	Bend	trans	-65	159.9	167.6	0	0	0	0	0	111.2	A309 L310 A318 R347	A309-A312 WeakPolarHBondContact O-CB 3.23Å; A309-A312 PolarHBondContact O-N 2.92Å; L310-A312 VanDerWaalsContact C-N 3.25Å; A312-A318 HydrophobicContact CB-CB 4.05Å; A312-R347 PolarHBondContact O-NH1 3.23Å
313	E	96.6	Very high	98.7	Very high	167 Å²	167	43 Å²	43	78%	0.78	21%	0.214	S	C	*	.	S	Bend	trans	-63.2	-52.3	-177.9	-165.6	-143.2	165.2	0	0	112.3	A315 R347	E313-A315 PolarHBondContact O-N 3.21Å; E313-R347 PolarHBondContact O-NH1 3.12Å; E313-R347 PolarHBondContact O-NH2 3.02Å
314	D	98.3	Very high	98.6	Very high	91 Å²	91	47 Å²	47	49%	0.487	23%	0.233	S	C	.	.			trans	-84.9	100.3	-179.9	-171.5	-27.9	0	0	0	111.2	H316 Q317 A318	D314-H316 VanDerWaalsContact C-N 3.33Å; D314-H316 PolarHBondContact O-N 2.75Å; D314-H316 PolarHBondContact OD1-N 2.94Å; D314-Q317 HydrophobicContact CB-CB 4.02Å; D314-Q317 VanDerWaalsContact CG-CB 3.48Å; D314-Q317 PolarHBondContact OD1-N 2.76Å; D314-A318 WeakPolarHBondContact O-CB 3.37Å; D314-A318 PolarHBondContact O-N 2.81Å
315	A	98.6	Very high	98.6	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-62.4	-37.7	179.2	0	0	0	0	0	113.2	L310 E313 L319 R347 L369	L310-A315 HydrophobicContact CD2-CB 3.9Å; E313-A315 PolarHBondContact O-N 3.21Å; A315-L319 VanDerWaalsContact O-CB 3.31Å; A315-L319 WeakPolarHBondContact O-CB 3.44Å; A315-L319 PolarHBondContact O-N 3.18Å; A315-R347 VanDerWaalsContact CB-CZ 3.47Å; A315-L369 HydrophobicContact CB-CD1 4.03Å
316	H	98.7	Very high	98.6	Very high	79 Å²	79	48.1 Å²	48.1	37%	0.366	24%	0.244	S	C	.	.	H	α-helix	trans	-68.4	-49.1	-176.4	-178.2	-76.7	0	0	0	110	D314 L319 L320 L369 I408	D314-H316 VanDerWaalsContact C-N 3.33Å; D314-H316 PolarHBondContact O-N 2.75Å; D314-H316 PolarHBondContact OD1-N 2.94Å; H316-L319 PolarHBondContact O-N 3.24Å; H316-L320 WeakPolarHBondContact O-CB 3.49Å; H316-L320 PolarHBondContact O-N 3.25Å; H316-L369 HydrophobicContact CB-CD2 4.02Å; H316-I408 WeakPolarHBondContact NE2-CG2 3.48Å; H316-I408 WeakPolarHBondContact O-CD1 3.4Å
317	Q	98.8	Very high	98.6	Very high	77 Å²	77	48.1 Å²	48.1	36%	0.36	24%	0.244	S	C	.	.	H	α-helix	trans	-64.6	-43.5	178.2	-172.2	58.7	29	0	0	111.6	D314 L319 L320 E321	D314-Q317 HydrophobicContact CB-CB 4.02Å; D314-Q317 VanDerWaalsContact CG-CB 3.48Å; D314-Q317 PolarHBondContact OD1-N 2.76Å; Q317-L319 VanDerWaalsContact C-N 3.34Å; Q317-L319 PolarHBondContact O-N 3.38Å; Q317-L320 PolarHBondContact O-N 3.05Å; Q317-E321 WeakPolarHBondContact CG-OE1 3.12Å; Q317-E321 PolarHBondContact NE2-OE1 2.87Å; Q317-E321 WeakPolarHBondContact O-CB 3.5Å; Q317-E321 WeakPolarHBondContact O-CG 3.47Å; Q317-E321 PolarHBondContact O-N 3.4Å
318	A	98.8	Very high	98.6	Very high	9 Å²	9	49.5 Å²	49.5	7%	0.074	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-41	178.4	0	0	0	0	0	112.8	A309 A312 D314 T322	A309-A318 HydrophobicContact CB-CB 4.39Å; A309-A318 WeakPolarHBondContact O-CB 3.46Å; A312-A318 HydrophobicContact CB-CB 4.05Å; D314-A318 WeakPolarHBondContact O-CB 3.37Å; D314-A318 PolarHBondContact O-N 2.81Å; A318-T322 WeakPolarHBondContact O-CB 3.28Å; A318-T322 PolarHBondContact O-N 2.91Å; A318-T322 PolarHBondContact O-OG1 3.02Å
319	L	98.9	Very high	98.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-68.9	-42.5	176.7	-176	58.9	0	0	0	111.4	C306 A315 H316 Q317 T322 M323 V343 V345 L369 I408	C306-L319 HydrophobicContact CB-CD1 4.3Å; A315-L319 VanDerWaalsContact O-CB 3.31Å; A315-L319 WeakPolarHBondContact O-CB 3.44Å; A315-L319 PolarHBondContact O-N 3.18Å; H316-L319 PolarHBondContact O-N 3.24Å; Q317-L319 VanDerWaalsContact C-N 3.34Å; Q317-L319 PolarHBondContact O-N 3.38Å; L319-T322 WeakPolarHBondContact O-CB 3.48Å; L319-T322 PolarHBondContact O-N 2.93Å; L319-M323 HydrophobicContact CD1-CG 4.32Å; L319-M323 VanDerWaalsContact O-CG 3.32Å; L319-M323 WeakPolarHBondContact O-CG 3.29Å; L319-M323 PolarHBondContact O-N 3.25Å; L319-V343 HydrophobicContact CD1-CG2 3.97Å; L319-V343 HydrophobicContact CD2-CG2 4.5Å; L319-V345 HydrophobicContact CD1-CG2 4.17Å; L319-V345 HydrophobicContact CD2-CG2 4.05Å; L319-L369 HydrophobicContact CD2-CB 3.79Å; L319-L369 HydrophobicContact CD2-CD2 4.29Å; L319-I408 HydrophobicContact CB-CD1 3.9Å; L319-I408 HydrophobicContact CD2-CD1 3.92Å; L319-I408 HydrophobicContact CD2-CG1 4.5Å; L319-I408 HydrophobicContact CG-CD1 3.95Å
320	L	98.8	Very high	98.6	Very high	32 Å²	32	48.8 Å²	48.8	17%	0.168	25%	0.254	C	S	.	.	H	α-helix	trans	-59.3	-48.8	176.8	178.4	60	0	0	0	111.5	H316 Q317 T322 M323 Q324 V406 I408	H316-L320 WeakPolarHBondContact O-CB 3.49Å; H316-L320 PolarHBondContact O-N 3.25Å; Q317-L320 PolarHBondContact O-N 3.05Å; L320-T322 VanDerWaalsContact C-N 3.28Å; L320-T322 PolarHBondContact O-N 3.26Å; L320-M323 PolarHBondContact O-N 2.88Å; L320-Q324 HydrophobicContact CD1-CG 4.22Å; L320-Q324 WeakPolarHBondContact O-CB 3.43Å; L320-Q324 WeakPolarHBondContact O-CG 3.37Å; L320-Q324 PolarHBondContact O-N 3.45Å; L320-V406 HydrophobicContact CD1-CB 4.15Å; L320-V406 HydrophobicContact CD1-CG1 3.96Å; L320-I408 HydrophobicContact CB-CD1 4.24Å; L320-I408 HydrophobicContact CD1-CG2 4.18Å
321	E	98.8	Very high	98.6	Very high	89 Å²	89	54 Å²	54	42%	0.416	29%	0.288	S	S	.	.	H	α-helix	trans	-62.4	-36.1	177.4	-73.8	176.9	-169.1	0	0	112.1	Q317 Q324 N325	Q317-E321 WeakPolarHBondContact CG-OE1 3.12Å; Q317-E321 PolarHBondContact NE2-OE1 2.87Å; Q317-E321 WeakPolarHBondContact O-CB 3.5Å; Q317-E321 WeakPolarHBondContact O-CG 3.47Å; Q317-E321 PolarHBondContact O-N 3.4Å; E321-Q324 PolarHBondContact O-N 2.85Å; E321-N325 WeakPolarHBondContact O-CB 3.16Å; E321-N325 PolarHBondContact O-N 3.35Å; E321-N325 PolarHBondContact O-ND2 2.82Å
322	T	98.9	Very high	98.6	Very high	5 Å²	5	58.8 Å²	58.8	3%	0.031	31%	0.309	C	S	.	.	I	π-helix	trans	-64.5	-49	174.9	-59.4	0	0	0	0	110.8	L302 E305 A309 A318 L319 L320 Q324 K326 F327	L302-T322 HydrophobicContact CD1-CG2 4.49Å; E305-T322 HydrophobicContact CG-CG2 4.11Å; A309-T322 WeakPolarHBondContact CB-OG1 3Å; A318-T322 WeakPolarHBondContact O-CB 3.28Å; A318-T322 PolarHBondContact O-N 2.91Å; A318-T322 PolarHBondContact O-OG1 3.02Å; L319-T322 WeakPolarHBondContact O-CB 3.48Å; L319-T322 PolarHBondContact O-N 2.93Å; L320-T322 VanDerWaalsContact C-N 3.28Å; L320-T322 PolarHBondContact O-N 3.26Å; T322-Q324 VanDerWaalsContact C-N 3.27Å; T322-Q324 PolarHBondContact O-N 2.85Å; T322-K326 HydrophobicContact CG2-CB 4.05Å; T322-K326 HydrophobicContact CG2-CG 4.3Å; T322-K326 CarbonylContact O-C 3.57Å; T322-K326 WeakPolarHBondContact O-CA 3.32Å; T322-K326 VanDerWaalsContact O-CB 3.29Å; T322-K326 WeakPolarHBondContact O-CB 3.03Å; T322-K326 PolarHBondContact O-N 2.85Å; T322-F327 PolarHBondContact O-N 3.13Å; T322-F327 VanDerWaalsContact O-N 3.11Å
323	M	98.9	Very high	98.6	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.29	C	S	.	.	I	π-helix	trans	-64.7	-31.9	179.7	-66.1	-60.9	-69.3	0	0	112.4	L302 L319 L320 F327 I328 V343 T373 V406	L302-M323 HydrophobicContact CD1-SD 4.39Å; L302-M323 HydrophobicContact CD2-SD 4.2Å; L319-M323 HydrophobicContact CD1-CG 4.32Å; L319-M323 VanDerWaalsContact O-CG 3.32Å; L319-M323 WeakPolarHBondContact O-CG 3.29Å; L319-M323 PolarHBondContact O-N 3.25Å; L320-M323 PolarHBondContact O-N 2.88Å; M323-F327 HydrophobicContact CE-CD1 3.82Å; M323-F327 HydrophobicContact CE-CE1 4.23Å; M323-F327 WeakPolarHBondContact O-CB 3.34Å; M323-F327 HydrophobicContact SD-CD1 4.41Å; M323-I328 WeakPolarHBondContact O-CG1 2.93Å; M323-I328 PolarHBondContact O-N 2.95Å; M323-V343 HydrophobicContact SD-CG1 4.41Å; M323-V343 HydrophobicContact SD-CG2 4.14Å; M323-T373 HydrophobicContact CE-CG2 4.11Å; M323-V406 HydrophobicContact CB-CG1 3.94Å; M323-V406 HydrophobicContact CB-CG2 3.95Å
324	Q	98.7	Very high	98.6	Very high	83 Å²	83	52.7 Å²	52.7	39%	0.388	29%	0.286	S	S	.	.	I	π-helix	trans	-79.2	-55.3	175.9	-70.8	177.7	-16.5	0	0	112.6	L320 E321 T322 S329 V406	L320-Q324 HydrophobicContact CD1-CG 4.22Å; L320-Q324 WeakPolarHBondContact O-CB 3.43Å; L320-Q324 WeakPolarHBondContact O-CG 3.37Å; L320-Q324 PolarHBondContact O-N 3.45Å; E321-Q324 PolarHBondContact O-N 2.85Å; T322-Q324 VanDerWaalsContact C-N 3.27Å; T322-Q324 PolarHBondContact O-N 2.85Å; Q324-S329 VanDerWaalsContact O-CB 3.29Å; Q324-S329 WeakPolarHBondContact O-CB 3.29Å; Q324-S329 PolarHBondContact O-N 2.89Å; Q324-S329 PolarHBondContact O-OG 3.21Å; Q324-V406 HydrophobicContact CG-CG2 3.95Å
325	N	98.7	Very high	98.4	Very high	89 Å²	89	52.6 Å²	52.6	48%	0.476	29%	0.293	S	S	.	.	I	π-helix	trans	-88.5	-38.8	-167.4	-59.3	-35.1	0	0	0	112.7	E321	E321-N325 WeakPolarHBondContact O-CB 3.16Å; E321-N325 PolarHBondContact O-N 3.35Å; E321-N325 PolarHBondContact O-ND2 2.82Å
326	K	98.8	Very high	98.3	Very high	97 Å²	97	55.9 Å²	55.9	42%	0.422	31%	0.308	S	S	.	.	I	π-helix	trans	-94.7	-14.4	-175.3	-53.1	-63.2	-173.1	60.6	0	113	T300 E305 T322 S330	T300-K326 WeakPolarHBondContact CG2-O 3.49Å; E305-K326 HydrophobicContact CG-CB 4Å; E305-K326 HydrophobicContact CG-CG 4.12Å; E305-K326 IonicContact OE1-NZ 2.92Å; E305-K326 PolarHBondContact OE1-NZ 3.19Å; T322-K326 HydrophobicContact CG2-CB 4.05Å; T322-K326 HydrophobicContact CG2-CG 4.3Å; T322-K326 CarbonylContact O-C 3.57Å; T322-K326 WeakPolarHBondContact O-CA 3.32Å; T322-K326 VanDerWaalsContact O-CB 3.29Å; T322-K326 WeakPolarHBondContact O-CB 3.03Å; T322-K326 PolarHBondContact O-N 2.85Å; K326-S330 VanDerWaalsContact O-CB 3.29Å; K326-S330 WeakPolarHBondContact O-CB 3.43Å; K326-S330 PolarHBondContact O-OG 2.94Å
327	F	98.8	Very high	97.9	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.326	C	S	.	.	I	π-helix	trans	-116.1	-73.4	179.3	-166.3	-124.9	0	0	0	112.8	H296 L297 T300 L302 T322 M323 S329 S330 L333 V339 T373	H296-F327 HydrophobicContact CB-CE2 3.85Å; H296-F327 HydrophobicContact CB-CZ 3.99Å; L297-F327 HydrophobicContact CD2-CE2 3.97Å; L297-F327 HydrophobicContact CD2-CZ 3.87Å; T300-F327 HydrophobicContact CG2-CD2 4.06Å; T300-F327 WeakPolarHBondContact OG1-CD2 3.2Å; L302-F327 HydrophobicContact CD1-CB 3.93Å; L302-F327 HydrophobicContact CD1-CD2 3.92Å; L302-F327 HydrophobicContact CD1-CG 4.02Å; L302-F327 HydrophobicContact CD2-CD1 4.3Å; L302-F327 HydrophobicContact CD2-CD2 3.87Å; L302-F327 HydrophobicContact CD2-CE1 4.31Å; L302-F327 HydrophobicContact CD2-CE2 3.91Å; L302-F327 HydrophobicContact CD2-CG 4.08Å; L302-F327 HydrophobicContact CD2-CZ 4.14Å; L302-F327 HydrophobicContact CG-CD2 4.4Å; T322-F327 PolarHBondContact O-N 3.13Å; T322-F327 VanDerWaalsContact O-N 3.11Å; M323-F327 HydrophobicContact CE-CD1 3.82Å; M323-F327 HydrophobicContact CE-CE1 4.23Å; M323-F327 WeakPolarHBondContact O-CB 3.34Å; M323-F327 HydrophobicContact SD-CD1 4.41Å; F327-S329 PolarHBondContact O-N 2.88Å; F327-S330 VanDerWaalsContact O-CB 3.23Å; F327-S330 WeakPolarHBondContact O-CB 3.32Å; F327-S330 PolarHBondContact O-N 3.07Å; F327-L333 HydrophobicContact CD2-CD1 4.19Å; F327-L333 HydrophobicContact CE2-CD1 4.14Å; F327-V339 HydrophobicContact CD1-CG1 3.72Å; F327-V339 HydrophobicContact CD2-CG1 3.96Å; F327-V339 HydrophobicContact CE1-CG1 3.51Å; F327-V339 HydrophobicContact CE2-CG1 3.74Å; F327-V339 HydrophobicContact CG-CG1 3.94Å; F327-V339 HydrophobicContact CZ-CG1 3.5Å; F327-T373 HydrophobicContact CD1-CG2 4.13Å; F327-T373 HydrophobicContact CE1-CG2 4.25Å
328	I	98.6	Very high	97.6	Very high	28 Å²	28	55.6 Å²	55.6	14%	0.144	32%	0.315	C	S	.	.	I	π-helix	trans	-58.2	-53.6	-178.6	-68.6	176.5	0	0	0	111.7	M323 S330 T373 V406	M323-I328 WeakPolarHBondContact O-CG1 2.93Å; M323-I328 PolarHBondContact O-N 2.95Å; I328-S330 PolarHBondContact O-N 3.31Å; I328-T373 HydrophobicContact CD1-CG2 3.7Å; I328-T373 HydrophobicContact CG1-CG2 3.74Å; I328-V406 HydrophobicContact CD1-CG2 3.46Å; I328-V406 VanDerWaalsContact CD1-CG2 3.46Å
329	S	98.6	Very high	97.6	Very high	84 Å²	84	55.4 Å²	55.4	59%	0.587	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	16.4	-177.2	-56.3	0	0	0	0	112.8	Q324 F327 P331	Q324-S329 VanDerWaalsContact O-CB 3.29Å; Q324-S329 WeakPolarHBondContact O-CB 3.29Å; Q324-S329 PolarHBondContact O-N 2.89Å; Q324-S329 PolarHBondContact O-OG 3.21Å; F327-S329 PolarHBondContact O-N 2.88Å; S329-P331 WeakPolarHBondContact O-CD 3.28Å
330	S	98.8	Very high	97.5	Very high	7 Å²	7	57.6 Å²	57.6	5%	0.049	32%	0.324	C	S	.	.			trans	-63.8	128.2	-178	-169	0	0	0	0	110.6	K326 F327 I328 F332 L333 A334	K326-S330 VanDerWaalsContact O-CB 3.29Å; K326-S330 WeakPolarHBondContact O-CB 3.43Å; K326-S330 PolarHBondContact O-OG 2.94Å; F327-S330 VanDerWaalsContact O-CB 3.23Å; F327-S330 WeakPolarHBondContact O-CB 3.32Å; F327-S330 PolarHBondContact O-N 3.07Å; I328-S330 PolarHBondContact O-N 3.31Å; S330-F332 PolarHBondContact O-N 3.26Å; S330-F332 VanDerWaalsContact O-N 3.12Å; S330-F332 PolarHBondContact OG-N 2.85Å; S330-L333 CarbonylContact O-C 3.37Å; S330-L333 PolarHBondContact O-N 3.11Å; S330-A334 PolarHBondContact O-N 2.75Å
331	P	98.6	Very high	97.5	Very high	111 Å²	111	56.1 Å²	56.1	72%	0.721	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-57.9	-27.7	172.7	-25.4	35	0	0	0	112.5	S329 L333 A334	S329-P331 WeakPolarHBondContact O-CD 3.28Å; P331-L333 PolarHBondContact O-N 3.3Å; P331-A334 PolarHBondContact O-N 3.36Å
332	F	98.6	Very high	97.5	Very high	135 Å²	135	51.9 Å²	51.9	59%	0.592	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-65.8	-17.6	175.3	-68	-84.6	0	0	0	113.1	R299 S330	R299-F332 HydrophobicContact CB-CB 4.33Å; R299-F332 PolarHBondContact NE-O 3.3Å; R299-F332 PolarHBondContact NH2-O 3.19Å; S330-F332 PolarHBondContact O-N 3.26Å; S330-F332 VanDerWaalsContact O-N 3.12Å; S330-F332 PolarHBondContact OG-N 2.85Å
333	L	98.1	Very high	97.5	Very high	3 Å²	3	51.6 Å²	51.6	2%	0.016	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-120.6	14.8	-179.2	-57.8	-178.6	0	0	0	112.7	H296 R299 T300 F327 S330 P331 S335 E336 V339	H296-L333 HydrophobicContact CB-CD1 3.85Å; H296-L333 HydrophobicContact CB-CD2 4.33Å; R299-L333 HydrophobicContact CB-CD2 3.89Å; T300-L333 HydrophobicContact CG2-CD1 3.65Å; T300-L333 HydrophobicContact CG2-CG 3.93Å; F327-L333 HydrophobicContact CD2-CD1 4.19Å; F327-L333 HydrophobicContact CE2-CD1 4.14Å; S330-L333 CarbonylContact O-C 3.37Å; S330-L333 PolarHBondContact O-N 3.11Å; P331-L333 PolarHBondContact O-N 3.3Å; L333-S335 PolarHBondContact O-N 3.15Å; L333-E336 HydrophobicContact CB-CG 4.14Å; L333-E336 HydrophobicContact CD2-CG 4.24Å; L333-E336 WeakPolarHBondContact O-CB 3.4Å; L333-E336 PolarHBondContact O-N 3.47Å; L333-V339 HydrophobicContact CB-CG2 3.95Å; L333-V339 HydrophobicContact CD1-CB 4.41Å; L333-V339 HydrophobicContact CD1-CG1 3.52Å; L333-V339 HydrophobicContact CD1-CG2 3.98Å
334	A	96.7	Very high	97.5	Very high	86 Å²	86	51.6 Å²	51.6	71%	0.711	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-19.8	-176	0	0	0	0	0	114.3	S330 P331	S330-A334 PolarHBondContact O-N 2.75Å; P331-A334 PolarHBondContact O-N 3.36Å
335	S	95.5	Very high	97.5	Very high	90 Å²	90	47.7 Å²	47.7	63%	0.629	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-12.3	176.5	51.8	0	0	0	0	114.3	L333	L333-S335 PolarHBondContact O-N 3.15Å
336	E	94.6	Very high	97.5	Very high	69 Å²	69	43.4 Å²	43.4	32%	0.322	25%	0.254	S	S	.	.			trans	-87.3	130	-171.7	-50.6	-51.8	131.2	0	0	111.2	H296 R299 L333 G338	H296-E336 IonicContact NE2-OE2 3.94Å; R299-E336 IonicContact NH1-OE1 3.2Å; R299-E336 PolarHBondContact NH1-OE1 3.06Å; R299-E336 VanDerWaalsContact NH1-OE1 3.09Å; L333-E336 HydrophobicContact CB-CG 4.14Å; L333-E336 HydrophobicContact CD2-CG 4.24Å; L333-E336 WeakPolarHBondContact O-CB 3.4Å; L333-E336 PolarHBondContact O-N 3.47Å; E336-G338 PolarHBondContact O-N 3.03Å
337	D	90.9	Very high	97.5	Very high	139 Å²	139	39.1 Å²	39.1	74%	0.743	24%	0.235	S	C	*	.	S	Bend	trans	-80.2	65.8	172.7	-176.5	34.8	0	0	0	110.5	K225	K225-D337 IonicContact NZ-OD2 3.66Å
338	G	93.8	Very high	97.5	Very high	12 Å²	12	39.1 Å²	39.1	12%	0.124	24%	0.235	C	C	.	.	S	Bend	trans	109.6	123.3	-179.6	0	0	0	0	0	113.8	H296 E336	H296-G338 PolarHBondContact CE1-O 2.91Å; E336-G338 PolarHBondContact O-N 3.03Å
339	V	97.6	Very high	97.3	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.024	24%	0.238	C	C	.	.			trans	-98	105.3	-175.8	177.5	0	0	0	0	110.6	H296 F327 L333 T373 G403	H296-V339 HydrophobicContact CB-CG1 4.4Å; F327-V339 HydrophobicContact CD1-CG1 3.72Å; F327-V339 HydrophobicContact CD2-CG1 3.96Å; F327-V339 HydrophobicContact CE1-CG1 3.51Å; F327-V339 HydrophobicContact CE2-CG1 3.74Å; F327-V339 HydrophobicContact CG-CG1 3.94Å; F327-V339 HydrophobicContact CZ-CG1 3.5Å; L333-V339 HydrophobicContact CB-CG2 3.95Å; L333-V339 HydrophobicContact CD1-CB 4.41Å; L333-V339 HydrophobicContact CD1-CG1 3.52Å; L333-V339 HydrophobicContact CD1-CG2 3.98Å; V339-T373 VanDerWaalsContact O-CB 3.27Å; V339-T373 WeakPolarHBondContact O-CB 3.45Å; V339-T373 PolarHBondContact O-OG1 3.04Å; V339-G403 PolarHBondContact N-O 3.5Å; V339-G403 WeakPolarHBondContact O-CA 3.49Å
340	L	97.8	Very high	97	Very high	47 Å²	47	41.3 Å²	41.3	25%	0.246	23%	0.233	C	C	.	.			trans	-97.8	117.4	-176.9	-59.2	176	0	0	0	113.1	L232 C293 H296 T373 T374	L232-L340 HydrophobicContact CD1-CB 4.11Å; L232-L340 HydrophobicContact CD1-CD1 3.57Å; L232-L340 HydrophobicContact CD1-CG 4.44Å; C293-L340 HydrophobicContact CB-CB 4.36Å; C293-L340 WeakPolarHBondContact CB-O 3.4Å; C293-L340 PolarHBondContact N-O 2.98Å; H296-L340 PolarHBondContact ND1-N 2.91Å; H296-L340 PolarHBondContact ND1-O 2.91Å; L340-T373 WeakPolarHBondContact CA-OG1 3.36Å; L340-T374 HydrophobicContact CB-CG2 4.09Å; L340-T374 HydrophobicContact CD2-CG2 4.31Å
341	G	98	Very high	96.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	166.6	174.2	0	0	0	0	0	113.2	S291 H372 T373	S291-G341 CarbonylContact O-C 3.54Å; S291-G341 VanDerWaalsContact O-CA 3.28Å; S291-G341 WeakPolarHBondContact O-CA 3.45Å; G341-H372 CarbonylContact O-C 3.55Å; G341-H372 VanDerWaalsContact O-CA 3.29Å; G341-H372 WeakPolarHBondContact O-CA 3.46Å; G341-T373 PolarHBondContact N-OG1 3.17Å; G341-T373 PolarHBondContact O-N 3.45Å; G341-T373 PolarHBondContact O-OG1 2.94Å
342	G	98.6	Very high	94.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	156.9	173.3	0	0	0	0	0	111.3	T290 S291 S371	T290-G342 CarbonylContact C-O 3.56Å; T290-G342 WeakPolarHBondContact CA-O 3.21Å; S291-G342 PolarHBondContact N-O 2.74Å; S291-G342 PolarHBondContact O-N 3.27Å; G342-S371 CarbonylContact C-O 3.56Å; G342-S371 WeakPolarHBondContact CA-O 3.4Å
343	V	98.9	Very high	92.8	Very high	0 Å²	0	38 Å²	38	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	144.4	-175.8	-56.8	0	0	0	0	110	V288 S289 T290 L302 L319 M323 V345 W370 S371	V288-V343 HydrophobicContact CG1-CB 4.45Å; S289-V343 WeakPolarHBondContact O-CA 3.49Å; T290-V343 HydrophobicContact CG2-CG1 3.83Å; L302-V343 HydrophobicContact CD2-CG1 3.59Å; L302-V343 HydrophobicContact CG-CG1 4.07Å; L319-V343 HydrophobicContact CD1-CG2 3.97Å; L319-V343 HydrophobicContact CD2-CG2 4.5Å; M323-V343 HydrophobicContact SD-CG1 4.41Å; M323-V343 HydrophobicContact SD-CG2 4.14Å; V343-V345 HydrophobicContact CG2-CG2 4.21Å; V343-W370 VanDerWaalsContact O-CA 3.29Å; V343-W370 WeakPolarHBondContact O-CA 3.47Å; V343-S371 PolarHBondContact N-O 3.18Å; V343-S371 PolarHBondContact O-N 3.06Å
344	I	98.9	Very high	90.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	143.6	158.6	61.4	176.7	0	0	0	108.8	L45 H47 V238 V288 S289 W370 M377 V379	L45-I344 HydrophobicContact CD1-CG2 4.38Å; L45-I344 HydrophobicContact CD2-CB 3.66Å; L45-I344 HydrophobicContact CD2-CG2 4.09Å; L45-I344 HydrophobicContact CG-CB 3.88Å; L45-I344 HydrophobicContact CG-CD1 4.15Å; L45-I344 HydrophobicContact CG-CG2 4.06Å; L45-I344 WeakPolarHBondContact O-CD1 3.44Å; H47-I344 HydrophobicContact CB-CD1 4.47Å; H47-I344 HydrophobicContact CB-CG2 3.95Å; V238-I344 HydrophobicContact CG1-CD1 4.34Å; V238-I344 HydrophobicContact CG1-CG1 4.18Å; V238-I344 HydrophobicContact CG2-CD1 4.13Å; V238-I344 HydrophobicContact CG2-CG1 4.27Å; V288-I344 WeakPolarHBondContact CA-O 3.26Å; S289-I344 PolarHBondContact N-O 3.08Å; S289-I344 PolarHBondContact O-N 3.37Å; I344-W370 HydrophobicContact CG2-CB 4.14Å; I344-M377 HydrophobicContact CG2-CE 3.67Å; I344-V379 HydrophobicContact CG2-CG1 4Å
345	V	98.9	Very high	88.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	140.1	-174.1	170.4	0	0	0	0	109.5	A287 V288 L310 L319 V343 F368 L369	A287-V345 WeakPolarHBondContact O-CA 3.28Å; V288-V345 HydrophobicContact CG1-CG2 4.21Å; V288-V345 HydrophobicContact CG2-CG2 4.25Å; L310-V345 HydrophobicContact CD1-CB 4.25Å; L310-V345 HydrophobicContact CD1-CG1 3.14Å; L310-V345 HydrophobicContact CD1-CG2 4.09Å; L310-V345 HydrophobicContact CD2-CG1 3.84Å; L310-V345 HydrophobicContact CG-CG1 4.11Å; L319-V345 HydrophobicContact CD1-CG2 4.17Å; L319-V345 HydrophobicContact CD2-CG2 4.05Å; V343-V345 HydrophobicContact CG2-CG2 4.21Å; V345-F368 WeakPolarHBondContact O-CA 3.46Å; V345-L369 HydrophobicContact CB-CB 4.49Å; V345-L369 PolarHBondContact N-O 2.75Å; V345-L369 PolarHBondContact O-N 3.38Å
346	L	98.9	Very high	86.3	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	131.7	165.6	-174	156.1	0	0	0	108.7	F43 V238 V240 V246 T286 A287 V366	F43-L346 HydrophobicContact CD1-CD1 3.79Å; V238-L346 HydrophobicContact CB-CB 4.11Å; V238-L346 HydrophobicContact CG2-CB 3.64Å; V238-L346 HydrophobicContact CG2-CD1 4.42Å; V240-L346 HydrophobicContact CB-CD1 4.01Å; V240-L346 HydrophobicContact CB-CD2 3.79Å; V240-L346 HydrophobicContact CG1-CD1 3.77Å; V240-L346 HydrophobicContact CG1-CD2 4.03Å; V240-L346 HydrophobicContact CG1-CG 4.46Å; V240-L346 HydrophobicContact CG2-CD2 4.49Å; V246-L346 HydrophobicContact CG1-CD2 3.85Å; T286-L346 CarbonylContact C-O 3.56Å; T286-L346 WeakPolarHBondContact CA-O 3.41Å; A287-L346 HydrophobicContact CB-CB 4.47Å; A287-L346 PolarHBondContact N-O 2.83Å; A287-L346 PolarHBondContact O-N 3.06Å; L346-V366 HydrophobicContact CD1-CG1 4.14Å; L346-V366 HydrophobicContact CD2-CG1 4.16Å; L346-V366 HydrophobicContact CG-CG1 3.85Å
347	R	98.7	Very high	84.4	Confident	6 Å²	6	50.2 Å²	50.2	2%	0.023	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	136.8	171.6	-175.7	174.4	80.7	168.8	2.3	108.8	Y284 S285 T286 L310 A312 E313 A315 V366 E367	Y284-R347 HydrophobicContact CD1-CG 3.91Å; Y284-R347 HydrophobicContact CG-CG 3.75Å; S285-R347 CarbonylContact O-C 3.57Å; S285-R347 WeakPolarHBondContact O-CA 3.3Å; T286-R347 HydrophobicContact CG2-CB 4.25Å; T286-R347 HydrophobicContact CG2-CG 3.98Å; L310-R347 WeakPolarHBondContact O-CD 3.48Å; L310-R347 PolarHBondContact O-NH1 3.33Å; A312-R347 PolarHBondContact O-NH1 3.23Å; E313-R347 PolarHBondContact O-NH1 3.12Å; E313-R347 PolarHBondContact O-NH2 3.02Å; A315-R347 VanDerWaalsContact CB-CZ 3.47Å; R347-V366 CarbonylContact O-C 3.53Å; R347-V366 WeakPolarHBondContact O-CA 3.44Å; R347-E367 HydrophobicContact CB-CB 4.33Å; R347-E367 IonicContact CZ-OE1 2.68Å; R347-E367 IonicContact CZ-OE2 3.98Å; R347-E367 PolarHBondContact N-O 3.22Å; R347-E367 IonicContact NE-OE1 3.04Å; R347-E367 PolarHBondContact NE-OE1 2.89Å; R347-E367 IonicContact NE-OE2 2.75Å; R347-E367 IonicContact NH2-OE1 2.65Å; R347-E367 PolarHBondContact NH2-OE1 2.79Å; R347-E367 IonicContact NH2-OE2 3.32Å; R347-E367 PolarHBondContact NH2-OE2 3.34Å; R347-E367 PolarHBondContact O-N 3.21Å
348	S	98	Very high	82.6	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.007	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	150.5	176.4	64.8	0	0	0	0	113.7	S285 L365	S285-S348 PolarHBondContact N-O 3.2Å; S285-S348 PolarHBondContact O-N 3.08Å; S348-L365 WeakPolarHBondContact CA-O 3.49Å; S348-L365 WeakPolarHBondContact CB-O 3.32Å
349	C	95.7	Very high	80.6	Confident	29 Å²	29	54.5 Å²	54.5	20%	0.196	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	156.6	171.1	61.9	0	0	0	0	110.8	Y284 L364 L365	Y284-C349 HydrophobicContact CD1-CB 3.86Å; Y284-C349 HydrophobicContact CE1-CB 4.22Å; C349-L364 WeakPolarHBondContact O-CA 3.36Å; C349-L365 PolarHBondContact N-O 3.11Å; C349-L365 PolarHBondContact O-N 2.68Å
350	R	92.1	Very high	78.4	Confident	128 Å²	128	62 Å²	62	48%	0.483	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	131.1	172.5	-66.9	-178.6	-145.7	-87.5	-8.4	109.6	E243 Q362 L364	E243-R350 PolarHBondContact O-NH1 2.71Å; E243-R350 PolarHBondContact O-NH2 3.05Å; R350-Q362 VanDerWaalsContact CD-NE2 3.26Å; R350-L364 HydrophobicContact CB-CD2 4.47Å; R350-L364 HydrophobicContact CG-CD2 3.62Å
351	C	83.7	Confident	76.7	Confident	33 Å²	33	64.2 Å²	64.2	22%	0.223	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	125.4	168.6	-55.5	0	0	0	0	109.1	T363	C351-T363 PolarHBondContact N-O 3Å; C351-T363 PolarHBondContact O-N 2.9Å
352	S	67.4	Low	75.4	Confident	112 Å²	112	68.7 Å²	68.7	78%	0.783	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-77.3	138.8	163.2	45.2	0	0	0	0	109.5
353	A	55.8	Low	74.9	Confident	39 Å²	39	70 Å²	70	32%	0.322	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-68	150.5	169	0	0	0	0	0	110.2	S357	A353-S357 WeakPolarHBondContact CB-OG 3.2Å
354	E	50.4	Low	74.6	Confident	157 Å²	157	70.2 Å²	70.2	73%	0.734	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-51.8	143.4	168.3	-74.6	-82.7	159.4	0	0	110.3	D356 S357	E354-D356 PolarHBondContact O-N 2.95Å; E354-S357 PolarHBondContact O-N 3.48Å; E354-S357 PolarHBondContact O-OG 3.05Å
355	P	52.3	Low	74.5	Confident	125 Å²	125	72.3 Å²	72.3	81%	0.812	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-11	-174.1	20.6	-30.7	0	0	0	115.3
356	D	52	Low	74.5	Confident	165 Å²	165	72.3 Å²	72.3	88%	0.882	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	3.3	-176.8	-100.6	-13.4	0	0	0	115.5	E354	E354-D356 PolarHBondContact O-N 2.95Å
357	S	53.8	Low	74.5	Confident	58 Å²	58	74.2 Å²	74.2	41%	0.406	41%	0.41	S	S	.	.			trans	-94.2	118.5	173.8	65.2	0	0	0	0	111.3	A353 E354 Q359	A353-S357 WeakPolarHBondContact CB-OG 3.2Å; E354-S357 PolarHBondContact O-N 3.48Å; E354-S357 PolarHBondContact O-OG 3.05Å; S357-Q359 PolarHBondContact O-N 3.36Å
358	S	52.7	Low	74.5	Confident	130 Å²	130	74.4 Å²	74.4	91%	0.909	41%	0.411	S	S	*	.	S	Bend	trans	-64.7	8.2	179.3	52.9	0	0	0	0	115
359	Q	51.3	Low	74.6	Confident	111 Å²	111	74.8 Å²	74.8	52%	0.519	41%	0.413	S	S	.	.	S	Bend	trans	-130	109.1	172.7	-65.6	-172.2	-8.1	0	0	108.2	S357 K361	S357-Q359 PolarHBondContact O-N 3.36Å; Q359-K361 HydrophobicContact CB-CD 4.33Å; Q359-K361 HydrophobicContact CB-CG 4.19Å; Q359-K361 PolarHBondContact O-N 3.22Å
360	N	53.2	Low	74.7	Confident	162 Å²	162	73.9 Å²	73.9	87%	0.866	41%	0.405	S	S	*	.			trans	-71.3	59	178.6	-138.2	6.5	0	0	0	110.6	Q362	N360-Q362 PolarHBondContact O-N 2.65Å
361	K	61.6	Low	75	Confident	93 Å²	93	67.8 Å²	67.8	40%	0.404	38%	0.382	S	S	.	.			trans	-82.7	101.4	-175.9	-82.9	178.4	171.8	171	0	109.4	Q359 T363	Q359-K361 HydrophobicContact CB-CD 4.33Å; Q359-K361 HydrophobicContact CB-CG 4.19Å; Q359-K361 PolarHBondContact O-N 3.22Å; K361-T363 PolarHBondContact O-N 2.57Å
362	Q	70.9	Confident	75.7	Confident	94 Å²	94	66.2 Å²	66.2	44%	0.439	37%	0.372	S	S	.	.			trans	-71	125.9	172.5	-159.8	164.8	28	0	0	109.3	R350 N360 S417	R350-Q362 VanDerWaalsContact CD-NE2 3.26Å; N360-Q362 PolarHBondContact O-N 2.65Å; Q362-S417 VanDerWaalsContact O-CB 3.26Å; Q362-S417 WeakPolarHBondContact O-CB 3.43Å; Q362-S417 PolarHBondContact O-N 3.4Å; Q362-S417 PolarHBondContact O-OG 3.16Å
363	T	87.4	Confident	77.2	Confident	27 Å²	27	60.9 Å²	60.9	17%	0.166	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	152	176.5	59	0	0	0	0	110.1	C351 K361 R414 L415	C351-T363 PolarHBondContact N-O 3Å; C351-T363 PolarHBondContact O-N 2.9Å; K361-T363 PolarHBondContact O-N 2.57Å; T363-R414 HydrophobicContact CG2-CG 4.48Å; T363-L415 WeakPolarHBondContact CA-O 3.34Å
364	L	93.8	Very high	79.2	Confident	4 Å²	4	59 Å²	59	2%	0.021	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	127.5	170.2	-65.8	162.6	0	0	0	108.4	D241 C349 R350 R414 L415	D241-L364 WeakPolarHBondContact O-CD1 3.21Å; C349-L364 WeakPolarHBondContact O-CA 3.36Å; R350-L364 HydrophobicContact CB-CD2 4.47Å; R350-L364 HydrophobicContact CG-CD2 3.62Å; L364-R414 CarbonylContact O-C 3.52Å; L364-R414 WeakPolarHBondContact O-CA 3.29Å; L364-L415 HydrophobicContact CB-CB 4.19Å; L364-L415 PolarHBondContact N-O 3.14Å; L364-L415 PolarHBondContact O-N 3.22Å
365	L	96.8	Very high	81.3	Confident	45 Å²	45	54.5 Å²	54.5	24%	0.236	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	124.2	164.1	178.3	62.7	0	0	0	107.6	S348 C349	S348-L365 WeakPolarHBondContact CA-O 3.49Å; S348-L365 WeakPolarHBondContact CB-O 3.32Å; C349-L365 PolarHBondContact N-O 3.11Å; C349-L365 PolarHBondContact O-N 2.68Å
366	V	98.3	Very high	83.4	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	121.3	177.3	-176.2	0	0	0	0	108.5	F43 V240 L346 R347 V412 C413 L415	F43-V366 HydrophobicContact CB-CG1 4.47Å; F43-V366 HydrophobicContact CD1-CG1 4.13Å; F43-V366 HydrophobicContact CG-CG1 4.3Å; V240-V366 HydrophobicContact CG1-CG1 4.29Å; V240-V366 HydrophobicContact CG1-CG2 3.88Å; L346-V366 HydrophobicContact CD1-CG1 4.14Å; L346-V366 HydrophobicContact CD2-CG1 4.16Å; L346-V366 HydrophobicContact CG-CG1 3.85Å; R347-V366 CarbonylContact O-C 3.53Å; R347-V366 WeakPolarHBondContact O-CA 3.44Å; V366-V412 CarbonylContact O-C 3.58Å; V366-V412 VanDerWaalsContact O-CA 3.31Å; V366-V412 WeakPolarHBondContact O-CA 3.22Å; V366-C413 WeakPolarHBondContact CA-O 3.2Å; V366-C413 HydrophobicContact CB-CB 4.39Å; V366-C413 WeakPolarHBondContact CB-O 3.39Å; V366-C413 PolarHBondContact N-O 3.28Å; V366-C413 PolarHBondContact O-N 2.96Å; V366-L415 HydrophobicContact CG2-CD1 3.66Å; V366-L415 HydrophobicContact CG2-CG 3.98Å
367	E	98.8	Very high	85.6	Confident	39 Å²	39	40.7 Å²	40.7	18%	0.182	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	134.6	165.8	-73.5	165.5	-82.4	0	0	108.4	R347 L369 V412	R347-E367 HydrophobicContact CB-CB 4.33Å; R347-E367 IonicContact CZ-OE1 2.68Å; R347-E367 IonicContact CZ-OE2 3.98Å; R347-E367 PolarHBondContact N-O 3.22Å; R347-E367 IonicContact NE-OE1 3.04Å; R347-E367 PolarHBondContact NE-OE1 2.89Å; R347-E367 IonicContact NE-OE2 2.75Å; R347-E367 IonicContact NH2-OE1 2.65Å; R347-E367 PolarHBondContact NH2-OE1 2.79Å; R347-E367 IonicContact NH2-OE2 3.32Å; R347-E367 PolarHBondContact NH2-OE2 3.34Å; R347-E367 PolarHBondContact O-N 3.21Å; E367-L369 HydrophobicContact CB-CD1 4.46Å; E367-V412 HydrophobicContact CG-CG1 3.91Å
368	F	98.8	Very high	87.7	Confident	11 Å²	11	37.9 Å²	37.9	5%	0.048	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	135.1	178.6	62.9	-89.4	0	0	0	109.6	F43 L45 V345 W370 Y381 G410 G411 C413	F43-F368 HydrophobicContact CE1-CB 3.71Å; F43-F368 AromaticContact CE1-CD1 3.78Å; F43-F368 HydrophobicContact CE1-CD1 3.78Å; F43-F368 HydrophobicContact CE1-CD2 4.39Å; F43-F368 AromaticContact CE1-CG 3.7Å; F43-F368 HydrophobicContact CE1-CG 3.7Å; F43-F368 AromaticContact CE2-CD1 3.91Å; F43-F368 HydrophobicContact CE2-CD1 3.91Å; F43-F368 AromaticContact CE2-CE1 3.9Å; F43-F368 HydrophobicContact CE2-CE1 3.9Å; F43-F368 HydrophobicContact CE2-CG 4.5Å; F43-F368 HydrophobicContact CE2-CZ 4.49Å; F43-F368 HydrophobicContact CZ-CB 4.03Å; F43-F368 AromaticContact CZ-CD1 3.27Å; F43-F368 HydrophobicContact CZ-CD1 3.27Å; F43-F368 AromaticContact CZ-CD2 3.94Å; F43-F368 HydrophobicContact CZ-CD2 3.94Å; F43-F368 AromaticContact CZ-CE1 3.59Å; F43-F368 HydrophobicContact CZ-CE1 3.59Å; F43-F368 HydrophobicContact CZ-CE2 4.21Å; F43-F368 AromaticContact CZ-CG 3.46Å; F43-F368 HydrophobicContact CZ-CG 3.46Å; F43-F368 VanDerWaalsContact CZ-CG 3.46Å; F43-F368 HydrophobicContact CZ-CZ 4.05Å; L45-F368 HydrophobicContact CD2-CB 4.21Å; V345-F368 WeakPolarHBondContact O-CA 3.46Å; F368-W370 HydrophobicContact CD2-CZ3 4.03Å; F368-W370 AromaticContact CE2-CZ3 3.95Å; F368-W370 HydrophobicContact CE2-CZ3 3.95Å; F368-Y381 HydrophobicContact CE2-CD1 4.26Å; F368-Y381 AromaticContact CE2-CD2 3.88Å; F368-Y381 HydrophobicContact CE2-CD2 3.88Å; F368-Y381 HydrophobicContact CE2-CE1 4.3Å; F368-Y381 AromaticContact CE2-CE2 3.91Å; F368-Y381 HydrophobicContact CE2-CE2 3.91Å; F368-Y381 HydrophobicContact CE2-CG 4.07Å; F368-Y381 AromaticContact CZ-CD2 3.96Å; F368-Y381 HydrophobicContact CZ-CD2 3.96Å; F368-Y381 AromaticContact CZ-CE2 3.84Å; F368-Y381 HydrophobicContact CZ-CE2 3.84Å; F368-G410 CarbonylContact O-C 3.5Å; F368-G410 WeakPolarHBondContact O-CA 3.48Å; F368-G411 WeakPolarHBondContact CD1-O 3.29Å; F368-G411 VanDerWaalsContact CE1-C 3.43Å; F368-G411 PolarHBondContact N-O 3.33Å; F368-G411 PolarHBondContact O-N 3.49Å; F368-C413 HydrophobicContact CE1-CB 4.29Å
369	L	98.9	Very high	89.9	Confident	8 Å²	8	31.7 Å²	31.7	4%	0.042	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	155.1	-176.1	-59.2	93.7	0	0	0	110.1	L45 A315 H316 L319 V345 E367 I408 E409	L45-L369 WeakPolarHBondContact CD2-O 3.27Å; A315-L369 HydrophobicContact CB-CD1 4.03Å; H316-L369 HydrophobicContact CB-CD2 4.02Å; L319-L369 HydrophobicContact CD2-CB 3.79Å; L319-L369 HydrophobicContact CD2-CD2 4.29Å; V345-L369 HydrophobicContact CB-CB 4.49Å; V345-L369 PolarHBondContact N-O 2.75Å; V345-L369 PolarHBondContact O-N 3.38Å; E367-L369 HydrophobicContact CB-CD1 4.46Å; L369-I408 HydrophobicContact CD2-CD1 4.23Å; L369-E409 VanDerWaalsContact CA-O 3.32Å; L369-E409 WeakPolarHBondContact CA-O 3.45Å
370	W	98.9	Very high	92.2	Very high	10 Å²	10	26.4 Å²	26.4	4%	0.038	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	144.8	162.9	57.2	86.5	0	0	0	109.3	L45 V343 I344 F368 V379 Y381 H392 S394 I408 E409	L45-W370 HydrophobicContact CD1-CE3 4.31Å; V343-W370 VanDerWaalsContact O-CA 3.29Å; V343-W370 WeakPolarHBondContact O-CA 3.47Å; I344-W370 HydrophobicContact CG2-CB 4.14Å; F368-W370 HydrophobicContact CD2-CZ3 4.03Å; F368-W370 AromaticContact CE2-CZ3 3.95Å; F368-W370 HydrophobicContact CE2-CZ3 3.95Å; W370-V379 HydrophobicContact CB-CG1 3.97Å; W370-V379 HydrophobicContact CD2-CG1 4.33Å; W370-V379 HydrophobicContact CD2-CG2 3.86Å; W370-V379 HydrophobicContact CE3-CG2 4.1Å; W370-V379 HydrophobicContact CG-CG1 3.97Å; W370-V379 HydrophobicContact CG-CG2 4.29Å; W370-V379 HydrophobicContact CZ2-CG2 4.32Å; W370-V379 HydrophobicContact CZ3-CG2 4.43Å; W370-Y381 HydrophobicContact CH2-CE1 4.01Å; W370-Y381 HydrophobicContact CZ3-CD1 4.12Å; W370-Y381 HydrophobicContact CZ3-CE1 4.02Å; W370-H392 AromaticContact CZ2-CD2 3.93Å; W370-S394 PolarHBondContact NE1-OG 3.44Å; W370-I408 WeakPolarHBondContact O-CA 3.45Å; W370-E409 HydrophobicContact CD2-CB 4.42Å; W370-E409 HydrophobicContact CH2-CB 4.44Å; W370-E409 HydrophobicContact CZ2-CB 3.59Å; W370-E409 HydrophobicContact CZ2-CG 4.4Å; W370-E409 PolarHBondContact N-O 3.4Å; W370-E409 PolarHBondContact NE1-OE1 3.2Å; W370-E409 VanDerWaalsContact NE1-OE1 3.11Å; W370-E409 PolarHBondContact O-N 3.43Å
371	S	98.9	Very high	94.3	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	144.7	175.9	-175.7	0	0	0	0	110.8	G342 V343 V406 A407	G342-S371 CarbonylContact C-O 3.56Å; G342-S371 WeakPolarHBondContact CA-O 3.4Å; V343-S371 PolarHBondContact N-O 3.18Å; V343-S371 PolarHBondContact O-N 3.06Å; S371-V406 WeakPolarHBondContact OG-CG1 3.49Å; S371-A407 CarbonylContact C-O 3.44Å; S371-A407 WeakPolarHBondContact CA-O 3.45Å; S371-A407 WeakPolarHBondContact CB-O 3.49Å; S371-A407 PolarHBondContact OG-O 3.04Å
372	H	98.8	Very high	96.1	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	157.8	177.6	66.7	85.3	0	0	0	112.8	G341 T374 M377 S394 A407	G341-H372 CarbonylContact O-C 3.55Å; G341-H372 VanDerWaalsContact O-CA 3.29Å; G341-H372 WeakPolarHBondContact O-CA 3.46Å; H372-T374 PolarHBondContact CE1-O 2.98Å; H372-T374 VanDerWaalsContact CE1-O 3.23Å; H372-T374 PolarHBondContact ND1-O 3.38Å; H372-M377 HydrophobicContact CB-CB 4.19Å; H372-M377 HydrophobicContact CB-SD 4.1Å; H372-M377 WeakPolarHBondContact CD2-CB 3.47Å; H372-S394 WeakPolarHBondContact NE2-CB 3.45Å; H372-S394 PolarHBondContact NE2-OG 3.12Å; H372-A407 PolarHBondContact N-O 3.22Å; H372-A407 PolarHBondContact O-N 2.76Å
373	T	98.5	Very high	97.4	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.062	C	C	.	.	S	Bend	trans	-109.9	-8.4	173.4	64.2	0	0	0	0	112.4	M323 F327 I328 V339 L340 G341 A402 G403 S405 V406	M323-T373 HydrophobicContact CE-CG2 4.11Å; F327-T373 HydrophobicContact CD1-CG2 4.13Å; F327-T373 HydrophobicContact CE1-CG2 4.25Å; I328-T373 HydrophobicContact CD1-CG2 3.7Å; I328-T373 HydrophobicContact CG1-CG2 3.74Å; V339-T373 VanDerWaalsContact O-CB 3.27Å; V339-T373 WeakPolarHBondContact O-CB 3.45Å; V339-T373 PolarHBondContact O-OG1 3.04Å; L340-T373 WeakPolarHBondContact CA-OG1 3.36Å; G341-T373 PolarHBondContact N-OG1 3.17Å; G341-T373 PolarHBondContact O-N 3.45Å; G341-T373 PolarHBondContact O-OG1 2.94Å; T373-A402 CarbonylContact O-C 3.6Å; T373-A402 WeakPolarHBondContact O-CA 3.48Å; T373-G403 PolarHBondContact O-N 3.28Å; T373-S405 VanDerWaalsContact CA-O 3.29Å; T373-S405 WeakPolarHBondContact CA-O 3.34Å; T373-S405 WeakPolarHBondContact CB-O 3.29Å; T373-V406 HydrophobicContact CG2-CG2 4.22Å
374	T	97.1	Very high	97.6	Very high	1 Å²	1	11.6 Å²	11.6	1%	0.006	5%	0.054	C	C	.	.	S	Bend	trans	-71.8	168.3	172.7	55.6	0	0	0	0	110.9	A50 G51 L340 H372 S376 L396	A50-T374 HydrophobicContact CB-CG2 4.16Å; G51-T374 PolarHBondContact N-OG1 2.97Å; L340-T374 HydrophobicContact CB-CG2 4.09Å; L340-T374 HydrophobicContact CD2-CG2 4.31Å; H372-T374 PolarHBondContact CE1-O 2.98Å; H372-T374 VanDerWaalsContact CE1-O 3.23Å; H372-T374 PolarHBondContact ND1-O 3.38Å; T374-S376 PolarHBondContact O-N 3.31Å; T374-S376 PolarHBondContact OG1-O 3.01Å; T374-L396 VanDerWaalsContact O-CD1 3.32Å; T374-L396 WeakPolarHBondContact O-CD1 3.45Å; T374-L396 VanDerWaalsContact O-CG 3.28Å; T374-L396 WeakPolarHBondContact O-CG 3.46Å
375	E	95.6	Very high	97.4	Very high	61 Å²	61	14.9 Å²	14.9	29%	0.285	7%	0.069	S	C	.	.	S	Bend	trans	-56.7	-36.4	177.8	-69.1	-170.4	-152.4	0	0	113.1	Y52 N227 R395 L396 A402	Y52-E375 HydrophobicContact CD2-CB 4.34Å; Y52-E375 WeakPolarHBondContact CD2-OE2 3.41Å; Y52-E375 VanDerWaalsContact CE2-OE2 3.26Å; Y52-E375 WeakPolarHBondContact CE2-OE2 3.49Å; N227-E375 PolarHBondContact ND2-OE1 2.8Å; E375-R395 WeakPolarHBondContact O-CA 3.26Å; E375-L396 PolarHBondContact O-N 3.27Å; E375-L396 VanDerWaalsContact O-N 3.16Å; E375-A402 HydrophobicContact CG-CB 3.87Å
376	S	96.4	Very high	97	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	162.4	-178.6	54.7	0	0	0	0	113	G51 H53 T374 S394	G51-S376 PolarHBondContact N-O 3.11Å; G51-S376 PolarHBondContact O-N 2.73Å; G51-S376 PolarHBondContact O-OG 3.37Å; H53-S376 PolarHBondContact N-OG 3.48Å; H53-S376 PolarHBondContact ND1-OG 3.05Å; T374-S376 PolarHBondContact O-N 3.31Å; T374-S376 PolarHBondContact OG1-O 3.01Å; S376-S394 CarbonylContact C-O 3.37Å; S376-S394 WeakPolarHBondContact CA-O 3.26Å; S376-S394 WeakPolarHBondContact CB-O 3.29Å
377	M	97.8	Very high	96.3	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	128.5	171.9	-172.3	174.5	-175.8	0	0	110.3	H47 G49 A50 I344 H372 V379 S394	H47-M377 HydrophobicContact CB-CE 3.5Å; H47-M377 VanDerWaalsContact CB-CE 3.5Å; G49-M377 WeakPolarHBondContact O-CA 3.43Å; G49-M377 WeakPolarHBondContact O-CG 3.38Å; A50-M377 HydrophobicContact CB-CB 4.34Å; A50-M377 HydrophobicContact CB-CG 4.05Å; A50-M377 HydrophobicContact CB-SD 4.19Å; I344-M377 HydrophobicContact CG2-CE 3.67Å; H372-M377 HydrophobicContact CB-CB 4.19Å; H372-M377 HydrophobicContact CB-SD 4.1Å; H372-M377 WeakPolarHBondContact CD2-CB 3.47Å; M377-V379 HydrophobicContact CE-CG1 4.49Å; M377-V379 HydrophobicContact CG-CG1 4.17Å; M377-V379 HydrophobicContact SD-CG1 4.48Å; M377-S394 PolarHBondContact N-O 2.95Å; M377-S394 PolarHBondContact O-N 2.88Å
378	C	98	Very high	96.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	124.9	175	-177.6	0	0	0	0	110.4	H47 A48 G49 Y61 C65 I393	H47-C378 CarbonylContact C-O 3.57Å; H47-C378 WeakPolarHBondContact CA-O 3.27Å; A48-C378 HydrophobicContact CB-CB 4.35Å; A48-C378 PolarHBondContact N-O 3.35Å; G49-C378 PolarHBondContact O-N 3.27Å; Y61-C378 VanDerWaalsContact C-SG 3.53Å; C65-C378 VanDerWaalsContact SG-SG 3.67Å; C378-I393 HydrophobicContact CB-CD1 3.47Å; C378-I393 VanDerWaalsContact CB-CD1 3.47Å; C378-I393 WeakPolarHBondContact SG-CD1 3.23Å
379	V	98.8	Very high	96	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	153.5	179.3	-60.8	0	0	0	0	111.9	L45 V46 I344 W370 M377 T391 H392	L45-V379 HydrophobicContact CD1-CB 4.27Å; V46-V379 CarbonylContact O-C 3.53Å; V46-V379 VanDerWaalsContact O-CA 3.27Å; V46-V379 WeakPolarHBondContact O-CA 3.35Å; I344-V379 HydrophobicContact CG2-CG1 4Å; W370-V379 HydrophobicContact CB-CG1 3.97Å; W370-V379 HydrophobicContact CD2-CG1 4.33Å; W370-V379 HydrophobicContact CD2-CG2 3.86Å; W370-V379 HydrophobicContact CE3-CG2 4.1Å; W370-V379 HydrophobicContact CG-CG1 3.97Å; W370-V379 HydrophobicContact CG-CG2 4.29Å; W370-V379 HydrophobicContact CZ2-CG2 4.32Å; W370-V379 HydrophobicContact CZ3-CG2 4.43Å; M377-V379 HydrophobicContact CE-CG1 4.49Å; M377-V379 HydrophobicContact CG-CG1 4.17Å; M377-V379 HydrophobicContact SD-CG1 4.48Å; V379-T391 WeakPolarHBondContact O-CA 3.35Å; V379-H392 HydrophobicContact CG2-CB 3.96Å; V379-H392 PolarHBondContact N-O 3.39Å; V379-H392 PolarHBondContact O-N 3.03Å
380	G	98.8	Very high	96	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	143.7	167.7	0	0	0	0	0	110.9	L45 V46 C69 K390	L45-G380 CarbonylContact C-O 3.55Å; L45-G380 WeakPolarHBondContact CA-O 3.43Å; V46-G380 WeakPolarHBondContact CG2-O 3.39Å; V46-G380 PolarHBondContact N-O 3.25Å; V46-G380 PolarHBondContact O-N 3.4Å; C69-G380 PolarHBondContact SG-O 3.45Å; C69-G380 VanDerWaalsContact SG-O 3.41Å; G380-K390 CarbonylContact C-O 3.49Å; G380-K390 WeakPolarHBondContact CA-O 3.45Å
381	Y	98.8	Very high	96	Very high	48 Å²	48	32 Å²	32	19%	0.188	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	153.5	178.5	59.5	-87	0	0	0	111.7	F43 V44 L45 F368 W370 A389 K390	F43-Y381 HydrophobicContact CE2-CD2 4.26Å; F43-Y381 HydrophobicContact CZ-CD2 4.01Å; F43-Y381 HydrophobicContact CZ-CG 4.27Å; V44-Y381 CarbonylContact O-C 3.58Å; V44-Y381 WeakPolarHBondContact O-CA 3.44Å; V44-Y381 WeakPolarHBondContact O-CB 3.44Å; L45-Y381 HydrophobicContact CD1-CD1 4.45Å; F368-Y381 HydrophobicContact CE2-CD1 4.26Å; F368-Y381 AromaticContact CE2-CD2 3.88Å; F368-Y381 HydrophobicContact CE2-CD2 3.88Å; F368-Y381 HydrophobicContact CE2-CE1 4.3Å; F368-Y381 AromaticContact CE2-CE2 3.91Å; F368-Y381 HydrophobicContact CE2-CE2 3.91Å; F368-Y381 HydrophobicContact CE2-CG 4.07Å; F368-Y381 AromaticContact CZ-CD2 3.96Å; F368-Y381 HydrophobicContact CZ-CD2 3.96Å; F368-Y381 AromaticContact CZ-CE2 3.84Å; F368-Y381 HydrophobicContact CZ-CE2 3.84Å; W370-Y381 HydrophobicContact CH2-CE1 4.01Å; W370-Y381 HydrophobicContact CZ3-CD1 4.12Å; W370-Y381 HydrophobicContact CZ3-CE1 4.02Å; Y381-A389 WeakPolarHBondContact O-CA 3.37Å; Y381-K390 HydrophobicContact CD1-CB 4.43Å; Y381-K390 HydrophobicContact CD2-CB 4.29Å; Y381-K390 HydrophobicContact CD2-CD 4.38Å; Y381-K390 HydrophobicContact CE1-CB 3.94Å; Y381-K390 HydrophobicContact CE2-CB 3.8Å; Y381-K390 HydrophobicContact CE2-CD 3.45Å; Y381-K390 VanDerWaalsContact CE2-CD 3.45Å; Y381-K390 HydrophobicContact CE2-CG 4.22Å; Y381-K390 PolarHBondContact N-O 2.96Å; Y381-K390 PolarHBondContact O-N 2.99Å; Y381-K390 WeakPolarHBondContact OH-CD 3.21Å
382	M	98.4	Very high	95.9	Very high	14 Å²	14	35.3 Å²	35.3	7%	0.069	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	135.1	-177.3	-170.1	170.4	165.6	0	0	111	F43 V44 C69 Q70 I73 G387 A389	F43-M382 WeakPolarHBondContact CA-O 3.41Å; V44-M382 HydrophobicContact CG1-CB 4Å; V44-M382 PolarHBondContact N-O 2.85Å; V44-M382 PolarHBondContact O-N 3.49Å; C69-M382 HydrophobicContact CB-CB 3.8Å; C69-M382 HydrophobicContact CB-SD 4.33Å; Q70-M382 HydrophobicContact CG-SD 4.25Å; I73-M382 HydrophobicContact CB-CE 4.25Å; I73-M382 HydrophobicContact CB-SD 4.4Å; I73-M382 HydrophobicContact CG1-CB 4.07Å; I73-M382 HydrophobicContact CG1-CE 4.16Å; I73-M382 HydrophobicContact CG1-CG 3.82Å; I73-M382 HydrophobicContact CG1-SD 3.9Å; I73-M382 HydrophobicContact CG2-CE 4.09Å; M382-G387 VanDerWaalsContact CE-C 3.47Å; M382-G387 WeakPolarHBondContact CE-O 3.2Å; M382-A389 HydrophobicContact CB-CB 4.04Å; M382-A389 HydrophobicContact CG-CB 4.2Å; M382-A389 HydrophobicContact SD-CB 3.77Å
383	S	97.4	Very high	95.9	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.014	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	141.7	163.3	171.4	0	0	0	0	109.7	Q385 D386 G387	S383-Q385 PolarHBondContact O-N 3.01Å; S383-Q385 PolarHBondContact OG-N 3.39Å; S383-D386 PolarHBondContact O-N 3.23Å; S383-G387 PolarHBondContact O-N 2.92Å
384	A	93.1	Very high	95.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-25.9	173.2	0	0	0	0	0	112.7	R40 G42 I73 Q77	R40-A384 WeakPolarHBondContact O-CB 3.35Å; G42-A384 WeakPolarHBondContact O-CB 3.35Å; G42-A384 PolarHBondContact O-N 3.1Å; I73-A384 HydrophobicContact CD1-CB 4.14Å; I73-A384 HydrophobicContact CG2-CB 4.03Å; Q77-A384 HydrophobicContact CG-CB 4.44Å; Q77-A384 PolarHBondContact NE2-O 2.85Å
385	Q	88.3	Confident	95.9	Very high	74 Å²	74	41 Å²	41	35%	0.346	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-34.2	-177.9	-67.3	169.1	-4.7	0	0	112.2	S383 G387 E416	S383-Q385 PolarHBondContact O-N 3.01Å; S383-Q385 PolarHBondContact OG-N 3.39Å; Q385-G387 VanDerWaalsContact C-N 3.34Å; Q385-G387 PolarHBondContact O-N 3.09Å; Q385-E416 VanDerWaalsContact NE2-N 3.14Å; Q385-E416 PolarHBondContact NE2-O 3.26Å
386	D	88.1	Confident	96	Very high	94 Å²	94	39.4 Å²	39.4	50%	0.503	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-28.3	177.3	-78.4	16.4	0	0	0	112.8	S383 K388 K390	S383-D386 PolarHBondContact O-N 3.23Å; D386-K388 PolarHBondContact O-N 3.23Å; D386-K390 IonicContact OD2-NZ 2.9Å; D386-K390 PolarHBondContact OD2-NZ 2.7Å
387	G	84.3	Confident	96	Very high	50 Å²	50	42.8 Å²	42.8	52%	0.515	22%	0.219	S	C	.	.			trans	71.2	-6.2	175.6	0	0	0	0	0	116.4	M382 S383 Q385	M382-G387 VanDerWaalsContact CE-C 3.47Å; M382-G387 WeakPolarHBondContact CE-O 3.2Å; S383-G387 PolarHBondContact O-N 2.92Å; Q385-G387 VanDerWaalsContact C-N 3.34Å; Q385-G387 PolarHBondContact O-N 3.09Å
388	K	94.1	Very high	95.9	Very high	166 Å²	166	49.4 Å²	49.4	72%	0.722	26%	0.263	S	S	*	.	S	Bend	trans	-132.2	123.1	178	-168.8	176.7	-179.2	-179.2	0	112.1	D386	D386-K388 PolarHBondContact O-N 3.23Å
389	A	97.7	Very high	95.8	Very high	12 Å²	12	53.3 Å²	53.3	10%	0.099	30%	0.303	C	S	.	.			trans	-66.1	138	172.8	0	0	0	0	0	111.6	K66 C69 Y381 M382	K66-A389 HydrophobicContact CG-CB 3.89Å; C69-A389 HydrophobicContact CB-CB 3.82Å; Y381-A389 WeakPolarHBondContact O-CA 3.37Å; M382-A389 HydrophobicContact CB-CB 4.04Å; M382-A389 HydrophobicContact CG-CB 4.2Å; M382-A389 HydrophobicContact SD-CB 3.77Å
390	K	98.6	Very high	95.7	Very high	99 Å²	99	55 Å²	55	43%	0.43	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	140.1	172.3	-67.2	164.3	-176.7	160.4	0	107.9	G380 Y381 D386	G380-K390 CarbonylContact C-O 3.49Å; G380-K390 WeakPolarHBondContact CA-O 3.45Å; Y381-K390 HydrophobicContact CD1-CB 4.43Å; Y381-K390 HydrophobicContact CD2-CB 4.29Å; Y381-K390 HydrophobicContact CD2-CD 4.38Å; Y381-K390 HydrophobicContact CE1-CB 3.94Å; Y381-K390 HydrophobicContact CE2-CB 3.8Å; Y381-K390 HydrophobicContact CE2-CD 3.45Å; Y381-K390 VanDerWaalsContact CE2-CD 3.45Å; Y381-K390 HydrophobicContact CE2-CG 4.22Å; Y381-K390 PolarHBondContact N-O 2.96Å; Y381-K390 PolarHBondContact O-N 2.99Å; Y381-K390 WeakPolarHBondContact OH-CD 3.21Å; D386-K390 IonicContact OD2-NZ 2.9Å; D386-K390 PolarHBondContact OD2-NZ 2.7Å
391	T	98.6	Very high	95.6	Very high	50 Å²	50	59 Å²	59	31%	0.307	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	139.4	-177.2	59.5	0	0	0	0	110.1	K62 C65 K66 V379	K62-T391 HydrophobicContact CB-CG2 4.49Å; K62-T391 WeakPolarHBondContact O-CG2 3.26Å; C65-T391 HydrophobicContact CB-CG2 4.29Å; K66-T391 HydrophobicContact CB-CG2 3.89Å; V379-T391 WeakPolarHBondContact O-CA 3.35Å
392	H	98.1	Very high	95.5	Very high	70 Å²	70	58.5 Å²	58.5	32%	0.324	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	146.8	-172.4	-178.3	68.3	0	0	0	110.7	W370 V379 S394 E409	W370-H392 AromaticContact CZ2-CD2 3.93Å; V379-H392 HydrophobicContact CG2-CB 3.96Å; V379-H392 PolarHBondContact N-O 3.39Å; V379-H392 PolarHBondContact O-N 3.03Å; H392-S394 PolarHBondContact CD2-N 3.24Å; H392-S394 VanDerWaalsContact CD2-N 3.32Å; H392-S394 WeakPolarHBondContact NE2-CA 3.29Å; H392-S394 PolarHBondContact NE2-N 2.88Å; H392-E409 IonicContact CD2-OE1 3.81Å; H392-E409 IonicContact NE2-OE1 2.89Å; H392-E409 PolarHBondContact NE2-OE1 3.27Å; H392-E409 IonicContact NE2-OE2 3.27Å
393	I	97.8	Very high	95.4	Very high	24 Å²	24	57.8 Å²	57.8	12%	0.123	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	100.4	167.8	-57.9	-62.7	0	0	0	105.5	H53 A58 K62 C378 R395	H53-I393 HydrophobicContact CB-CG2 4.34Å; A58-I393 HydrophobicContact CB-CD1 4.43Å; A58-I393 HydrophobicContact CB-CG1 4.16Å; K62-I393 HydrophobicContact CD-CG1 4.17Å; K62-I393 HydrophobicContact CG-CD1 4.01Å; K62-I393 HydrophobicContact CG-CG1 4.21Å; C378-I393 HydrophobicContact CB-CD1 3.47Å; C378-I393 VanDerWaalsContact CB-CD1 3.47Å; C378-I393 WeakPolarHBondContact SG-CD1 3.23Å; I393-R395 HydrophobicContact CG2-CG 4.14Å
394	S	98.3	Very high	95.3	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	140.6	172.9	-168.4	0	0	0	0	108.5	W370 H372 S376 M377 H392 E409	W370-S394 PolarHBondContact NE1-OG 3.44Å; H372-S394 WeakPolarHBondContact NE2-CB 3.45Å; H372-S394 PolarHBondContact NE2-OG 3.12Å; S376-S394 CarbonylContact C-O 3.37Å; S376-S394 WeakPolarHBondContact CA-O 3.26Å; S376-S394 WeakPolarHBondContact CB-O 3.29Å; M377-S394 PolarHBondContact N-O 2.95Å; M377-S394 PolarHBondContact O-N 2.88Å; H392-S394 PolarHBondContact CD2-N 3.24Å; H392-S394 VanDerWaalsContact CD2-N 3.32Å; H392-S394 WeakPolarHBondContact NE2-CA 3.29Å; H392-S394 PolarHBondContact NE2-N 2.88Å; S394-E409 WeakPolarHBondContact CB-OE1 3.43Å; S394-E409 PolarHBondContact OG-OE1 3.48Å
395	R	97.6	Very high	95.6	Very high	97 Å²	97	64.3 Å²	64.3	37%	0.366	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	148.5	-179.1	-65.1	-165.7	179.4	-80.8	0.9	109.2	H53 E375 I393	H53-R395 PolarHBondContact O-NH1 3.28Å; H53-R395 PolarHBondContact O-NH2 2.7Å; E375-R395 WeakPolarHBondContact O-CA 3.26Å; I393-R395 HydrophobicContact CG2-CG 4.14Å
396	L	97.7	Very high	96.1	Very high	27 Å²	27	62 Å²	62	14%	0.141	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-58.6	143.2	169.8	-72.8	174.1	0	0	0	110.7	T374 E375 A400 A402 A407	T374-L396 VanDerWaalsContact O-CD1 3.32Å; T374-L396 WeakPolarHBondContact O-CD1 3.45Å; T374-L396 VanDerWaalsContact O-CG 3.28Å; T374-L396 WeakPolarHBondContact O-CG 3.46Å; E375-L396 PolarHBondContact O-N 3.27Å; E375-L396 VanDerWaalsContact O-N 3.16Å; L396-A400 HydrophobicContact CB-CB 4.06Å; L396-A402 HydrophobicContact CD1-CB 3.92Å; L396-A407 HydrophobicContact CD2-CB 3.95Å
397	P	96.1	Very high	96.6	Very high	71 Å²	71	57.9 Å²	57.9	46%	0.461	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-58.5	156.7	176.4	-24.8	33.9	0	0	0	113	G399 A400	P397-G399 PolarHBondContact O-N 2.95Å; P397-A400 HydrophobicContact CB-CB 4.44Å; P397-A400 VanDerWaalsContact O-CB 3.28Å; P397-A400 WeakPolarHBondContact O-CB 3.5Å; P397-A400 PolarHBondContact O-N 3.42Å
398	P	95.7	Very high	97.3	Very high	140 Å²	140	56.9 Å²	56.9	91%	0.909	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	127.4	172.4	-24.9	34.5	0	0	0	111.7	A400	P398-A400 VanDerWaalsContact C-N 3.32Å
399	G	95.6	Very high	97.5	Very high	82 Å²	82	52.4 Å²	52.4	85%	0.845	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.1	-8.7	-178.8	0	0	0	0	0	115.4	P397	P397-G399 PolarHBondContact O-N 2.95Å
400	A	97.1	Very high	97.5	Very high	34 Å²	34	53.8 Å²	53.8	28%	0.281	33%	0.327	S	S	.	.			trans	-73.8	149.2	171.7	0	0	0	0	0	111.3	L396 P397 P398	L396-A400 HydrophobicContact CB-CB 4.06Å; P397-A400 HydrophobicContact CB-CB 4.44Å; P397-A400 VanDerWaalsContact O-CB 3.28Å; P397-A400 WeakPolarHBondContact O-CB 3.5Å; P397-A400 PolarHBondContact O-N 3.42Å; P398-A400 VanDerWaalsContact C-N 3.32Å
401	V	96.1	Very high	97.5	Very high	86 Å²	86	50.4 Å²	50.4	52%	0.521	32%	0.319	S	S	.	.			trans	-109.6	123.6	-175.2	179.6	0	0	0	0	109.6	G403 Q404 S405	V401-G403 PolarHBondContact O-N 3.45Å; V401-Q404 HydrophobicContact CB-CB 4.13Å; V401-Q404 HydrophobicContact CG1-CB 4.2Å; V401-Q404 HydrophobicContact CG1-CG 4.08Å; V401-Q404 PolarHBondContact O-N 3.47Å; V401-S405 PolarHBondContact N-OG 3.49Å; V401-S405 PolarHBondContact O-N 2.81Å; V401-S405 PolarHBondContact O-OG 3.26Å
402	A	96.1	Very high	97.5	Very high	36 Å²	36	53.1 Å²	53.1	30%	0.298	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	134.1	176.4	0	0	0	0	0	111.1	T373 E375 L396 Q404	T373-A402 CarbonylContact O-C 3.6Å; T373-A402 WeakPolarHBondContact O-CA 3.48Å; E375-A402 HydrophobicContact CG-CB 3.87Å; L396-A402 HydrophobicContact CD1-CB 3.92Å; A402-Q404 VanDerWaalsContact C-N 3.26Å; A402-Q404 PolarHBondContact O-N 2.9Å
403	G	96.3	Very high	97.4	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	-6.8	-175.6	0	0	0	0	0	115.4	V339 T373 V401	V339-G403 PolarHBondContact N-O 3.5Å; V339-G403 WeakPolarHBondContact O-CA 3.49Å; T373-G403 PolarHBondContact O-N 3.28Å; V401-G403 PolarHBondContact O-N 3.45Å
404	Q	96.9	Very high	97.3	Very high	103 Å²	103	56.5 Å²	56.5	48%	0.481	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	-7.7	-177.8	-59.4	-63.3	-25.2	0	0	112.9	V401 A402	V401-Q404 HydrophobicContact CB-CB 4.13Å; V401-Q404 HydrophobicContact CG1-CB 4.2Å; V401-Q404 HydrophobicContact CG1-CG 4.08Å; V401-Q404 PolarHBondContact O-N 3.47Å; A402-Q404 VanDerWaalsContact C-N 3.26Å; A402-Q404 PolarHBondContact O-N 2.9Å
405	S	98.2	Very high	96.9	Very high	35 Å²	35	56.5 Å²	56.5	25%	0.245	35%	0.347	C	S	.	.			trans	-132.7	160.7	-177.2	-57.1	0	0	0	0	110.4	T373 V401	T373-S405 VanDerWaalsContact CA-O 3.29Å; T373-S405 WeakPolarHBondContact CA-O 3.34Å; T373-S405 WeakPolarHBondContact CB-O 3.29Å; V401-S405 PolarHBondContact N-OG 3.49Å; V401-S405 PolarHBondContact O-N 2.81Å; V401-S405 PolarHBondContact O-OG 3.26Å
406	V	98.7	Very high	96.2	Very high	26 Å²	26	57.6 Å²	57.6	16%	0.158	36%	0.356	C	S	.	.			trans	-117.8	132	179.7	-177.8	0	0	0	0	109.4	L320 M323 Q324 I328 S371 T373	L320-V406 HydrophobicContact CD1-CB 4.15Å; L320-V406 HydrophobicContact CD1-CG1 3.96Å; M323-V406 HydrophobicContact CB-CG1 3.94Å; M323-V406 HydrophobicContact CB-CG2 3.95Å; Q324-V406 HydrophobicContact CG-CG2 3.95Å; I328-V406 HydrophobicContact CD1-CG2 3.46Å; I328-V406 VanDerWaalsContact CD1-CG2 3.46Å; S371-V406 WeakPolarHBondContact OG-CG1 3.49Å; T373-V406 HydrophobicContact CG2-CG2 4.22Å
407	A	98.7	Very high	94.6	Very high	7 Å²	7	57.9 Å²	57.9	6%	0.058	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	140	157.1	0	0	0	0	0	108.8	S371 H372 L396	S371-A407 CarbonylContact C-O 3.44Å; S371-A407 WeakPolarHBondContact CA-O 3.45Å; S371-A407 WeakPolarHBondContact CB-O 3.49Å; S371-A407 PolarHBondContact OG-O 3.04Å; H372-A407 PolarHBondContact N-O 3.22Å; H372-A407 PolarHBondContact O-N 2.76Å; L396-A407 HydrophobicContact CD2-CB 3.95Å
408	I	98.8	Very high	92.8	Very high	30 Å²	30	56.2 Å²	56.2	15%	0.154	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	134	175.6	-177.8	169.2	0	0	0	108.9	H316 L319 L320 L369 W370	H316-I408 WeakPolarHBondContact NE2-CG2 3.48Å; H316-I408 WeakPolarHBondContact O-CD1 3.4Å; L319-I408 HydrophobicContact CB-CD1 3.9Å; L319-I408 HydrophobicContact CD2-CD1 3.92Å; L319-I408 HydrophobicContact CD2-CG1 4.5Å; L319-I408 HydrophobicContact CG-CD1 3.95Å; L320-I408 HydrophobicContact CB-CD1 4.24Å; L320-I408 HydrophobicContact CD1-CG2 4.18Å; L369-I408 HydrophobicContact CD2-CD1 4.23Å; W370-I408 WeakPolarHBondContact O-CA 3.45Å
409	E	98.8	Very high	90.6	Very high	72 Å²	72	53.6 Å²	53.6	34%	0.336	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	163.2	173.8	-58.1	167.5	-102.7	0	0	108.6	L369 W370 H392 S394	L369-E409 VanDerWaalsContact CA-O 3.32Å; L369-E409 WeakPolarHBondContact CA-O 3.45Å; W370-E409 HydrophobicContact CD2-CB 4.42Å; W370-E409 HydrophobicContact CH2-CB 4.44Å; W370-E409 HydrophobicContact CZ2-CB 3.59Å; W370-E409 HydrophobicContact CZ2-CG 4.4Å; W370-E409 PolarHBondContact N-O 3.4Å; W370-E409 PolarHBondContact NE1-OE1 3.2Å; W370-E409 VanDerWaalsContact NE1-OE1 3.11Å; W370-E409 PolarHBondContact O-N 3.43Å; H392-E409 IonicContact CD2-OE1 3.81Å; H392-E409 IonicContact NE2-OE1 2.89Å; H392-E409 PolarHBondContact NE2-OE1 3.27Å; H392-E409 IonicContact NE2-OE2 3.27Å; S394-E409 WeakPolarHBondContact CB-OE1 3.43Å; S394-E409 PolarHBondContact OG-OE1 3.48Å
410	G	98.5	Very high	88.3	Confident	41 Å²	41	60.5 Å²	60.5	42%	0.423	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	-173	178.3	0	0	0	0	0	113.4	F368	F368-G410 CarbonylContact O-C 3.5Å; F368-G410 WeakPolarHBondContact O-CA 3.48Å
411	G	98.4	Very high	87.9	Confident	27 Å²	27	61.8 Å²	61.8	28%	0.278	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.9	-177.6	177.5	0	0	0	0	0	112.5	F368	F368-G411 WeakPolarHBondContact CD1-O 3.29Å; F368-G411 VanDerWaalsContact CE1-C 3.43Å; F368-G411 PolarHBondContact N-O 3.33Å; F368-G411 PolarHBondContact O-N 3.49Å
412	V	98.1	Very high	87.4	Confident	107 Å²	107	60.5 Å²	60.5	65%	0.648	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	147	179.6	-63.8	0	0	0	0	110.7	V366 E367	V366-V412 CarbonylContact O-C 3.58Å; V366-V412 VanDerWaalsContact O-CA 3.31Å; V366-V412 WeakPolarHBondContact O-CA 3.22Å; E367-V412 HydrophobicContact CG-CG1 3.91Å
413	C	96.4	Very high	87	Confident	17 Å²	17	61.9 Å²	61.9	12%	0.115	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	134.4	172.2	-175	0	0	0	0	108.4	F43 V366 F368	F43-C413 HydrophobicContact CD2-CB 3.94Å; F43-C413 HydrophobicContact CE2-CB 4.01Å; V366-C413 WeakPolarHBondContact CA-O 3.2Å; V366-C413 HydrophobicContact CB-CB 4.39Å; V366-C413 WeakPolarHBondContact CB-O 3.39Å; V366-C413 PolarHBondContact N-O 3.28Å; V366-C413 PolarHBondContact O-N 2.96Å; F368-C413 HydrophobicContact CE1-CB 4.29Å
414	R	94.9	Very high	86.4	Confident	149 Å²	149	65.5 Å²	65.5	56%	0.562	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	125.4	170.9	-176.7	172.1	-94.3	112.7	-3.4	107.9	T363 L364	T363-R414 HydrophobicContact CG2-CG 4.48Å; L364-R414 CarbonylContact O-C 3.52Å; L364-R414 WeakPolarHBondContact O-CA 3.29Å
415	L	91.1	Very high	85.8	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	128	175.7	-55.1	172.9	0	0	0	109.4	F43 V240 T363 L364 V366	F43-L415 HydrophobicContact CB-CD1 4.06Å; F43-L415 HydrophobicContact CB-CD2 4.34Å; V240-L415 HydrophobicContact CG1-CD1 3.91Å; T363-L415 WeakPolarHBondContact CA-O 3.34Å; L364-L415 HydrophobicContact CB-CB 4.19Å; L364-L415 PolarHBondContact N-O 3.14Å; L364-L415 PolarHBondContact O-N 3.22Å; V366-L415 HydrophobicContact CG2-CD1 3.66Å; V366-L415 HydrophobicContact CG2-CG 3.98Å
416	E	82.6	Confident	84.9	Confident	119 Å²	119	65.1 Å²	65.1	56%	0.556	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	137.5	170.3	-54.8	-174.5	163	0	0	111.4	Q385	Q385-E416 VanDerWaalsContact NE2-N 3.14Å; Q385-E416 PolarHBondContact NE2-O 3.26Å
417	S	64	Low	83.9	Confident	33 Å²	33	67.9 Å²	67.9	23%	0.231	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-73.7	139.9	165.2	-57.5	0	0	0	0	109.3	Q362	Q362-S417 VanDerWaalsContact O-CB 3.26Å; Q362-S417 WeakPolarHBondContact O-CB 3.43Å; Q362-S417 PolarHBondContact O-N 3.4Å; Q362-S417 PolarHBondContact O-OG 3.16Å
418	P	57.9	Low	82.8	Confident	37 Å²	37	72.5 Å²	72.5	24%	0.24	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-57.6	144.5	172.3	24.1	-31.2	0	0	0	110.2	N420	P418-N420 PolarHBondContact O-N 2.82Å
419	V	50.4	Low	81.5	Confident	84 Å²	84	76.1 Å²	76.1	51%	0.509	43%	0.426	S	S	.	.			trans	-77.4	115.8	175.6	-175.4	0	0	0	0	106.3	E38	E38-V419 PolarHBondContact OE2-N 3.1Å
420	N	46.6	Very low	79.9	Confident	227 Å²	227	76.5 Å²	76.5	100%	1.214	43%	0.434	S	S	*	.			trans	-60.8	0	176.7	-84.3	-18.3	0	0	0	112.3	P418	P418-N420 PolarHBondContact O-N 2.82Å

Retrieved 420 of 420 residues in 873.7 ms (Link to these results)

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