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Beta-crystallin B3

Crystallins are the dominant structural components of the vertebrate eye lens.

AlphaFold DB , UniProt , Accession A0A096NW63, Species PAPAN (Papio anubis, Olive baboon), Gene CRYBB3, Length 211 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	39.7	Very low	34.9	Very low	246 Å²	246	154.3 Å²	154.3	100%	1.212	84%	0.843	S	S	*	*				0	97.6	0	-86.3	171.7	172.7	0	0	105.6
2	E	32.9	Very low	35	Very low	194 Å²	194	149.9 Å²	149.9	91%	0.907	84%	0.843	S	S	*	*			trans	-88.2	122.2	178	-74.1	172.3	145.3	0	0	108.3
3	E	32.7	Very low	35.5	Very low	180 Å²	180	143.2 Å²	143.2	84%	0.841	82%	0.818	S	S	*	*			trans	-79	115.5	171.4	-97.7	179.9	110.7	0	0	109.6
4	Q	32.7	Very low	35.8	Very low	192 Å²	192	137 Å²	137	90%	0.897	80%	0.801	S	S	*	*			trans	-81.6	113.7	167.3	-78.3	175.4	32.5	0	0	109.3
5	H	32.3	Very low	35.9	Very low	177 Å²	177	141.1 Å²	141.1	82%	0.819	81%	0.805	S	S	*	*			trans	-81.7	111.3	164.9	-96.8	66.5	0	0	0	109.3
6	G	30	Very low	36.5	Very low	74 Å²	74	137.4 Å²	137.4	76%	0.763	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-77.2	134.9	171.3	0	0	0	0	0	111.6
7	A	33.8	Very low	36.5	Very low	95 Å²	95	140.4 Å²	140.4	79%	0.785	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-71.4	145.8	174.9	0	0	0	0	0	111.5
8	P	35.1	Very low	36.4	Very low	127 Å²	127	134.9 Å²	134.9	83%	0.825	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-77.2	133.8	179.3	29.8	-31.2	0	0	0	111.7
9	E	36.7	Very low	36.3	Very low	195 Å²	195	131.6 Å²	131.6	91%	0.911	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-68.2	131.5	-180	-170.6	173	158.2	0	0	111.6
10	Q	42.1	Very low	36.6	Very low	133 Å²	133	134.4 Å²	134.4	62%	0.621	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-77.4	123.2	179.7	-70.9	-178.3	-8.3	0	0	110.6	A12	Q10-A12 PolarHBondContact O-N 2.74Å
11	A	36.3	Very low	37.1	Very low	84 Å²	84	131.2 Å²	131.2	69%	0.694	78%	0.78	S	S	*	*			trans	-71.7	111	172.8	0	0	0	0	0	110.5
12	A	36	Very low	38.1	Very low	102 Å²	102	121.3 Å²	121.3	84%	0.843	74%	0.742	S	S	*	*			trans	-86.2	113.3	172.1	0	0	0	0	0	110	Q10	Q10-A12 PolarHBondContact O-N 2.74Å
13	A	40.8	Very low	40.6	Very low	63 Å²	63	116.8 Å²	116.8	52%	0.521	73%	0.731	S	S	.	*			trans	-96.7	122.6	175.2	0	0	0	0	0	111.6
14	G	40.8	Very low	43.4	Very low	56 Å²	56	110.2 Å²	110.2	58%	0.577	70%	0.699	S	S	*	*			trans	46.3	106.4	150.8	0	0	0	0	0	119.9	A43	G14-A43 WeakPolarHBondContact O-CB 2.92Å
15	K	36.2	Very low	46.4	Very low	198 Å²	198	103.3 Å²	103.3	86%	0.861	67%	0.666	S	S	*	*			trans	-81.7	122	163.4	-67.9	179.5	178.7	177.4	0	110.1
16	S	45.7	Very low	49.5	Very low	82 Å²	82	94.9 Å²	94.9	57%	0.573	63%	0.627	S	S	*	*			trans	-119.9	137.9	158.9	65.4	0	0	0	0	109.9	G18	S16-G18 PolarHBondContact O-N 2.78Å
17	H	36.5	Very low	52.8	Low	188 Å²	188	91.7 Å²	91.7	87%	0.87	59%	0.592	S	S	*	*			trans	-82.5	102.8	-179.7	-83.6	23.7	0	0	0	110.2
18	G	34.4	Very low	55.8	Low	43 Å²	43	87.2 Å²	87.2	44%	0.443	56%	0.555	S	S	.	*			trans	-75.1	137.8	164.3	0	0	0	0	0	111.1	S16	S16-G18 PolarHBondContact O-N 2.78Å
19	G	35.1	Very low	58.8	Low	72 Å²	72	82.2 Å²	82.2	74%	0.742	52%	0.52	S	S	*	.	S	Bend	trans	-54.6	140.2	-177	0	0	0	0	0	114.3
20	L	43.2	Very low	61.6	Low	186 Å²	186	75.2 Å²	75.2	97%	0.974	49%	0.487	S	S	*	.	S	Bend	trans	43.6	74.7	164.9	-66.7	165.3	0	0	0	116.7
21	G	45.8	Very low	64.2	Low	68 Å²	68	73.4 Å²	73.4	70%	0.701	48%	0.481	S	S	*	.	S	Bend		108.3	23.6	129.6	0	0	0	0	0	118.5	K201	G21-K201 PolarHBondContact O-NZ 3.12Å
22	G	60.5	Low	67.2	Low	39 Å²	39	73.4 Å²	73.4	40%	0.402	47%	0.467	S	S	.	.			trans	-152.9	135.2	166	0	0	0	0	0	112.2	Y24 K201	G22-Y24 PolarHBondContact O-N 3.46Å; G22-K201 VanDerWaalsContact CA-NZ 3.27Å
23	S	85.4	Confident	70.2	Confident	98 Å²	98	72.8 Å²	72.8	69%	0.685	45%	0.449	S	S	*	.			trans	-72.1	121.2	165.8	52.6	0	0	0	0	108.7	S63	S23-S63 WeakPolarHBondContact O-CB 3.13Å
24	Y	92.3	Very high	72.9	Confident	42 Å²	42	72.3 Å²	72.3	17%	0.165	44%	0.436	C	S	.	.			trans	-73.3	141.1	167.2	-69.7	-88.1	0	0	0	109.4	G22 S42 P65 P106 L107 N108	G22-Y24 PolarHBondContact O-N 3.46Å; Y24-S42 VanDerWaalsContact O-CA 3.3Å; Y24-S42 WeakPolarHBondContact O-CA 3.4Å; Y24-S42 WeakPolarHBondContact O-CB 3.47Å; Y24-P65 WeakPolarHBondContact CE1-O 2.98Å; Y24-P106 HydrophobicContact CD1-CB 3.72Å; Y24-P106 HydrophobicContact CD1-CG 4.39Å; Y24-P106 HydrophobicContact CD2-CB 3.74Å; Y24-P106 HydrophobicContact CD2-CG 4.16Å; Y24-P106 HydrophobicContact CE1-CB 3.82Å; Y24-P106 HydrophobicContact CE2-CB 3.84Å; Y24-P106 HydrophobicContact CG-CB 3.67Å; Y24-P106 HydrophobicContact CG-CG 3.99Å; Y24-L107 PolarHBondContact OH-O 3.37Å; Y24-N108 PolarHBondContact OH-OD1 3.37Å
25	K	96.2	Very high	75.6	Confident	47 Å²	47	75.1 Å²	75.1	20%	0.204	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	125.7	175.8	-177.5	171	162.9	-174.4	0	111.3	E40 L41 E62 S63	K25-E40 HydrophobicContact CD-CG 4.36Å; K25-E40 WeakPolarHBondContact CD-OE1 3.21Å; K25-E40 WeakPolarHBondContact CE-OE1 3.1Å; K25-E40 WeakPolarHBondContact CE-OE2 3.42Å; K25-E40 HydrophobicContact CG-CG 4.19Å; K25-E40 IonicContact NZ-OE1 2.66Å; K25-E40 PolarHBondContact NZ-OE1 2.99Å; K25-E40 IonicContact NZ-OE2 2.86Å; K25-L41 WeakPolarHBondContact CA-O 3.41Å; K25-E62 HydrophobicContact CB-CB 4.25Å; K25-E62 HydrophobicContact CD-CB 4.31Å; K25-E62 WeakPolarHBondContact CD-OE2 3.34Å; K25-E62 WeakPolarHBondContact CE-OE1 3.41Å; K25-E62 WeakPolarHBondContact CE-OE2 3.26Å; K25-E62 HydrophobicContact CG-CB 4.18Å; K25-E62 VanDerWaalsContact NZ-CD 3.29Å; K25-E62 IonicContact NZ-OE1 3.82Å; K25-E62 PolarHBondContact NZ-OE1 3.49Å; K25-E62 VanDerWaalsContact NZ-OE1 3.17Å; K25-E62 IonicContact NZ-OE2 3.92Å; K25-E62 PolarHBondContact NZ-OE2 2.84Å; K25-E62 PolarHBondContact O-N 3.19Å; K25-S63 PolarHBondContact N-O 2.85Å; K25-S63 PolarHBondContact O-N 2.97Å; K25-S63 VanDerWaalsContact O-O 3.09Å
26	V	97.4	Very high	78.4	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	141.9	173.2	62.5	0	0	0	0	109.4	V28 L41 I59 Q60 V61 W66 L104	V26-V28 HydrophobicContact CG2-CG1 4.46Å; V26-L41 HydrophobicContact CG1-CB 3.81Å; V26-L41 HydrophobicContact CG1-CD1 4.49Å; V26-L41 PolarHBondContact N-O 3.26Å; V26-L41 PolarHBondContact O-N 2.86Å; V26-I59 HydrophobicContact CG2-CG2 3.49Å; V26-I59 VanDerWaalsContact CG2-CG2 3.49Å; V26-Q60 WeakPolarHBondContact CA-O 3.03Å; V26-V61 HydrophobicContact CG2-CG2 3.97Å; V26-W66 HydrophobicContact CB-CD2 4.06Å; V26-W66 HydrophobicContact CB-CG 4.29Å; V26-W66 HydrophobicContact CB-CZ2 4.07Å; V26-W66 HydrophobicContact CG1-CD2 3.67Å; V26-W66 VanDerWaalsContact CG1-CE2 3.47Å; V26-W66 HydrophobicContact CG1-CE3 3.85Å; V26-W66 HydrophobicContact CG1-CG 4.34Å; V26-W66 HydrophobicContact CG1-CH2 3.65Å; V26-W66 HydrophobicContact CG1-CZ2 3.47Å; V26-W66 VanDerWaalsContact CG1-CZ2 3.47Å; V26-W66 HydrophobicContact CG1-CZ3 3.83Å; V26-L104 HydrophobicContact CB-CD1 4.5Å; V26-L104 HydrophobicContact CG1-CD1 3.56Å; V26-L104 HydrophobicContact CG2-CD1 4.29Å
27	I	97.9	Very high	80.8	Confident	8 Å²	8	69.3 Å²	69.3	4%	0.041	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	123.3	175.5	-52.9	168.5	0	0	0	107.1	Y29 R38 C39 E40 I59 Q60 E62	I27-Y29 HydrophobicContact CB-CE2 4.01Å; I27-Y29 HydrophobicContact CG2-CD2 4.15Å; I27-Y29 HydrophobicContact CG2-CE1 4.26Å; I27-Y29 HydrophobicContact CG2-CE2 3.48Å; I27-Y29 VanDerWaalsContact CG2-CE2 3.48Å; I27-R38 HydrophobicContact CG2-CB 4.19Å; I27-R38 HydrophobicContact CG2-CG 4.49Å; I27-C39 WeakPolarHBondContact CA-O 3.33Å; I27-E40 HydrophobicContact CG1-CG 4.38Å; I27-I59 CarbonylContact O-C 3.52Å; I27-I59 WeakPolarHBondContact O-CA 3.4Å; I27-Q60 PolarHBondContact N-O 3.15Å; I27-Q60 PolarHBondContact O-N 2.85Å; I27-E62 HydrophobicContact CD1-CG 4.45Å; I27-E62 WeakPolarHBondContact CD1-OE1 3.44Å
28	V	97.6	Very high	83.7	Confident	0 Å²	0	65 Å²	65	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	137.2	176	-68.1	0	0	0	0	109.2	V26 R38 C39 L48 L53 V56 I59	V26-V28 HydrophobicContact CG2-CG1 4.46Å; V28-R38 CarbonylContact O-C 3.59Å; V28-R38 WeakPolarHBondContact O-CA 3.3Å; V28-C39 HydrophobicContact CG2-CB 3.85Å; V28-C39 WeakPolarHBondContact CG2-O 3.4Å; V28-C39 PolarHBondContact N-O 2.82Å; V28-C39 PolarHBondContact O-N 2.9Å; V28-L48 HydrophobicContact CG2-CD2 4.12Å; V28-L53 HydrophobicContact CB-CD1 3.92Å; V28-L53 HydrophobicContact CG2-CD1 3.58Å; V28-V56 HydrophobicContact CB-CG1 4.42Å; V28-I59 HydrophobicContact CG1-CG1 4.29Å; V28-I59 HydrophobicContact CG1-CG2 4.41Å
29	Y	97.6	Very high	86.5	Confident	23 Å²	23	63.7 Å²	63.7	9%	0.09	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	146	-177	-64.8	-95.1	0	0	0	110.2	I27 F34 K37 R38 G57 S58 Q60	I27-Y29 HydrophobicContact CB-CE2 4.01Å; I27-Y29 HydrophobicContact CG2-CD2 4.15Å; I27-Y29 HydrophobicContact CG2-CE1 4.26Å; I27-Y29 HydrophobicContact CG2-CE2 3.48Å; I27-Y29 VanDerWaalsContact CG2-CE2 3.48Å; Y29-F34 VanDerWaalsContact CD1-C 3.41Å; Y29-F34 HydrophobicContact CD1-CB 4.28Å; Y29-F34 WeakPolarHBondContact CD1-O 3.35Å; Y29-F34 HydrophobicContact CD2-CB 4.18Å; Y29-F34 HydrophobicContact CD2-CD1 4.04Å; Y29-F34 HydrophobicContact CE1-CB 4.07Å; Y29-F34 WeakPolarHBondContact CE1-O 3.44Å; Y29-F34 HydrophobicContact CE2-CB 3.95Å; Y29-F34 AromaticContact CE2-CD1 4Å; Y29-F34 HydrophobicContact CE2-CD1 4Å; Y29-F34 HydrophobicContact CE2-CG 4.4Å; Y29-F34 HydrophobicContact CG-CB 4.34Å; Y29-K37 WeakPolarHBondContact CA-O 3.36Å; Y29-R38 HydrophobicContact CD1-CB 3.6Å; Y29-R38 HydrophobicContact CE1-CB 3.75Å; Y29-R38 HydrophobicContact CE1-CG 4.32Å; Y29-R38 HydrophobicContact CG-CB 4.24Å; Y29-G57 PolarHBondContact O-N 3.46Å; Y29-S58 WeakPolarHBondContact CB-OG 3.26Å; Y29-S58 PolarHBondContact N-O 3.12Å; Y29-S58 PolarHBondContact O-N 3.01Å; Y29-Q60 HydrophobicContact CE2-CB 4.35Å; Y29-Q60 HydrophobicContact CE2-CG 3.9Å; Y29-Q60 PolarHBondContact OH-OE1 2.88Å
30	E	96.2	Very high	89.4	Confident	47 Å²	47	64.3 Å²	64.3	22%	0.22	36%	0.356	C	S	.	.	S	Bend	trans	-69.4	-34.5	179.5	-166	154	-125.8	0	0	112.8	K37 L53 E54 K55 G57	E30-K37 HydrophobicContact CB-CB 4.22Å; E30-K37 WeakPolarHBondContact CB-O 3.37Å; E30-K37 PolarHBondContact N-O 3.31Å; E30-K37 VanDerWaalsContact OE2-CB 3.24Å; E30-K37 WeakPolarHBondContact OE2-CB 3.48Å; E30-L53 HydrophobicContact CB-CD2 4.07Å; E30-E54 WeakPolarHBondContact OE1-CB 3.47Å; E30-E54 PolarHBondContact OE1-N 3.28Å; E30-K55 VanDerWaalsContact CA-O 3.29Å; E30-K55 WeakPolarHBondContact CA-O 3.44Å; E30-G57 PolarHBondContact O-N 3.14Å
31	L	97.4	Very high	92	Very high	96 Å²	96	55.9 Å²	55.9	50%	0.503	31%	0.312	S	S	.	.	S	Bend	trans	-110.7	163.4	-177.9	-54.1	179.1	0	0	0	111.2	Q35 G57 S58	L31-Q35 HydrophobicContact CB-CB 3.99Å; L31-Q35 WeakPolarHBondContact CB-O 3.42Å; L31-Q35 HydrophobicContact CD1-CB 4.25Å; L31-Q35 PolarHBondContact N-O 3.26Å; L31-G57 CarbonylContact O-C 3.59Å; L31-S58 WeakPolarHBondContact O-CB 3.49Å; L31-S58 PolarHBondContact O-N 2.86Å; L31-S58 PolarHBondContact O-OG 3.04Å
32	E	98.2	Very high	94.4	Very high	83 Å²	83	55 Å²	55	39%	0.388	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-62.8	160.3	170.7	-62.5	-171.3	164.4	0	0	111.5	F34 P87 R88	E32-F34 VanDerWaalsContact C-N 3.26Å; E32-F34 PolarHBondContact O-N 3.17Å; E32-P87 WeakPolarHBondContact CA-O 3.43Å; E32-R88 HydrophobicContact CB-CG 4.12Å; E32-R88 VanDerWaalsContact CD-CG 3.45Å; E32-R88 HydrophobicContact CG-CG 3.92Å; E32-R88 WeakPolarHBondContact OE1-CD 3.29Å; E32-R88 WeakPolarHBondContact OE2-CD 3.39Å; E32-R88 WeakPolarHBondContact OE2-CG 3.37Å
33	N	98.1	Very high	96	Very high	89 Å²	89	53.7 Å²	53.7	48%	0.476	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	56.3	37	176.1	-49.6	-67.6	0	0	0	114	Q35 P87	N33-Q35 WeakPolarHBondContact O-CG 3.27Å; N33-Q35 PolarHBondContact O-N 2.95Å; N33-Q35 PolarHBondContact O-NE2 3.07Å; N33-Q35 VanDerWaalsContact O-NE2 3.14Å; N33-P87 PolarHBondContact N-O 3.36Å
34	F	98	Very high	96.5	Very high	53 Å²	53	54.6 Å²	54.6	23%	0.232	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	63.4	39.4	171.4	-36.6	-60.9	0	0	0	113.4	Y29 E32 S58 I59 Q60 D85 P87	Y29-F34 VanDerWaalsContact CD1-C 3.41Å; Y29-F34 HydrophobicContact CD1-CB 4.28Å; Y29-F34 WeakPolarHBondContact CD1-O 3.35Å; Y29-F34 HydrophobicContact CD2-CB 4.18Å; Y29-F34 HydrophobicContact CD2-CD1 4.04Å; Y29-F34 HydrophobicContact CE1-CB 4.07Å; Y29-F34 WeakPolarHBondContact CE1-O 3.44Å; Y29-F34 HydrophobicContact CE2-CB 3.95Å; Y29-F34 AromaticContact CE2-CD1 4Å; Y29-F34 HydrophobicContact CE2-CD1 4Å; Y29-F34 HydrophobicContact CE2-CG 4.4Å; Y29-F34 HydrophobicContact CG-CB 4.34Å; E32-F34 VanDerWaalsContact C-N 3.26Å; E32-F34 PolarHBondContact O-N 3.17Å; F34-S58 VanDerWaalsContact CA-OG 3.28Å; F34-S58 WeakPolarHBondContact CA-OG 3.38Å; F34-S58 PolarHBondContact N-OG 2.69Å; F34-I59 WeakPolarHBondContact CE1-O 3.4Å; F34-Q60 HydrophobicContact CD1-CG 3.41Å; F34-Q60 VanDerWaalsContact CD1-CG 3.41Å; F34-Q60 HydrophobicContact CE1-CG 3.51Å; F34-Q60 HydrophobicContact CG-CG 4.08Å; F34-Q60 HydrophobicContact CZ-CG 4.25Å; F34-D85 HydrophobicContact CE1-CB 4.44Å; F34-D85 HydrophobicContact CE2-CB 4.38Å; F34-D85 HydrophobicContact CZ-CB 3.73Å; F34-P87 HydrophobicContact CE2-CB 4.24Å; F34-P87 HydrophobicContact CZ-CB 3.83Å
35	Q	97.7	Very high	96.7	Very high	116 Å²	116	53.1 Å²	53.1	54%	0.542	27%	0.269	S	S	.	.			trans	-113.8	167.9	-177.8	-58.1	-56.4	-46.2	0	0	112.7	L31 N33	L31-Q35 HydrophobicContact CB-CB 3.99Å; L31-Q35 WeakPolarHBondContact CB-O 3.42Å; L31-Q35 HydrophobicContact CD1-CB 4.25Å; L31-Q35 PolarHBondContact N-O 3.26Å; N33-Q35 WeakPolarHBondContact O-CG 3.27Å; N33-Q35 PolarHBondContact O-N 2.95Å; N33-Q35 PolarHBondContact O-NE2 3.07Å; N33-Q35 VanDerWaalsContact O-NE2 3.14Å
36	G	96.3	Very high	96.8	Very high	50 Å²	50	54.2 Å²	54.2	52%	0.515	28%	0.281	S	S	.	.	S	Bend	trans	79.5	-159.6	175	0	0	0	0	0	113.8
37	K	96	Very high	96.7	Very high	107 Å²	107	54.7 Å²	54.7	47%	0.465	29%	0.285	S	S	.	.	S	Bend	trans	-61.8	140.8	175.3	-168.8	-179.1	179.7	-163.9	0	109.1	Y29 E30 S51 L52 L53	Y29-K37 WeakPolarHBondContact CA-O 3.36Å; E30-K37 HydrophobicContact CB-CB 4.22Å; E30-K37 WeakPolarHBondContact CB-O 3.37Å; E30-K37 PolarHBondContact N-O 3.31Å; E30-K37 VanDerWaalsContact OE2-CB 3.24Å; E30-K37 WeakPolarHBondContact OE2-CB 3.48Å; K37-S51 PolarHBondContact NZ-O 2.86Å; K37-L52 WeakPolarHBondContact CD-O 3.42Å; K37-L52 WeakPolarHBondContact CE-O 3.31Å; K37-L52 PolarHBondContact NZ-O 2.86Å; K37-L53 HydrophobicContact CB-CD2 4.05Å; K37-L53 HydrophobicContact CD-CD2 4.22Å; K37-L53 HydrophobicContact CG-CD2 4.01Å; K37-L53 WeakPolarHBondContact O-CD2 3.28Å
38	R	95.5	Very high	96.4	Very high	99 Å²	99	54.4 Å²	54.4	37%	0.374	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	151	177.3	73.2	-179.9	-177.8	88.7	0.7	111.9	I27 V28 Y29	I27-R38 HydrophobicContact CG2-CB 4.19Å; I27-R38 HydrophobicContact CG2-CG 4.49Å; V28-R38 CarbonylContact O-C 3.59Å; V28-R38 WeakPolarHBondContact O-CA 3.3Å; Y29-R38 HydrophobicContact CD1-CB 3.6Å; Y29-R38 HydrophobicContact CE1-CB 3.75Å; Y29-R38 HydrophobicContact CE1-CG 4.32Å; Y29-R38 HydrophobicContact CG-CB 4.24Å
39	C	94.7	Very high	95.8	Very high	14 Å²	14	56.2 Å²	56.2	10%	0.095	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.2	172.8	179.3	0	0	0	0	109.2	I27 V28 L52	I27-C39 WeakPolarHBondContact CA-O 3.33Å; V28-C39 HydrophobicContact CG2-CB 3.85Å; V28-C39 WeakPolarHBondContact CG2-O 3.4Å; V28-C39 PolarHBondContact N-O 2.82Å; V28-C39 PolarHBondContact O-N 2.9Å; C39-L52 HydrophobicContact CB-CB 4.39Å
40	E	96.5	Very high	95	Very high	86 Å²	86	60.1 Å²	60.1	40%	0.402	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	130.4	174.4	-179.4	174.2	150.7	0	0	109.2	K25 I27	K25-E40 HydrophobicContact CD-CG 4.36Å; K25-E40 WeakPolarHBondContact CD-OE1 3.21Å; K25-E40 WeakPolarHBondContact CE-OE1 3.1Å; K25-E40 WeakPolarHBondContact CE-OE2 3.42Å; K25-E40 HydrophobicContact CG-CG 4.19Å; K25-E40 IonicContact NZ-OE1 2.66Å; K25-E40 PolarHBondContact NZ-OE1 2.99Å; K25-E40 IonicContact NZ-OE2 2.86Å; I27-E40 HydrophobicContact CG1-CG 4.38Å
41	L	95.9	Very high	93.6	Very high	8 Å²	8	62.9 Å²	62.9	4%	0.042	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	132.4	-178.5	-60.7	171.5	0	0	0	110	K25 V26 C45 L48 W66 L104	K25-L41 WeakPolarHBondContact CA-O 3.41Å; V26-L41 HydrophobicContact CG1-CB 3.81Å; V26-L41 HydrophobicContact CG1-CD1 4.49Å; V26-L41 PolarHBondContact N-O 3.26Å; V26-L41 PolarHBondContact O-N 2.86Å; L41-C45 HydrophobicContact CD1-CB 3.83Å; L41-C45 HydrophobicContact CD2-CB 4.28Å; L41-L48 HydrophobicContact CD1-CD2 3.78Å; L41-W66 HydrophobicContact CB-CH2 4.07Å; L41-W66 WeakPolarHBondContact O-CZ2 3.43Å; L41-L104 HydrophobicContact CD1-CD1 4.28Å; L41-L104 HydrophobicContact CD1-CD2 3.75Å; L41-L104 HydrophobicContact CD1-CG 4.27Å
42	S	96.1	Very high	92.6	Very high	49 Å²	49	59.8 Å²	59.8	34%	0.343	33%	0.325	S	S	.	.	S	Bend	trans	-115.2	-1.6	172.6	59.9	0	0	0	0	113.6	Y24	Y24-S42 VanDerWaalsContact O-CA 3.3Å; Y24-S42 WeakPolarHBondContact O-CA 3.4Å; Y24-S42 WeakPolarHBondContact O-CB 3.47Å
43	A	95	Very high	91.9	Very high	12 Å²	12	56.2 Å²	56.2	10%	0.099	31%	0.309	C	S	.	.	S	Bend	trans	-140.3	174.7	178.8	0	0	0	0	0	109.8	G14 W66	G14-A43 WeakPolarHBondContact O-CB 2.92Å; A43-W66 VanDerWaalsContact O-CH2 3.31Å; A43-W66 WeakPolarHBondContact O-CH2 3.24Å; A43-W66 VanDerWaalsContact O-CZ3 3.26Å; A43-W66 WeakPolarHBondContact O-CZ3 3.2Å
44	E	96.5	Very high	91.5	Very high	117 Å²	117	60.4 Å²	60.4	55%	0.547	33%	0.325	S	S	.	.			trans	-60.6	145.5	176.7	64.6	-174.4	-137.6	0	0	113.1	F74 L104 R105	E44-F74 HydrophobicContact CB-CE1 4.32Å; E44-F74 HydrophobicContact CB-CZ 3.97Å; E44-F74 HydrophobicContact CG-CZ 4.29Å; E44-L104 WeakPolarHBondContact CA-O 3.44Å; E44-R105 HydrophobicContact CB-CB 3.58Å
45	C	96.8	Very high	91.3	Very high	11 Å²	11	62.8 Å²	62.8	7%	0.074	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-130.9	109.1	177.4	-176.8	0	0	0	0	109.1	L41 S47 L48 S103 L104	L41-C45 HydrophobicContact CD1-CB 3.83Å; L41-C45 HydrophobicContact CD2-CB 4.28Å; C45-S47 VanDerWaalsContact C-N 3.31Å; C45-S47 PolarHBondContact O-N 2.91Å; C45-S47 PolarHBondContact SG-O 3.29Å; C45-S47 VanDerWaalsContact SG-O 3.38Å; C45-L48 HydrophobicContact CB-CD2 4.46Å; C45-S103 VanDerWaalsContact O-CA 3.26Å; C45-S103 WeakPolarHBondContact O-CA 3.37Å; C45-S103 WeakPolarHBondContact O-CB 3.45Å; C45-L104 HydrophobicContact CB-CD2 4.25Å; C45-L104 PolarHBondContact N-O 2.98Å; C45-L104 PolarHBondContact O-N 2.9Å
46	P	96.6	Very high	91.3	Very high	71 Å²	71	57.5 Å²	57.5	46%	0.461	31%	0.311	S	S	.	.	S	Bend	trans	-78	-12.6	-178.2	30.8	-35.4	0	0	0	113.7	R72 A73 F74 S103	P46-R72 WeakPolarHBondContact O-CA 3.28Å; P46-A73 PolarHBondContact O-N 2.88Å; P46-F74 HydrophobicContact CB-CE2 4.19Å; P46-F74 HydrophobicContact CB-CZ 3.94Å; P46-S103 WeakPolarHBondContact O-CB 3.26Å
47	S	95.4	Very high	91.3	Very high	10 Å²	10	55.7 Å²	55.7	7%	0.07	29%	0.292	C	S	.	.			trans	-153.6	110.5	173.9	-171.8	0	0	0	0	111.1	C45 T49 D50 R72 L102	C45-S47 VanDerWaalsContact C-N 3.31Å; C45-S47 PolarHBondContact O-N 2.91Å; C45-S47 PolarHBondContact SG-O 3.29Å; C45-S47 VanDerWaalsContact SG-O 3.38Å; S47-T49 VanDerWaalsContact C-N 3.26Å; S47-T49 PolarHBondContact O-N 3.09Å; S47-T49 PolarHBondContact OG-OG1 3.29Å; S47-D50 WeakPolarHBondContact CB-OD1 3.44Å; S47-D50 VanDerWaalsContact CB-OD2 3.31Å; S47-D50 WeakPolarHBondContact CB-OD2 3.36Å; S47-D50 PolarHBondContact OG-OD1 3.38Å; S47-D50 PolarHBondContact OG-OD2 3.49Å; S47-R72 WeakPolarHBondContact OG-CD 3.49Å; S47-R72 PolarHBondContact OG-NE 3.49Å; S47-L102 CarbonylContact C-O 3.56Å; S47-L102 VanDerWaalsContact CA-O 3.29Å; S47-L102 WeakPolarHBondContact CA-O 3.4Å
48	L	92.4	Very high	91.4	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-18.8	174.9	-74.4	170.1	0	0	0	113.2	V28 L41 C45 L52 L53 V56 L101 L102 L104	V28-L48 HydrophobicContact CG2-CD2 4.12Å; L41-L48 HydrophobicContact CD1-CD2 3.78Å; C45-L48 HydrophobicContact CB-CD2 4.46Å; L48-L52 HydrophobicContact CD2-CD1 4.35Å; L48-L52 VanDerWaalsContact O-CB 3.3Å; L48-L52 WeakPolarHBondContact O-CB 3.48Å; L48-L53 PolarHBondContact O-N 2.91Å; L48-V56 HydrophobicContact CD1-CG2 3.69Å; L48-L101 HydrophobicContact CD1-CD2 3.36Å; L48-L102 PolarHBondContact N-O 2.76Å; L48-L104 HydrophobicContact CD1-CD2 3.49Å; L48-L104 VanDerWaalsContact CD1-CD2 3.49Å; L48-L104 HydrophobicContact CD2-CD2 3.64Å; L48-L104 HydrophobicContact CG-CD2 3.73Å
49	T	84.3	Confident	91.5	Very high	38 Å²	38	45.9 Å²	45.9	23%	0.233	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-5.3	-178.4	57.9	0	0	0	0	113.3	S47 S51 L53 R72 L102	S47-T49 VanDerWaalsContact C-N 3.26Å; S47-T49 PolarHBondContact O-N 3.09Å; S47-T49 PolarHBondContact OG-OG1 3.29Å; T49-S51 PolarHBondContact O-N 3.15Å; T49-L53 WeakPolarHBondContact CA-O 3.48Å; T49-R72 PolarHBondContact OG1-NE 3.45Å; T49-R72 PolarHBondContact OG1-NH2 3.22Å; T49-L102 HydrophobicContact CG2-CD2 3.54Å
50	D	80.5	Confident	91.7	Very high	105 Å²	105	47.4 Å²	47.4	56%	0.561	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	71.1	177.4	-69.1	11.1	0	0	0	108.4	S47 L52	S47-D50 WeakPolarHBondContact CB-OD1 3.44Å; S47-D50 VanDerWaalsContact CB-OD2 3.31Å; S47-D50 WeakPolarHBondContact CB-OD2 3.36Å; S47-D50 PolarHBondContact OG-OD1 3.38Å; S47-D50 PolarHBondContact OG-OD2 3.49Å; D50-L52 PolarHBondContact O-N 3.24Å
51	S	67.9	Low	91.7	Very high	106 Å²	106	43.5 Å²	43.5	74%	0.741	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.6	-4.5	179.3	75.6	0	0	0	0	118.3	K37 T49	K37-S51 PolarHBondContact NZ-O 2.86Å; T49-S51 PolarHBondContact O-N 3.15Å
52	L	75.6	Confident	91.7	Very high	31 Å²	31	47.2 Å²	47.2	16%	0.162	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-56.7	179.8	-51.6	172.2	0	0	0	112	K37 C39 L48 D50	K37-L52 WeakPolarHBondContact CD-O 3.42Å; K37-L52 WeakPolarHBondContact CE-O 3.31Å; K37-L52 PolarHBondContact NZ-O 2.86Å; C39-L52 HydrophobicContact CB-CB 4.39Å; L48-L52 HydrophobicContact CD2-CD1 4.35Å; L48-L52 VanDerWaalsContact O-CB 3.3Å; L48-L52 WeakPolarHBondContact O-CB 3.48Å; D50-L52 PolarHBondContact O-N 3.24Å
53	L	84.8	Confident	91.5	Very high	8 Å²	8	47 Å²	47	4%	0.042	26%	0.256	C	S	.	.			trans	-143.1	153	-178.5	-60.8	173.6	0	0	0	111.1	V28 E30 K37 L48 T49 V56	V28-L53 HydrophobicContact CB-CD1 3.92Å; V28-L53 HydrophobicContact CG2-CD1 3.58Å; E30-L53 HydrophobicContact CB-CD2 4.07Å; K37-L53 HydrophobicContact CB-CD2 4.05Å; K37-L53 HydrophobicContact CD-CD2 4.22Å; K37-L53 HydrophobicContact CG-CD2 4.01Å; K37-L53 WeakPolarHBondContact O-CD2 3.28Å; L48-L53 PolarHBondContact O-N 2.91Å; T49-L53 WeakPolarHBondContact CA-O 3.48Å; L53-V56 HydrophobicContact CD1-CG2 4.19Å
54	E	89.6	Confident	91.3	Very high	176 Å²	176	47.1 Å²	47.1	82%	0.822	26%	0.258	S	S	*	.	S	Bend	trans	-72.2	-42.4	170.7	-67.6	-174.6	177	0	0	111.6	E30	E30-E54 WeakPolarHBondContact OE1-CB 3.47Å; E30-E54 PolarHBondContact OE1-N 3.28Å
55	K	93.7	Very high	91.3	Very high	104 Å²	104	41.8 Å²	41.8	45%	0.452	23%	0.233	S	C	.	.	S	Bend	trans	-153.7	151	176.6	-171.3	-176.4	178.4	-164.9	0	109.4	E30 D99	E30-K55 VanDerWaalsContact CA-O 3.29Å; E30-K55 WeakPolarHBondContact CA-O 3.44Å; K55-D99 WeakPolarHBondContact CE-OD2 3.27Å; K55-D99 IonicContact NZ-OD2 2.77Å; K55-D99 PolarHBondContact NZ-OD2 2.86Å
56	V	96.7	Very high	91.3	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.03	23%	0.23	C	C	.	.			trans	-86.6	122.4	172.4	-177.5	0	0	0	0	109.7	V28 L48 L53 I59 W92 L101	V28-V56 HydrophobicContact CB-CG1 4.42Å; L48-V56 HydrophobicContact CD1-CG2 3.69Å; L53-V56 HydrophobicContact CD1-CG2 4.19Å; V56-I59 HydrophobicContact CG1-CD1 4.13Å; V56-I59 HydrophobicContact CG1-CG1 3.79Å; V56-W92 HydrophobicContact CG1-CH2 4.11Å; V56-L101 HydrophobicContact CG1-CD2 4.44Å; V56-L101 HydrophobicContact CG2-CD2 4.07Å
57	G	96.6	Very high	91.3	Very high	11 Å²	11	38 Å²	38	11%	0.113	21%	0.208	C	C	.	.			trans	-103.8	-32.5	176.3	0	0	0	0	0	113.9	Y29 E30 L31	Y29-G57 PolarHBondContact O-N 3.46Å; E30-G57 PolarHBondContact O-N 3.14Å; L31-G57 CarbonylContact O-C 3.59Å
58	S	98.3	Very high	91.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	160.4	176.4	57.3	0	0	0	0	112.7	Y29 L31 F34 Y86 P87	Y29-S58 WeakPolarHBondContact CB-OG 3.26Å; Y29-S58 PolarHBondContact N-O 3.12Å; Y29-S58 PolarHBondContact O-N 3.01Å; L31-S58 WeakPolarHBondContact O-CB 3.49Å; L31-S58 PolarHBondContact O-N 2.86Å; L31-S58 PolarHBondContact O-OG 3.04Å; F34-S58 VanDerWaalsContact CA-OG 3.28Å; F34-S58 WeakPolarHBondContact CA-OG 3.38Å; F34-S58 PolarHBondContact N-OG 2.69Å; S58-Y86 WeakPolarHBondContact CA-O 3.48Å; S58-Y86 VanDerWaalsContact CB-O 3.3Å; S58-Y86 WeakPolarHBondContact CB-O 3.41Å; S58-P87 WeakPolarHBondContact CB-O 3.29Å
59	I	98.4	Very high	91.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	137.5	-173.9	-52.4	176.9	0	0	0	109.8	V26 I27 V28 F34 V56 V61 L81 Y86 W92 L101	V26-I59 HydrophobicContact CG2-CG2 3.49Å; V26-I59 VanDerWaalsContact CG2-CG2 3.49Å; I27-I59 CarbonylContact O-C 3.52Å; I27-I59 WeakPolarHBondContact O-CA 3.4Å; V28-I59 HydrophobicContact CG1-CG1 4.29Å; V28-I59 HydrophobicContact CG1-CG2 4.41Å; F34-I59 WeakPolarHBondContact CE1-O 3.4Å; V56-I59 HydrophobicContact CG1-CD1 4.13Å; V56-I59 HydrophobicContact CG1-CG1 3.79Å; I59-V61 HydrophobicContact CG2-CG2 4.13Å; I59-L81 HydrophobicContact CD1-CD1 4.07Å; I59-L81 HydrophobicContact CD1-CD2 4.5Å; I59-Y86 HydrophobicContact CB-CD2 4.48Å; I59-Y86 PolarHBondContact N-O 3.14Å; I59-Y86 WeakPolarHBondContact O-CA 3.44Å; I59-Y86 WeakPolarHBondContact O-CB 3.38Å; I59-Y86 PolarHBondContact O-N 2.98Å; I59-W92 HydrophobicContact CD1-CD2 4.1Å; I59-W92 HydrophobicContact CD1-CE3 3.9Å; I59-W92 HydrophobicContact CD1-CH2 4.42Å; I59-W92 HydrophobicContact CD1-CZ3 4.08Å; I59-W92 HydrophobicContact CG1-CE3 4.16Å; I59-W92 HydrophobicContact CG1-CH2 4.46Å; I59-W92 HydrophobicContact CG1-CZ3 3.97Å; I59-L101 HydrophobicContact CD1-CD1 3.72Å; I59-L101 HydrophobicContact CD1-CD2 4.23Å
60	Q	98.3	Very high	92.3	Very high	46 Å²	46	38.7 Å²	38.7	22%	0.215	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	120	165.1	-62.8	-173.6	-78.1	0	0	109.5	V26 I27 Y29 F34 D85	V26-Q60 WeakPolarHBondContact CA-O 3.03Å; I27-Q60 PolarHBondContact N-O 3.15Å; I27-Q60 PolarHBondContact O-N 2.85Å; Y29-Q60 HydrophobicContact CE2-CB 4.35Å; Y29-Q60 HydrophobicContact CE2-CG 3.9Å; Y29-Q60 PolarHBondContact OH-OE1 2.88Å; F34-Q60 HydrophobicContact CD1-CG 3.41Å; F34-Q60 VanDerWaalsContact CD1-CG 3.41Å; F34-Q60 HydrophobicContact CE1-CG 3.51Å; F34-Q60 HydrophobicContact CG-CG 4.08Å; F34-Q60 HydrophobicContact CZ-CG 4.25Å; Q60-D85 WeakPolarHBondContact CG-OD1 3.39Å; Q60-D85 PolarHBondContact NE2-OD1 2.86Å
61	V	97	Very high	93	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.024	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	102.9	175.3	-178.4	0	0	0	0	108.1	V26 I59 L81 E82 K83 G84 Y86	V26-V61 HydrophobicContact CG2-CG2 3.97Å; I59-V61 HydrophobicContact CG2-CG2 4.13Å; V61-L81 HydrophobicContact CG2-CB 3.9Å; V61-E82 VanDerWaalsContact CB-O 3.28Å; V61-E82 WeakPolarHBondContact CB-O 3.48Å; V61-K83 WeakPolarHBondContact O-CA 3.3Å; V61-K83 WeakPolarHBondContact O-CG 3.35Å; V61-G84 PolarHBondContact N-O 2.93Å; V61-G84 PolarHBondContact O-N 2.81Å; V61-G84 VanDerWaalsContact O-N 3.15Å; V61-Y86 HydrophobicContact CG2-CD2 4.45Å; V61-Y86 HydrophobicContact CG2-CE2 4.03Å
62	E	94.8	Very high	94.4	Very high	86 Å²	86	36.5 Å²	36.5	40%	0.402	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-37.7	175.7	-71.6	-169.7	-167.7	0	0	111.8	K25 I27	K25-E62 HydrophobicContact CB-CB 4.25Å; K25-E62 HydrophobicContact CD-CB 4.31Å; K25-E62 WeakPolarHBondContact CD-OE2 3.34Å; K25-E62 WeakPolarHBondContact CE-OE1 3.41Å; K25-E62 WeakPolarHBondContact CE-OE2 3.26Å; K25-E62 HydrophobicContact CG-CB 4.18Å; K25-E62 VanDerWaalsContact NZ-CD 3.29Å; K25-E62 IonicContact NZ-OE1 3.82Å; K25-E62 PolarHBondContact NZ-OE1 3.49Å; K25-E62 VanDerWaalsContact NZ-OE1 3.17Å; K25-E62 IonicContact NZ-OE2 3.92Å; K25-E62 PolarHBondContact NZ-OE2 2.84Å; K25-E62 PolarHBondContact O-N 3.19Å; I27-E62 HydrophobicContact CD1-CG 4.45Å; I27-E62 WeakPolarHBondContact CD1-OE1 3.44Å
63	S	92.9	Very high	95.4	Very high	45 Å²	45	37 Å²	37	32%	0.315	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	117.8	179.7	-64.9	0	0	0	0	110.3	S23 K25 W66	S23-S63 WeakPolarHBondContact O-CB 3.13Å; K25-S63 PolarHBondContact N-O 2.85Å; K25-S63 PolarHBondContact O-N 2.97Å; K25-S63 VanDerWaalsContact O-O 3.09Å; S63-W66 PolarHBondContact O-NE1 2.82Å
64	G	91.5	Very high	96	Very high	14 Å²	14	39.2 Å²	39.2	14%	0.144	20%	0.201	C	C	.	.			trans	-144.5	-155.1	-172.1	0	0	0	0	0	112.6
65	P	94.8	Very high	96.3	Very high	5 Å²	5	38 Å²	38	3%	0.032	19%	0.189	C	C	.	.			cis	-74.6	161.9	1.5	31.6	-35.8	0	0	0	113.4	Y24 L81 L107 I109 I197	Y24-P65 WeakPolarHBondContact CE1-O 2.98Å; P65-L81 CarbonylContact C-O 3.56Å; P65-L81 VanDerWaalsContact CA-O 3.27Å; P65-L81 WeakPolarHBondContact CA-O 3.48Å; P65-L107 HydrophobicContact CG-CB 4.23Å; P65-L107 PolarHBondContact O-N 3.03Å; P65-I109 VanDerWaalsContact CD-CD1 3.48Å; P65-I109 HydrophobicContact CG-CD1 3.56Å; P65-I109 HydrophobicContact CG-CG1 4.09Å; P65-I197 HydrophobicContact CB-CG2 4.37Å; P65-I197 HydrophobicContact CG-CG2 3.89Å
66	W	96.6	Very high	96.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	153.6	169.7	-69.2	73.6	0	0	0	109.9	V26 L41 A43 S63 L81 L104 R105 P106	V26-W66 HydrophobicContact CB-CD2 4.06Å; V26-W66 HydrophobicContact CB-CG 4.29Å; V26-W66 HydrophobicContact CB-CZ2 4.07Å; V26-W66 HydrophobicContact CG1-CD2 3.67Å; V26-W66 VanDerWaalsContact CG1-CE2 3.47Å; V26-W66 HydrophobicContact CG1-CE3 3.85Å; V26-W66 HydrophobicContact CG1-CG 4.34Å; V26-W66 HydrophobicContact CG1-CH2 3.65Å; V26-W66 HydrophobicContact CG1-CZ2 3.47Å; V26-W66 VanDerWaalsContact CG1-CZ2 3.47Å; V26-W66 HydrophobicContact CG1-CZ3 3.83Å; L41-W66 HydrophobicContact CB-CH2 4.07Å; L41-W66 WeakPolarHBondContact O-CZ2 3.43Å; A43-W66 VanDerWaalsContact O-CH2 3.31Å; A43-W66 WeakPolarHBondContact O-CH2 3.24Å; A43-W66 VanDerWaalsContact O-CZ3 3.26Å; A43-W66 WeakPolarHBondContact O-CZ3 3.2Å; S63-W66 PolarHBondContact O-NE1 2.82Å; W66-L81 HydrophobicContact CB-CB 4.17Å; W66-L81 HydrophobicContact CB-CD1 4.42Å; W66-L81 PolarHBondContact N-O 3.48Å; W66-L81 PolarHBondContact O-N 3.38Å; W66-L104 HydrophobicContact CD2-CD1 4.24Å; W66-L104 HydrophobicContact CE3-CB 4.43Å; W66-L104 HydrophobicContact CE3-CD1 3.61Å; W66-L104 HydrophobicContact CE3-CG 4Å; W66-L104 HydrophobicContact CZ3-CD1 4.04Å; W66-L104 HydrophobicContact CZ3-CG 4.24Å; W66-R105 WeakPolarHBondContact CA-O 3.47Å; W66-P106 HydrophobicContact CE3-CG 4.25Å; W66-P106 HydrophobicContact CH2-CG 3.95Å; W66-P106 HydrophobicContact CZ2-CG 4.33Å; W66-P106 HydrophobicContact CZ3-CG 3.91Å
67	L	97.8	Very high	96.4	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	110.4	169.6	-175.1	56.5	0	0	0	108.6	F69 Q78 V80 L104 R105 L107 V172	L67-F69 HydrophobicContact CB-CE2 4.21Å; L67-F69 HydrophobicContact CD2-CE1 4.21Å; L67-F69 HydrophobicContact CD2-CE2 3.98Å; L67-F69 HydrophobicContact CD2-CZ 3.44Å; L67-F69 VanDerWaalsContact CD2-CZ 3.44Å; L67-F69 HydrophobicContact CG-CD2 4.49Å; L67-F69 HydrophobicContact CG-CE1 4.34Å; L67-F69 HydrophobicContact CG-CE2 3.68Å; L67-F69 HydrophobicContact CG-CZ 3.6Å; L67-F69 WeakPolarHBondContact O-CE2 3.26Å; L67-Q78 HydrophobicContact CD1-CB 4.01Å; L67-V80 HydrophobicContact CD1-CG2 4.31Å; L67-L104 CarbonylContact O-C 3.54Å; L67-L104 WeakPolarHBondContact O-CA 3.3Å; L67-R105 HydrophobicContact CB-CG 4.38Å; L67-R105 PolarHBondContact N-O 2.99Å; L67-R105 PolarHBondContact O-N 3.46Å; L67-L107 HydrophobicContact CB-CB 4.28Å; L67-L107 HydrophobicContact CB-CD2 4.49Å; L67-L107 HydrophobicContact CD2-CD1 4.45Å; L67-V172 HydrophobicContact CD1-CG2 3.6Å; L67-V172 HydrophobicContact CD2-CB 4.24Å; L67-V172 HydrophobicContact CD2-CG2 4.05Å; L67-V172 HydrophobicContact CG-CG2 4.47Å
68	G	97.7	Very high	96.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	155.2	173.2	0	0	0	0	0	111.7	Q78 F79 S103	G68-Q78 WeakPolarHBondContact O-CA 3.48Å; G68-F79 PolarHBondContact N-O 2.67Å; G68-F79 PolarHBondContact O-N 2.88Å; G68-S103 CarbonylContact C-O 3.59Å
69	F	97.9	Very high	96.4	Very high	8 Å²	8	35.3 Å²	35.3	4%	0.035	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	139.3	-178.1	-64.6	-92.2	0	0	0	111	L67 S71 F74 R75 E77 Q78 L102 S103 R105	L67-F69 HydrophobicContact CB-CE2 4.21Å; L67-F69 HydrophobicContact CD2-CE1 4.21Å; L67-F69 HydrophobicContact CD2-CE2 3.98Å; L67-F69 HydrophobicContact CD2-CZ 3.44Å; L67-F69 VanDerWaalsContact CD2-CZ 3.44Å; L67-F69 HydrophobicContact CG-CD2 4.49Å; L67-F69 HydrophobicContact CG-CE1 4.34Å; L67-F69 HydrophobicContact CG-CE2 3.68Å; L67-F69 HydrophobicContact CG-CZ 3.6Å; L67-F69 WeakPolarHBondContact O-CE2 3.26Å; F69-S71 VanDerWaalsContact C-N 3.29Å; F69-S71 PolarHBondContact O-N 3.21Å; F69-F74 HydrophobicContact CD1-CB 4.36Å; F69-F74 HydrophobicContact CD2-CB 3.94Å; F69-F74 AromaticContact CD2-CD1 3.91Å; F69-F74 HydrophobicContact CD2-CD1 3.91Å; F69-F74 HydrophobicContact CD2-CG 4.42Å; F69-F74 HydrophobicContact CE1-CB 4.16Å; F69-F74 WeakPolarHBondContact CE1-O 3.48Å; F69-F74 HydrophobicContact CE2-CB 3.74Å; F69-F74 AromaticContact CE2-CD1 3.9Å; F69-F74 HydrophobicContact CE2-CD1 3.9Å; F69-F74 HydrophobicContact CE2-CG 4.24Å; F69-F74 HydrophobicContact CG-CB 4.24Å; F69-F74 HydrophobicContact CZ-CB 3.85Å; F69-R75 WeakPolarHBondContact CB-O 3.39Å; F69-E77 CarbonylContact C-O 3.4Å; F69-E77 VanDerWaalsContact CA-O 3.32Å; F69-E77 WeakPolarHBondContact CA-O 3.45Å; F69-Q78 HydrophobicContact CD1-CG 4.02Å; F69-Q78 HydrophobicContact CE1-CG 3.8Å; F69-L102 PolarHBondContact O-N 2.97Å; F69-S103 WeakPolarHBondContact CB-OG 3.43Å; F69-S103 PolarHBondContact N-O 3.05Å; F69-S103 PolarHBondContact O-N 2.9Å; F69-R105 HydrophobicContact CE2-CG 4.22Å
70	E	96.8	Very high	96.3	Very high	56 Å²	56	35.7 Å²	35.7	26%	0.262	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	-41.3	175.8	179.9	-173.5	-156.5	0	0	112.1	E77 F79 S98 S100 L102	E70-E77 HydrophobicContact CB-CB 4.02Å; E70-E77 PolarHBondContact N-O 3.05Å; E70-E77 PolarHBondContact OE2-N 3.16Å; E70-F79 HydrophobicContact CB-CE2 4.26Å; E70-F79 HydrophobicContact CB-CZ 4.38Å; E70-S98 WeakPolarHBondContact OE1-CB 3.47Å; E70-S98 PolarHBondContact OE1-OG 3.38Å; E70-S100 WeakPolarHBondContact CA-O 3.29Å; E70-S100 PolarHBondContact O-OG 2.79Å; E70-L102 WeakPolarHBondContact O-CB 3.39Å; E70-L102 WeakPolarHBondContact O-CD1 3.22Å; E70-L102 VanDerWaalsContact O-CG 3.24Å; E70-L102 WeakPolarHBondContact O-CG 3.47Å
71	S	96.4	Very high	96.2	Very high	45 Å²	45	33.5 Å²	33.5	32%	0.315	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	162.5	-176.4	-63.5	0	0	0	0	112.8	F69 R75 S103	F69-S71 VanDerWaalsContact C-N 3.29Å; F69-S71 PolarHBondContact O-N 3.21Å; S71-R75 WeakPolarHBondContact CA-O 3.4Å; S71-R75 VanDerWaalsContact CB-O 3.25Å; S71-R75 WeakPolarHBondContact CB-O 3.49Å; S71-R75 PolarHBondContact N-O 2.89Å; S71-S103 PolarHBondContact O-OG 2.86Å
72	R	96.6	Very high	96.1	Very high	121 Å²	121	35.8 Å²	35.8	46%	0.457	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	156.9	170.9	-62.5	-177.3	-175	104.4	3.9	111.6	P46 S47 T49 F74 L102	P46-R72 WeakPolarHBondContact O-CA 3.28Å; S47-R72 WeakPolarHBondContact OG-CD 3.49Å; S47-R72 PolarHBondContact OG-NE 3.49Å; T49-R72 PolarHBondContact OG1-NE 3.45Å; T49-R72 PolarHBondContact OG1-NH2 3.22Å; R72-F74 VanDerWaalsContact C-N 3.29Å; R72-F74 PolarHBondContact O-N 3.4Å; R72-L102 HydrophobicContact CG-CB 4.08Å; R72-L102 HydrophobicContact CG-CD1 4.31Å
73	A	96.8	Very high	96.1	Very high	42 Å²	42	38 Å²	38	35%	0.347	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	41.5	177.7	0	0	0	0	0	113.3	P46	P46-A73 PolarHBondContact O-N 2.88Å
74	F	97.1	Very high	96.2	Very high	54 Å²	54	37.2 Å²	37.2	24%	0.237	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	46.2	171.7	-39.6	-60.9	0	0	0	113.6	E44 P46 F69 R72 S103 R105	E44-F74 HydrophobicContact CB-CE1 4.32Å; E44-F74 HydrophobicContact CB-CZ 3.97Å; E44-F74 HydrophobicContact CG-CZ 4.29Å; P46-F74 HydrophobicContact CB-CE2 4.19Å; P46-F74 HydrophobicContact CB-CZ 3.94Å; F69-F74 HydrophobicContact CD1-CB 4.36Å; F69-F74 HydrophobicContact CD2-CB 3.94Å; F69-F74 AromaticContact CD2-CD1 3.91Å; F69-F74 HydrophobicContact CD2-CD1 3.91Å; F69-F74 HydrophobicContact CD2-CG 4.42Å; F69-F74 HydrophobicContact CE1-CB 4.16Å; F69-F74 WeakPolarHBondContact CE1-O 3.48Å; F69-F74 HydrophobicContact CE2-CB 3.74Å; F69-F74 AromaticContact CE2-CD1 3.9Å; F69-F74 HydrophobicContact CE2-CD1 3.9Å; F69-F74 HydrophobicContact CE2-CG 4.24Å; F69-F74 HydrophobicContact CG-CB 4.24Å; F69-F74 HydrophobicContact CZ-CB 3.85Å; R72-F74 VanDerWaalsContact C-N 3.29Å; R72-F74 PolarHBondContact O-N 3.4Å; F74-S103 WeakPolarHBondContact CA-OG 3.11Å; F74-S103 PolarHBondContact N-OG 2.66Å; F74-R105 HydrophobicContact CD1-CB 4.46Å; F74-R105 HydrophobicContact CE1-CB 4.08Å
75	R	96	Very high	96.5	Very high	151 Å²	151	41.4 Å²	41.4	57%	0.57	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-124.6	165.5	-176.9	-69	-170.5	-66.9	-108	1.5	112.5	F69 S71	F69-R75 WeakPolarHBondContact CB-O 3.39Å; S71-R75 WeakPolarHBondContact CA-O 3.4Å; S71-R75 VanDerWaalsContact CB-O 3.25Å; S71-R75 WeakPolarHBondContact CB-O 3.49Å; S71-R75 PolarHBondContact N-O 2.89Å
76	G	95.8	Very high	96.6	Very high	35 Å²	35	42.7 Å²	42.7	36%	0.361	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	82.5	-157.1	177.1	0	0	0	0	0	112.2
77	E	96.9	Very high	96.7	Very high	16 Å²	16	45 Å²	45	8%	0.075	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	143	178.5	-172	170.3	175.3	0	0	111.9	F69 E70 F79 S95 R169	F69-E77 CarbonylContact C-O 3.4Å; F69-E77 VanDerWaalsContact CA-O 3.32Å; F69-E77 WeakPolarHBondContact CA-O 3.45Å; E70-E77 HydrophobicContact CB-CB 4.02Å; E70-E77 PolarHBondContact N-O 3.05Å; E70-E77 PolarHBondContact OE2-N 3.16Å; E77-F79 HydrophobicContact CB-CE1 4.38Å; E77-F79 HydrophobicContact CB-CZ 4.09Å; E77-F79 HydrophobicContact CG-CE1 3.75Å; E77-F79 HydrophobicContact CG-CZ 3.98Å; E77-S95 VanDerWaalsContact CD-OG 3.24Å; E77-S95 WeakPolarHBondContact OE1-CB 3.44Å; E77-S95 PolarHBondContact OE1-OG 3.42Å; E77-S95 PolarHBondContact OE2-OG 2.8Å; E77-R169 HydrophobicContact CG-CG 4.4Å
78	Q	97.4	Very high	96.6	Very high	11 Å²	11	50.1 Å²	50.1	5%	0.051	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	143.7	-177.2	-64.9	173	33.9	0	0	111.1	L67 G68 F69 W184	L67-Q78 HydrophobicContact CD1-CB 4.01Å; G68-Q78 WeakPolarHBondContact O-CA 3.48Å; F69-Q78 HydrophobicContact CD1-CG 4.02Å; F69-Q78 HydrophobicContact CE1-CG 3.8Å; Q78-W184 PolarHBondContact NE2-O 2.79Å
79	F	97	Very high	96.5	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	114.3	177.7	-45.2	-68.8	0	0	0	109.8	G68 E70 E77 L81 W92 L101	G68-F79 PolarHBondContact N-O 2.67Å; G68-F79 PolarHBondContact O-N 2.88Å; E70-F79 HydrophobicContact CB-CE2 4.26Å; E70-F79 HydrophobicContact CB-CZ 4.38Å; E77-F79 HydrophobicContact CB-CE1 4.38Å; E77-F79 HydrophobicContact CB-CZ 4.09Å; E77-F79 HydrophobicContact CG-CE1 3.75Å; E77-F79 HydrophobicContact CG-CZ 3.98Å; F79-L81 HydrophobicContact CB-CD2 4.34Å; F79-L81 PolarHBondContact O-N 2.88Å; F79-W92 AromaticContact CD1-CD1 3.97Å; F79-W92 AromaticContact CG-CD1 3.85Å; F79-L101 HydrophobicContact CD2-CD1 3.96Å
80	V	96.7	Very high	96.3	Very high	9 Å²	9	54.6 Å²	54.6	6%	0.055	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	118.7	172.1	179.8	0	0	0	0	108.8	L67 E82 V159 V172 I197	L67-V80 HydrophobicContact CD1-CG2 4.31Å; V80-E82 HydrophobicContact CG1-CG 4.26Å; V80-V159 HydrophobicContact CG2-CB 4.12Å; V80-V159 HydrophobicContact CG2-CG2 3.94Å; V80-V172 HydrophobicContact CG2-CG2 3.67Å; V80-I197 HydrophobicContact CG1-CD1 4.04Å; V80-I197 HydrophobicContact CG1-CG1 4.49Å; V80-I197 HydrophobicContact CG1-CG2 4.24Å; V80-I197 HydrophobicContact CG2-CD1 3.86Å
81	L	96.3	Very high	96.2	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	95	-177.9	-54.6	173.8	0	0	0	109	I59 V61 P65 W66 F79 Y86 W92 L101	I59-L81 HydrophobicContact CD1-CD1 4.07Å; I59-L81 HydrophobicContact CD1-CD2 4.5Å; V61-L81 HydrophobicContact CG2-CB 3.9Å; P65-L81 CarbonylContact C-O 3.56Å; P65-L81 VanDerWaalsContact CA-O 3.27Å; P65-L81 WeakPolarHBondContact CA-O 3.48Å; W66-L81 HydrophobicContact CB-CB 4.17Å; W66-L81 HydrophobicContact CB-CD1 4.42Å; W66-L81 PolarHBondContact N-O 3.48Å; W66-L81 PolarHBondContact O-N 3.38Å; F79-L81 HydrophobicContact CB-CD2 4.34Å; F79-L81 PolarHBondContact O-N 2.88Å; L81-Y86 HydrophobicContact CD2-CE1 4.4Å; L81-W92 HydrophobicContact CD2-CB 3.54Å; L81-W92 HydrophobicContact CD2-CG 4.31Å; L81-L101 HydrophobicContact CD1-CD1 4.43Å
82	E	94.4	Very high	96.1	Very high	51 Å²	51	52 Å²	52	24%	0.238	26%	0.259	C	S	.	.			trans	-76.8	169.7	174.5	-69.7	168.8	167.3	0	0	110.3	V61 V80 G84 Y86 R195	V61-E82 VanDerWaalsContact CB-O 3.28Å; V61-E82 WeakPolarHBondContact CB-O 3.48Å; V80-E82 HydrophobicContact CG1-CG 4.26Å; E82-G84 PolarHBondContact O-N 3.29Å; E82-Y86 PolarHBondContact N-OH 3.44Å; E82-Y86 WeakPolarHBondContact O-CE2 3.48Å; E82-Y86 PolarHBondContact O-OH 2.97Å; E82-R195 IonicContact OE1-CZ 3.06Å; E82-R195 IonicContact OE1-NH1 3.21Å; E82-R195 PolarHBondContact OE1-NH1 2.77Å; E82-R195 IonicContact OE1-NH2 3.93Å; E82-R195 PolarHBondContact OE1-NH2 3.02Å; E82-R195 IonicContact OE2-NH2 2.97Å
83	K	94.2	Very high	95.9	Very high	134 Å²	134	46.3 Å²	46.3	58%	0.583	24%	0.238	S	C	*	.	S	Bend	trans	-58.6	124.5	176.4	-178.5	-178.1	178.6	179.6	0	110.1	V61	V61-K83 WeakPolarHBondContact O-CA 3.3Å; V61-K83 WeakPolarHBondContact O-CG 3.35Å
84	G	94.9	Very high	95.5	Very high	27 Å²	27	47.9 Å²	47.9	28%	0.278	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	157.3	-175.4	-178	0	0	0	0	0	113.7	V61 E82	V61-G84 PolarHBondContact N-O 2.93Å; V61-G84 PolarHBondContact O-N 2.81Å; V61-G84 VanDerWaalsContact O-N 3.15Å; E82-G84 PolarHBondContact O-N 3.29Å
85	D	97.8	Very high	95.1	Very high	103 Å²	103	46.3 Å²	46.3	55%	0.551	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.6	-176.5	-71.7	-27.6	0	0	0	110.2	F34 Q60 P87	F34-D85 HydrophobicContact CE1-CB 4.44Å; F34-D85 HydrophobicContact CE2-CB 4.38Å; F34-D85 HydrophobicContact CZ-CB 3.73Å; Q60-D85 WeakPolarHBondContact CG-OD1 3.39Å; Q60-D85 PolarHBondContact NE2-OD1 2.86Å; D85-P87 WeakPolarHBondContact O-CD 3.4Å
86	Y	97.8	Very high	94.7	Very high	32 Å²	32	46.4 Å²	46.4	13%	0.125	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	88.6	179.7	-59.3	-95	0	0	0	109.1	S58 I59 V61 L81 E82 R88 A91 W92	S58-Y86 WeakPolarHBondContact CA-O 3.48Å; S58-Y86 VanDerWaalsContact CB-O 3.3Å; S58-Y86 WeakPolarHBondContact CB-O 3.41Å; I59-Y86 HydrophobicContact CB-CD2 4.48Å; I59-Y86 PolarHBondContact N-O 3.14Å; I59-Y86 WeakPolarHBondContact O-CA 3.44Å; I59-Y86 WeakPolarHBondContact O-CB 3.38Å; I59-Y86 PolarHBondContact O-N 2.98Å; V61-Y86 HydrophobicContact CG2-CD2 4.45Å; V61-Y86 HydrophobicContact CG2-CE2 4.03Å; L81-Y86 HydrophobicContact CD2-CE1 4.4Å; E82-Y86 PolarHBondContact N-OH 3.44Å; E82-Y86 WeakPolarHBondContact O-CE2 3.48Å; E82-Y86 PolarHBondContact O-OH 2.97Å; Y86-R88 VanDerWaalsContact C-N 3.27Å; Y86-R88 PolarHBondContact O-N 2.83Å; Y86-A91 HydrophobicContact CD1-CB 4.17Å; Y86-A91 WeakPolarHBondContact CD1-O 3.2Å; Y86-W92 HydrophobicContact CD1-CB 3.89Å; Y86-W92 HydrophobicContact CE1-CB 4.31Å
87	P	97.8	Very high	94.3	Very high	47 Å²	47	49.1 Å²	49.1	31%	0.305	24%	0.243	S	C	.	.			trans	-73.2	-16.1	-168.5	27.8	-35.6	0	0	0	114.2	E32 N33 F34 S58 D85	E32-P87 WeakPolarHBondContact CA-O 3.43Å; N33-P87 PolarHBondContact N-O 3.36Å; F34-P87 HydrophobicContact CE2-CB 4.24Å; F34-P87 HydrophobicContact CZ-CB 3.83Å; S58-P87 WeakPolarHBondContact CB-O 3.29Å; D85-P87 WeakPolarHBondContact O-CD 3.4Å
88	R	97.3	Very high	93.9	Very high	110 Å²	110	49.1 Å²	49.1	42%	0.415	25%	0.245	S	C	.	.	S	Bend	trans	-150.7	166.3	179.8	-61.8	-164.1	-59.7	-123	-3.8	111.3	E32 Y86 D90 A91 W92	E32-R88 HydrophobicContact CB-CG 4.12Å; E32-R88 VanDerWaalsContact CD-CG 3.45Å; E32-R88 HydrophobicContact CG-CG 3.92Å; E32-R88 WeakPolarHBondContact OE1-CD 3.29Å; E32-R88 WeakPolarHBondContact OE2-CD 3.39Å; E32-R88 WeakPolarHBondContact OE2-CG 3.37Å; Y86-R88 VanDerWaalsContact C-N 3.27Å; Y86-R88 PolarHBondContact O-N 2.83Å; R88-D90 VanDerWaalsContact C-N 3.27Å; R88-D90 WeakPolarHBondContact CB-OD1 3.37Å; R88-D90 IonicContact CZ-OD1 3.34Å; R88-D90 IonicContact NE-OD1 2.97Å; R88-D90 PolarHBondContact NE-OD1 2.68Å; R88-D90 IonicContact NH2-OD1 3.66Å; R88-D90 PolarHBondContact O-N 3.25Å; R88-A91 WeakPolarHBondContact O-CB 3.31Å; R88-A91 PolarHBondContact O-N 2.81Å; R88-W92 VanDerWaalsContact O-CZ3 3.26Å; R88-W92 WeakPolarHBondContact O-CZ3 3.46Å
89	W	95.4	Very high	93.6	Very high	69 Å²	69	51.6 Å²	51.6	26%	0.261	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-59.8	-33.8	-178.5	76.4	-89.6	0	0	0	115	A91 W92 S93 R96 S98 D99	W89-A91 PolarHBondContact O-N 2.72Å; W89-W92 VanDerWaalsContact CA-CE2 3.48Å; W89-W92 VanDerWaalsContact CA-CZ3 3.46Å; W89-W92 HydrophobicContact CB-CH2 3.7Å; W89-W92 HydrophobicContact CB-CZ2 3.43Å; W89-W92 VanDerWaalsContact CB-CZ2 3.43Å; W89-W92 HydrophobicContact CB-CZ3 4.35Å; W89-W92 PolarHBondContact O-N 2.91Å; W89-S93 WeakPolarHBondContact O-CB 3.38Å; W89-S93 PolarHBondContact O-N 2.72Å; W89-S93 VanDerWaalsContact O-N 3.09Å; W89-R96 HydrophobicContact CH2-CB 4Å; W89-R96 HydrophobicContact CH2-CG 4.41Å; W89-R96 HydrophobicContact CZ3-CB 4.3Å; W89-S98 WeakPolarHBondContact CZ3-O 3.39Å; W89-D99 HydrophobicContact CB-CB 3.91Å; W89-D99 HydrophobicContact CD2-CB 3.48Å; W89-D99 VanDerWaalsContact CD2-CB 3.48Å; W89-D99 HydrophobicContact CE3-CB 3.78Å; W89-D99 HydrophobicContact CG-CB 3.52Å; W89-D99 HydrophobicContact CZ3-CB 4.44Å
90	D	93.7	Very high	93.5	Very high	33 Å²	33	53.1 Å²	53.1	18%	0.176	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-77.3	-2.7	178.9	75.4	-46.7	0	0	0	113.7	R88 R96	R88-D90 VanDerWaalsContact C-N 3.27Å; R88-D90 WeakPolarHBondContact CB-OD1 3.37Å; R88-D90 IonicContact CZ-OD1 3.34Å; R88-D90 IonicContact NE-OD1 2.97Å; R88-D90 PolarHBondContact NE-OD1 2.68Å; R88-D90 IonicContact NH2-OD1 3.66Å; R88-D90 PolarHBondContact O-N 3.25Å; D90-R96 IonicContact OD2-CZ 3.42Å; D90-R96 IonicContact OD2-NH1 2.78Å; D90-R96 PolarHBondContact OD2-NH1 3.32Å; D90-R96 IonicContact OD2-NH2 3.63Å; D90-R96 PolarHBondContact OD2-NH2 3.44Å
91	A	94.6	Very high	93.6	Very high	42 Å²	42	52.9 Å²	52.9	35%	0.347	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-82.8	-26.6	170.2	0	0	0	0	0	112.8	Y86 R88 W89	Y86-A91 HydrophobicContact CD1-CB 4.17Å; Y86-A91 WeakPolarHBondContact CD1-O 3.2Å; R88-A91 WeakPolarHBondContact O-CB 3.31Å; R88-A91 PolarHBondContact O-N 2.81Å; W89-A91 PolarHBondContact O-N 2.72Å
92	W	94.1	Very high	93.6	Very high	4 Å²	4	54.5 Å²	54.5	2%	0.015	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-23.8	176	65.1	77.7	0	0	0	113.6	V56 I59 F79 L81 Y86 R88 W89 L101 Q170	V56-W92 HydrophobicContact CG1-CH2 4.11Å; I59-W92 HydrophobicContact CD1-CD2 4.1Å; I59-W92 HydrophobicContact CD1-CE3 3.9Å; I59-W92 HydrophobicContact CD1-CH2 4.42Å; I59-W92 HydrophobicContact CD1-CZ3 4.08Å; I59-W92 HydrophobicContact CG1-CE3 4.16Å; I59-W92 HydrophobicContact CG1-CH2 4.46Å; I59-W92 HydrophobicContact CG1-CZ3 3.97Å; F79-W92 AromaticContact CD1-CD1 3.97Å; F79-W92 AromaticContact CG-CD1 3.85Å; L81-W92 HydrophobicContact CD2-CB 3.54Å; L81-W92 HydrophobicContact CD2-CG 4.31Å; Y86-W92 HydrophobicContact CD1-CB 3.89Å; Y86-W92 HydrophobicContact CE1-CB 4.31Å; R88-W92 VanDerWaalsContact O-CZ3 3.26Å; R88-W92 WeakPolarHBondContact O-CZ3 3.46Å; W89-W92 VanDerWaalsContact CA-CE2 3.48Å; W89-W92 VanDerWaalsContact CA-CZ3 3.46Å; W89-W92 HydrophobicContact CB-CH2 3.7Å; W89-W92 HydrophobicContact CB-CZ2 3.43Å; W89-W92 VanDerWaalsContact CB-CZ2 3.43Å; W89-W92 HydrophobicContact CB-CZ3 4.35Å; W89-W92 PolarHBondContact O-N 2.91Å; W92-L101 HydrophobicContact CZ2-CB 4.41Å; W92-Q170 PolarHBondContact O-NE2 3.39Å
93	S	92.6	Very high	93.8	Very high	2 Å²	2	52 Å²	52	1%	0.014	27%	0.265	C	S	.	.			trans	-94.6	105.6	179.6	-175.5	0	0	0	0	111.9	W89 S95 R96	W89-S93 WeakPolarHBondContact O-CB 3.38Å; W89-S93 PolarHBondContact O-N 2.72Å; W89-S93 VanDerWaalsContact O-N 3.09Å; S93-S95 VanDerWaalsContact C-N 3.3Å; S93-S95 PolarHBondContact O-N 2.83Å; S93-R96 PolarHBondContact OG-N 2.94Å
94	N	87.6	Confident	93.9	Very high	76 Å²	76	45.7 Å²	45.7	41%	0.406	24%	0.237	S	C	.	.	S	Bend	trans	-78.8	-10.9	176.1	-80.8	0.1	0	0	0	114	Y166 G168	N94-Y166 PolarHBondContact ND2-O 2.78Å; N94-G168 CarbonylContact C-O 3.54Å; N94-G168 WeakPolarHBondContact CB-O 3.44Å; N94-G168 PolarHBondContact O-N 3.49Å
95	S	87.9	Confident	94.1	Very high	21 Å²	21	46.6 Å²	46.6	15%	0.147	23%	0.232	C	C	.	.	S	Bend	trans	-97.6	-22.1	-179.6	78.7	0	0	0	0	113.1	E77 S93 N97	E77-S95 VanDerWaalsContact CD-OG 3.24Å; E77-S95 WeakPolarHBondContact OE1-CB 3.44Å; E77-S95 PolarHBondContact OE1-OG 3.42Å; E77-S95 PolarHBondContact OE2-OG 2.8Å; S93-S95 VanDerWaalsContact C-N 3.3Å; S93-S95 PolarHBondContact O-N 2.83Å; S95-N97 VanDerWaalsContact CB-ND2 3.3Å; S95-N97 WeakPolarHBondContact CB-ND2 3.42Å; S95-N97 PolarHBondContact O-N 2.65Å; S95-N97 WeakPolarHBondContact OG-CB 3.36Å; S95-N97 PolarHBondContact OG-N 3.29Å; S95-N97 PolarHBondContact OG-ND2 3.2Å
96	R	87.5	Confident	94	Very high	153 Å²	153	42.8 Å²	42.8	58%	0.577	21%	0.213	S	C	*	.			trans	57.4	19.2	-172.8	-60.1	-177.2	175.7	-91.8	-9.5	114.5	W89 D90 S93	W89-R96 HydrophobicContact CH2-CB 4Å; W89-R96 HydrophobicContact CH2-CG 4.41Å; W89-R96 HydrophobicContact CZ3-CB 4.3Å; D90-R96 IonicContact OD2-CZ 3.42Å; D90-R96 IonicContact OD2-NH1 2.78Å; D90-R96 PolarHBondContact OD2-NH1 3.32Å; D90-R96 IonicContact OD2-NH2 3.63Å; D90-R96 PolarHBondContact OD2-NH2 3.44Å; S93-R96 PolarHBondContact OG-N 2.94Å
97	N	87.9	Confident	93.8	Very high	91 Å²	91	41.2 Å²	41.2	49%	0.487	21%	0.207	S	C	.	.	S	Bend	trans	-77.6	-31.8	-178.5	-69.3	-39.8	0	0	0	113.7	S95 R169	S95-N97 VanDerWaalsContact CB-ND2 3.3Å; S95-N97 WeakPolarHBondContact CB-ND2 3.42Å; S95-N97 PolarHBondContact O-N 2.65Å; S95-N97 WeakPolarHBondContact OG-CB 3.36Å; S95-N97 PolarHBondContact OG-N 3.29Å; S95-N97 PolarHBondContact OG-ND2 3.2Å; N97-R169 PolarHBondContact ND2-NE 2.98Å
98	S	88.4	Confident	93.3	Very high	17 Å²	17	43 Å²	43	12%	0.119	21%	0.214	C	C	.	.			trans	-149.5	138	-172.5	-167	0	0	0	0	110	E70 W89 S100	E70-S98 WeakPolarHBondContact OE1-CB 3.47Å; E70-S98 PolarHBondContact OE1-OG 3.38Å; W89-S98 WeakPolarHBondContact CZ3-O 3.39Å; S98-S100 VanDerWaalsContact C-N 3.34Å; S98-S100 WeakPolarHBondContact OG-CB 3.06Å; S98-S100 PolarHBondContact OG-N 2.87Å
99	D	92.4	Very high	92.8	Very high	62 Å²	62	39 Å²	39	33%	0.332	20%	0.2	S	C	.	.			trans	-94.5	3.3	170.7	67.5	-8.2	0	0	0	112	K55 W89	K55-D99 WeakPolarHBondContact CE-OD2 3.27Å; K55-D99 IonicContact NZ-OD2 2.77Å; K55-D99 PolarHBondContact NZ-OD2 2.86Å; W89-D99 HydrophobicContact CB-CB 3.91Å; W89-D99 HydrophobicContact CD2-CB 3.48Å; W89-D99 VanDerWaalsContact CD2-CB 3.48Å; W89-D99 HydrophobicContact CE3-CB 3.78Å; W89-D99 HydrophobicContact CG-CB 3.52Å; W89-D99 HydrophobicContact CZ3-CB 4.44Å
100	S	95.2	Very high	91.7	Very high	33 Å²	33	40.2 Å²	40.2	23%	0.231	21%	0.212	C	C	.	.			trans	-80.2	134.9	-178.7	-151.3	0	0	0	0	111.3	E70 S98 L102	E70-S100 WeakPolarHBondContact CA-O 3.29Å; E70-S100 PolarHBondContact O-OG 2.79Å; S98-S100 VanDerWaalsContact C-N 3.34Å; S98-S100 WeakPolarHBondContact OG-CB 3.06Å; S98-S100 PolarHBondContact OG-N 2.87Å; S100-L102 WeakPolarHBondContact OG-CG 3.44Å
101	L	96.9	Very high	91	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.021	21%	0.209	C	C	.	.			trans	-141.6	108.4	169.6	-172.7	142	0	0	0	106.8	L48 V56 I59 F79 L81 W92	L48-L101 HydrophobicContact CD1-CD2 3.36Å; V56-L101 HydrophobicContact CG1-CD2 4.44Å; V56-L101 HydrophobicContact CG2-CD2 4.07Å; I59-L101 HydrophobicContact CD1-CD1 3.72Å; I59-L101 HydrophobicContact CD1-CD2 4.23Å; F79-L101 HydrophobicContact CD2-CD1 3.96Å; L81-L101 HydrophobicContact CD1-CD1 4.43Å; W92-L101 HydrophobicContact CZ2-CB 4.41Å
102	L	97.1	Very high	90.3	Very high	33 Å²	33	40.9 Å²	40.9	17%	0.173	22%	0.215	C	C	.	.			trans	-119.8	-16.3	-167.5	-65.5	-178.3	0	0	0	113.6	S47 L48 T49 F69 E70 R72 S100	S47-L102 CarbonylContact C-O 3.56Å; S47-L102 VanDerWaalsContact CA-O 3.29Å; S47-L102 WeakPolarHBondContact CA-O 3.4Å; L48-L102 PolarHBondContact N-O 2.76Å; T49-L102 HydrophobicContact CG2-CD2 3.54Å; F69-L102 PolarHBondContact O-N 2.97Å; E70-L102 WeakPolarHBondContact O-CB 3.39Å; E70-L102 WeakPolarHBondContact O-CD1 3.22Å; E70-L102 VanDerWaalsContact O-CG 3.24Å; E70-L102 WeakPolarHBondContact O-CG 3.47Å; R72-L102 HydrophobicContact CG-CB 4.08Å; R72-L102 HydrophobicContact CG-CD1 4.31Å; S100-L102 WeakPolarHBondContact OG-CG 3.44Å
103	S	98.1	Very high	90.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	156.9	171.3	63.1	0	0	0	0	111.2	C45 P46 G68 F69 S71 F74	C45-S103 VanDerWaalsContact O-CA 3.26Å; C45-S103 WeakPolarHBondContact O-CA 3.37Å; C45-S103 WeakPolarHBondContact O-CB 3.45Å; P46-S103 WeakPolarHBondContact O-CB 3.26Å; G68-S103 CarbonylContact C-O 3.59Å; F69-S103 WeakPolarHBondContact CB-OG 3.43Å; F69-S103 PolarHBondContact N-O 3.05Å; F69-S103 PolarHBondContact O-N 2.9Å; S71-S103 PolarHBondContact O-OG 2.86Å; F74-S103 WeakPolarHBondContact CA-OG 3.11Å; F74-S103 PolarHBondContact N-OG 2.66Å
104	L	97.8	Very high	90.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	153.4	177.1	66	161.1	0	0	0	111.4	V26 L41 E44 C45 L48 W66 L67	V26-L104 HydrophobicContact CB-CD1 4.5Å; V26-L104 HydrophobicContact CG1-CD1 3.56Å; V26-L104 HydrophobicContact CG2-CD1 4.29Å; L41-L104 HydrophobicContact CD1-CD1 4.28Å; L41-L104 HydrophobicContact CD1-CD2 3.75Å; L41-L104 HydrophobicContact CD1-CG 4.27Å; E44-L104 WeakPolarHBondContact CA-O 3.44Å; C45-L104 HydrophobicContact CB-CD2 4.25Å; C45-L104 PolarHBondContact N-O 2.98Å; C45-L104 PolarHBondContact O-N 2.9Å; L48-L104 HydrophobicContact CD1-CD2 3.49Å; L48-L104 VanDerWaalsContact CD1-CD2 3.49Å; L48-L104 HydrophobicContact CD2-CD2 3.64Å; L48-L104 HydrophobicContact CG-CD2 3.73Å; W66-L104 HydrophobicContact CD2-CD1 4.24Å; W66-L104 HydrophobicContact CE3-CB 4.43Å; W66-L104 HydrophobicContact CE3-CD1 3.61Å; W66-L104 HydrophobicContact CE3-CG 4Å; W66-L104 HydrophobicContact CZ3-CD1 4.04Å; W66-L104 HydrophobicContact CZ3-CG 4.24Å; L67-L104 CarbonylContact O-C 3.54Å; L67-L104 WeakPolarHBondContact O-CA 3.3Å
105	R	97.6	Very high	90.7	Very high	47 Å²	47	44.2 Å²	44.2	18%	0.177	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	155.1	174.6	65.2	178.3	177.8	89.8	-9.4	111.7	E44 W66 L67 F69 F74 L107 E174	E44-R105 HydrophobicContact CB-CB 3.58Å; W66-R105 WeakPolarHBondContact CA-O 3.47Å; L67-R105 HydrophobicContact CB-CG 4.38Å; L67-R105 PolarHBondContact N-O 2.99Å; L67-R105 PolarHBondContact O-N 3.46Å; F69-R105 HydrophobicContact CE2-CG 4.22Å; F74-R105 HydrophobicContact CD1-CB 4.46Å; F74-R105 HydrophobicContact CE1-CB 4.08Å; R105-L107 PolarHBondContact O-N 2.97Å; R105-E174 IonicContact CZ-OE2 3.73Å; R105-E174 IonicContact NH1-OE1 2.67Å; R105-E174 IonicContact NH1-OE2 2.64Å; R105-E174 IonicContact NH2-OE1 3.64Å; R105-E174 IonicContact NH2-OE2 3.94Å; R105-E174 PolarHBondContact NH2-OE2 3.38Å
106	P	96.2	Very high	91.2	Very high	22 Å²	22	43.2 Å²	43.2	14%	0.143	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.6	138.5	163.2	-27.5	37.8	0	0	0	111.1	Y24 W66	Y24-P106 HydrophobicContact CD1-CB 3.72Å; Y24-P106 HydrophobicContact CD1-CG 4.39Å; Y24-P106 HydrophobicContact CD2-CB 3.74Å; Y24-P106 HydrophobicContact CD2-CG 4.16Å; Y24-P106 HydrophobicContact CE1-CB 3.82Å; Y24-P106 HydrophobicContact CE2-CB 3.84Å; Y24-P106 HydrophobicContact CG-CB 3.67Å; Y24-P106 HydrophobicContact CG-CG 3.99Å; W66-P106 HydrophobicContact CE3-CG 4.25Å; W66-P106 HydrophobicContact CH2-CG 3.95Å; W66-P106 HydrophobicContact CZ2-CG 4.33Å; W66-P106 HydrophobicContact CZ3-CG 3.91Å
107	L	93.9	Very high	91.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.			trans	-107.9	113.5	175.3	-177.3	61.2	0	0	0	109.6	Y24 P65 L67 R105 T157 V172 E174 I197	Y24-L107 PolarHBondContact OH-O 3.37Å; P65-L107 HydrophobicContact CG-CB 4.23Å; P65-L107 PolarHBondContact O-N 3.03Å; L67-L107 HydrophobicContact CB-CB 4.28Å; L67-L107 HydrophobicContact CB-CD2 4.49Å; L67-L107 HydrophobicContact CD2-CD1 4.45Å; R105-L107 PolarHBondContact O-N 2.97Å; L107-T157 HydrophobicContact CD1-CG2 4.23Å; L107-T157 HydrophobicContact CD2-CG2 4.27Å; L107-T157 HydrophobicContact CG-CG2 4.33Å; L107-V172 HydrophobicContact CD1-CG1 4.08Å; L107-V172 HydrophobicContact CD2-CG1 4.26Å; L107-E174 HydrophobicContact CD1-CG 4.15Å; L107-I197 HydrophobicContact CD2-CD1 3.51Å; L107-I197 HydrophobicContact CD2-CG2 4.4Å
108	N	88	Confident	92.3	Very high	83 Å²	83	32.6 Å²	32.6	44%	0.444	18%	0.177	S	C	.	.			trans	-71.8	131.9	-177.9	-67.4	-31.5	0	0	0	110.7	Y24 T157	Y24-N108 PolarHBondContact OH-OD1 3.37Å; N108-T157 PolarHBondContact O-OG1 3.06Å
109	I	85.7	Confident	92.8	Very high	27 Å²	27	32.2 Å²	32.2	14%	0.138	17%	0.173	C	C	.	.			trans	-114.1	104.6	168.8	-59	170.2	0	0	0	106.3	P65 I197 D199	P65-I109 VanDerWaalsContact CD-CD1 3.48Å; P65-I109 HydrophobicContact CG-CD1 3.56Å; P65-I109 HydrophobicContact CG-CG1 4.09Å; I109-I197 HydrophobicContact CD1-CG2 4.1Å; I109-I197 HydrophobicContact CG1-CG2 4.5Å; I109-D199 HydrophobicContact CD1-CB 3.86Å
110	D	73.3	Confident	93	Very high	95 Å²	95	31.5 Å²	31.5	51%	0.508	17%	0.168	S	C	.	.			trans	-108.5	2.7	-165.9	69.3	-15.6	0	0	0	114.4
111	S	77.6	Confident	93.2	Very high	17 Å²	17	32.5 Å²	32.5	12%	0.119	17%	0.171	C	C	.	.			trans	-143.2	135.7	-173.3	-173.5	0	0	0	0	113.7	D113 H114	S111-D113 WeakPolarHBondContact CB-O 3.48Å; S111-D113 PolarHBondContact OG-N 2.92Å; S111-D113 PolarHBondContact OG-O 3.46Å; S111-H114 PolarHBondContact O-CE1 2.9Å
112	P	80.8	Confident	93.3	Very high	72 Å²	72	34.3 Å²	34.3	47%	0.468	18%	0.183	S	C	.	.	S	Bend	trans	-73.1	-31.4	169.4	30.4	-33.2	0	0	0	112.1	H114	P112-H114 PolarHBondContact O-ND1 2.95Å
113	D	90.4	Very high	93.4	Very high	93 Å²	93	36 Å²	36	50%	0.497	20%	0.201	S	C	.	.	S	Bend	trans	-97.4	147	-179.3	-55	-31.1	0	0	0	110.3	S111 N155	S111-D113 WeakPolarHBondContact CB-O 3.48Å; S111-D113 PolarHBondContact OG-N 2.92Å; S111-D113 PolarHBondContact OG-O 3.46Å; D113-N155 WeakPolarHBondContact O-CB 3.44Å
114	H	94.5	Very high	93.4	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	21%	0.208	C	C	.	.			trans	-128	125.4	-176.1	-70.1	74.6	0	0	0	110.2	S111 P112 V132 D133 N155 W158 R196 H203	S111-H114 PolarHBondContact O-CE1 2.9Å; P112-H114 PolarHBondContact O-ND1 2.95Å; H114-V132 WeakPolarHBondContact O-CA 3.29Å; H114-D133 PolarHBondContact N-OD1 3.46Å; H114-D133 IonicContact ND1-OD1 3.84Å; H114-D133 PolarHBondContact O-N 2.92Å; H114-N155 WeakPolarHBondContact CA-O 3.37Å; H114-W158 HydrophobicContact CB-CH2 4.04Å; H114-W158 HydrophobicContact CB-CZ2 3.49Å; H114-W158 VanDerWaalsContact CB-CZ2 3.49Å; H114-R196 HydrophobicContact CB-CG 3.79Å; H114-R196 VanDerWaalsContact CD2-CG 3.49Å; H114-R196 WeakPolarHBondContact CD2-CG 3.36Å; H114-H203 AromaticContact CE1-NE2 3.96Å
115	K	97.6	Very high	93.4	Very high	58 Å²	58	40.1 Å²	40.1	25%	0.252	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	124.8	174.5	-178.3	165.1	-174.6	156.7	0	111.9	H117 E130 I131 V132 I154 N155	K115-H117 VanDerWaalsContact CE-NE2 3.29Å; K115-H117 WeakPolarHBondContact CE-NE2 3.45Å; K115-E130 WeakPolarHBondContact CE-OE2 3.24Å; K115-E130 VanDerWaalsContact NZ-CD 3.26Å; K115-E130 IonicContact NZ-OE1 3.75Å; K115-E130 PolarHBondContact NZ-OE1 3.29Å; K115-E130 IonicContact NZ-OE2 3.78Å; K115-E130 PolarHBondContact NZ-OE2 3.26Å; K115-I131 WeakPolarHBondContact CA-O 3.28Å; K115-V132 HydrophobicContact CD-CG2 4.18Å; K115-V132 HydrophobicContact CG-CG2 4.12Å; K115-I154 HydrophobicContact CB-CB 4.06Å; K115-I154 HydrophobicContact CD-CB 4.45Å; K115-I154 HydrophobicContact CD-CG2 4.44Å; K115-I154 HydrophobicContact CG-CB 4.01Å; K115-I154 HydrophobicContact CG-CG1 4.14Å; K115-I154 WeakPolarHBondContact O-CB 3.44Å; K115-I154 PolarHBondContact O-N 3.17Å; K115-N155 HydrophobicContact CB-CB 4.36Å; K115-N155 PolarHBondContact N-O 2.95Å; K115-N155 PolarHBondContact O-N 2.91Å; K115-N155 VanDerWaalsContact O-N 3.14Å
116	L	98.5	Very high	93.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136.8	-178.5	-167.5	67	0	0	0	111	L118 E130 I131 V151 A153 W158 V194	L116-L118 HydrophobicContact CD2-CD2 3.71Å; L116-L118 HydrophobicContact CD2-CG 4.39Å; L116-L118 HydrophobicContact CG-CD2 3.95Å; L116-E130 WeakPolarHBondContact O-CA 3.4Å; L116-I131 HydrophobicContact CB-CB 4.47Å; L116-I131 PolarHBondContact N-O 2.89Å; L116-I131 PolarHBondContact O-N 2.64Å; L116-V151 HydrophobicContact CD1-CG1 3.47Å; L116-V151 VanDerWaalsContact CD1-CG1 3.47Å; L116-V151 HydrophobicContact CG-CG1 4.24Å; L116-A153 HydrophobicContact CD1-CB 3.82Å; L116-W158 HydrophobicContact CB-CD2 3.97Å; L116-W158 HydrophobicContact CB-CE3 4.38Å; L116-W158 HydrophobicContact CB-CG 4.49Å; L116-W158 HydrophobicContact CB-CH2 4.06Å; L116-W158 HydrophobicContact CB-CZ2 3.6Å; L116-W158 HydrophobicContact CB-CZ3 4.42Å; L116-W158 HydrophobicContact CD1-CG 4.17Å; L116-W158 HydrophobicContact CD2-CB 4.29Å; L116-W158 HydrophobicContact CD2-CD2 3.84Å; L116-W158 HydrophobicContact CD2-CE3 3.94Å; L116-W158 HydrophobicContact CD2-CG 4.02Å; L116-W158 HydrophobicContact CD2-CZ3 4.48Å; L116-W158 HydrophobicContact CG-CD2 4.34Å; L116-W158 HydrophobicContact CG-CG 4.48Å; L116-V194 HydrophobicContact CD2-CG1 4.43Å; L116-V194 HydrophobicContact CD2-CG2 3.64Å
117	H	98.8	Very high	93.5	Very high	17 Å²	17	44.3 Å²	44.3	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.6	167.2	-59.8	161.4	0	0	0	110.1	K115 F119 K128 M129 E130 V151 R152	K115-H117 VanDerWaalsContact CE-NE2 3.29Å; K115-H117 WeakPolarHBondContact CE-NE2 3.45Å; H117-F119 HydrophobicContact CB-CD2 4.34Å; H117-F119 HydrophobicContact CB-CE2 3.48Å; H117-F119 VanDerWaalsContact CB-CE2 3.48Å; H117-F119 HydrophobicContact CB-CZ 3.89Å; H117-K128 PolarHBondContact CE1-NZ 3.25Å; H117-K128 VanDerWaalsContact CE1-NZ 3.28Å; H117-K128 PolarHBondContact ND1-NZ 3.11Å; H117-K128 PolarHBondContact NE2-NZ 3.14Å; H117-M129 CarbonylContact C-O 3.55Å; H117-M129 WeakPolarHBondContact CA-O 3.44Å; H117-E130 IonicContact CD2-OE2 2.92Å; H117-E130 IonicContact CE1-OE2 3.38Å; H117-E130 IonicContact NE2-OE2 2.95Å; H117-E130 PolarHBondContact NE2-OE2 2.8Å; H117-V151 CarbonylContact O-C 3.56Å; H117-V151 WeakPolarHBondContact O-CA 3.32Å; H117-R152 HydrophobicContact CB-CB 4.17Å; H117-R152 PolarHBondContact N-O 3.35Å; H117-R152 PolarHBondContact O-N 3Å
118	L	98.8	Very high	93.7	Very high	3 Å²	3	49 Å²	49	2%	0.016	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	141.2	171.8	-52.7	-179.5	0	0	0	109.3	L116 K128 M129 I131 L139 F144 V148 V151 V194	L116-L118 HydrophobicContact CD2-CD2 3.71Å; L116-L118 HydrophobicContact CD2-CG 4.39Å; L116-L118 HydrophobicContact CG-CD2 3.95Å; L118-K128 CarbonylContact O-C 3.59Å; L118-K128 WeakPolarHBondContact O-CA 3.44Å; L118-M129 HydrophobicContact CB-CB 4.39Å; L118-M129 PolarHBondContact N-O 2.92Å; L118-M129 PolarHBondContact O-N 2.87Å; L118-I131 HydrophobicContact CD1-CD1 4.07Å; L118-L139 HydrophobicContact CD1-CD1 3.97Å; L118-L139 HydrophobicContact CD1-CD2 3.74Å; L118-F144 HydrophobicContact CB-CE1 4.5Å; L118-F144 HydrophobicContact CB-CZ 4.44Å; L118-V148 HydrophobicContact CB-CG1 4.17Å; L118-V148 HydrophobicContact CB-CG2 4.34Å; L118-V148 HydrophobicContact CD1-CG2 4.28Å; L118-V148 HydrophobicContact CD2-CG1 4.13Å; L118-V151 HydrophobicContact CD2-CG1 4.15Å; L118-V151 HydrophobicContact CD2-CG2 3.81Å; L118-V194 HydrophobicContact CD1-CG1 4.4Å
119	F	98.8	Very high	94.1	Very high	9 Å²	9	46 Å²	46	4%	0.039	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	138	179.7	-61.4	-94.7	0	0	0	111	H117 N121 F124 R127 K128 V148 A149 S150 R152	H117-F119 HydrophobicContact CB-CD2 4.34Å; H117-F119 HydrophobicContact CB-CE2 3.48Å; H117-F119 VanDerWaalsContact CB-CE2 3.48Å; H117-F119 HydrophobicContact CB-CZ 3.89Å; F119-N121 VanDerWaalsContact C-N 3.32Å; F119-N121 PolarHBondContact O-N 3.29Å; F119-F124 VanDerWaalsContact CD1-C 3.41Å; F119-F124 HydrophobicContact CD1-CB 4.1Å; F119-F124 WeakPolarHBondContact CD1-O 3.25Å; F119-F124 HydrophobicContact CD2-CB 4.16Å; F119-F124 AromaticContact CD2-CD1 3.91Å; F119-F124 HydrophobicContact CD2-CD1 3.91Å; F119-F124 HydrophobicContact CE1-CB 3.93Å; F119-F124 WeakPolarHBondContact CE1-O 3.43Å; F119-F124 HydrophobicContact CE2-CB 4Å; F119-F124 AromaticContact CE2-CD1 3.9Å; F119-F124 HydrophobicContact CE2-CD1 3.9Å; F119-F124 HydrophobicContact CE2-CG 4.34Å; F119-F124 HydrophobicContact CG-CB 4.21Å; F119-F124 HydrophobicContact CZ-CB 3.89Å; F119-R127 WeakPolarHBondContact CA-O 3.49Å; F119-K128 HydrophobicContact CD1-CB 4Å; F119-K128 HydrophobicContact CD1-CG 4.06Å; F119-K128 HydrophobicContact CE1-CB 3.95Å; F119-K128 HydrophobicContact CE1-CD 3.74Å; F119-K128 HydrophobicContact CE1-CG 3.66Å; F119-K128 HydrophobicContact CZ-CD 3.97Å; F119-K128 HydrophobicContact CZ-CG 4.03Å; F119-V148 CarbonylContact O-C 3.59Å; F119-V148 WeakPolarHBondContact O-CA 3.46Å; F119-A149 PolarHBondContact O-N 3.21Å; F119-S150 WeakPolarHBondContact CB-OG 3.3Å; F119-S150 PolarHBondContact N-O 3.25Å; F119-S150 PolarHBondContact O-N 2.78Å; F119-R152 HydrophobicContact CE2-CG 4.09Å
120	E	98.3	Very high	94.7	Very high	48 Å²	48	49.2 Å²	49.2	22%	0.224	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	-34.2	-179.3	179.2	-176.4	-168.8	0	0	113	R127 F144 R147 A149	E120-R127 HydrophobicContact CB-CB 4.09Å; E120-R127 PolarHBondContact N-O 2.94Å; E120-R127 VanDerWaalsContact OE2-CB 3.26Å; E120-R127 WeakPolarHBondContact OE2-CB 3.24Å; E120-R127 PolarHBondContact OE2-N 2.89Å; E120-F144 HydrophobicContact CB-CZ 4.48Å; E120-R147 PolarHBondContact O-NE 2.88Å; E120-R147 VanDerWaalsContact O-NE 3.16Å; E120-A149 WeakPolarHBondContact O-CB 3.41Å
121	N	98.6	Very high	95.9	Very high	54 Å²	54	45 Å²	45	29%	0.289	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	161	-176.9	-68.7	-40.4	0	0	0	112	F119 S125 A149 S150	F119-N121 VanDerWaalsContact C-N 3.32Å; F119-N121 PolarHBondContact O-N 3.29Å; N121-S125 WeakPolarHBondContact CB-O 3.4Å; N121-S125 WeakPolarHBondContact CB-OG 3.43Å; N121-S125 PolarHBondContact N-O 2.85Å; N121-S125 VanDerWaalsContact N-O 3.12Å; N121-A149 VanDerWaalsContact C-CB 3.5Å; N121-S150 PolarHBondContact O-OG 2.81Å
122	P	98.8	Very high	96.9	Very high	42 Å²	42	47.5 Å²	47.5	27%	0.273	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-57.5	163.7	172.4	-25	35.7	0	0	0	112.7	F124 S125 A149 R179 W181	P122-F124 PolarHBondContact O-N 2.92Å; P122-S125 PolarHBondContact O-N 2.86Å; P122-S125 PolarHBondContact O-OG 3.09Å; P122-A149 HydrophobicContact CG-CB 4.09Å; P122-R179 CarbonylContact C-O 3.59Å; P122-R179 WeakPolarHBondContact CA-O 3.35Å; P122-R179 WeakPolarHBondContact CB-O 3.43Å; P122-W181 HydrophobicContact CG-CZ3 3.9Å
123	A	98.5	Very high	97.5	Very high	67 Å²	67	47.3 Å²	47.3	55%	0.554	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	53.5	37	177.1	0	0	0	0	0	114.3	S125 R179	A123-S125 PolarHBondContact O-N 3.46Å; A123-R179 PolarHBondContact N-O 2.85Å
124	F	98.5	Very high	97.7	Very high	32 Å²	32	47 Å²	47	14%	0.14	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	62.3	37.9	173.6	-38.1	-59	0	0	0	114.3	F119 P122 S150 V151 R152 E177 Y178 R179	F119-F124 VanDerWaalsContact CD1-C 3.41Å; F119-F124 HydrophobicContact CD1-CB 4.1Å; F119-F124 WeakPolarHBondContact CD1-O 3.25Å; F119-F124 HydrophobicContact CD2-CB 4.16Å; F119-F124 AromaticContact CD2-CD1 3.91Å; F119-F124 HydrophobicContact CD2-CD1 3.91Å; F119-F124 HydrophobicContact CE1-CB 3.93Å; F119-F124 WeakPolarHBondContact CE1-O 3.43Å; F119-F124 HydrophobicContact CE2-CB 4Å; F119-F124 AromaticContact CE2-CD1 3.9Å; F119-F124 HydrophobicContact CE2-CD1 3.9Å; F119-F124 HydrophobicContact CE2-CG 4.34Å; F119-F124 HydrophobicContact CG-CB 4.21Å; F119-F124 HydrophobicContact CZ-CB 3.89Å; P122-F124 PolarHBondContact O-N 2.92Å; F124-S150 VanDerWaalsContact CA-OG 3.29Å; F124-S150 WeakPolarHBondContact CA-OG 3.49Å; F124-S150 PolarHBondContact N-OG 2.9Å; F124-V151 WeakPolarHBondContact CE1-O 3.33Å; F124-R152 HydrophobicContact CD1-CG 3.72Å; F124-R152 HydrophobicContact CE1-CG 3.63Å; F124-R152 HydrophobicContact CG-CG 4.37Å; F124-R152 HydrophobicContact CZ-CG 4.18Å; F124-E177 HydrophobicContact CZ-CB 3.81Å; F124-E177 HydrophobicContact CZ-CG 4.2Å; F124-Y178 WeakPolarHBondContact CE1-O 3.38Å; F124-R179 HydrophobicContact CE1-CG 4.28Å; F124-R179 HydrophobicContact CE2-CG 3.61Å; F124-R179 HydrophobicContact CZ-CB 4.3Å; F124-R179 HydrophobicContact CZ-CG 3.36Å
125	S	98.4	Very high	97.8	Very high	56 Å²	56	49 Å²	49	39%	0.392	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	171	-177.1	68.3	0	0	0	0	112.6	N121 P122 A123	N121-S125 WeakPolarHBondContact CB-O 3.4Å; N121-S125 WeakPolarHBondContact CB-OG 3.43Å; N121-S125 PolarHBondContact N-O 2.85Å; N121-S125 VanDerWaalsContact N-O 3.12Å; P122-S125 PolarHBondContact O-N 2.86Å; P122-S125 PolarHBondContact O-OG 3.09Å; A123-S125 PolarHBondContact O-N 3.46Å
126	G	97.5	Very high	97.8	Very high	49 Å²	49	46.3 Å²	46.3	51%	0.505	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	77.2	-157.2	-177.5	0	0	0	0	0	113.2
127	R	97.7	Very high	97.8	Very high	107 Å²	107	49.3 Å²	49.3	40%	0.404	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	137.6	176.5	-169	-177.8	-58.7	171.3	12.2	110.4	F119 E120 G143 F144	F119-R127 WeakPolarHBondContact CA-O 3.49Å; E120-R127 HydrophobicContact CB-CB 4.09Å; E120-R127 PolarHBondContact N-O 2.94Å; E120-R127 VanDerWaalsContact OE2-CB 3.26Å; E120-R127 WeakPolarHBondContact OE2-CB 3.24Å; E120-R127 PolarHBondContact OE2-N 2.89Å; R127-G143 PolarHBondContact NH1-O 2.89Å; R127-F144 HydrophobicContact CB-CE2 4.13Å; R127-F144 HydrophobicContact CG-CD2 4.09Å; R127-F144 HydrophobicContact CG-CE2 3.77Å
128	K	97.7	Very high	97.7	Very high	100 Å²	100	50 Å²	50	44%	0.435	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	139	177.6	-179.8	-172.2	174.7	-169.4	0	110.6	H117 L118 F119 E130	H117-K128 PolarHBondContact CE1-NZ 3.25Å; H117-K128 VanDerWaalsContact CE1-NZ 3.28Å; H117-K128 PolarHBondContact ND1-NZ 3.11Å; H117-K128 PolarHBondContact NE2-NZ 3.14Å; L118-K128 CarbonylContact O-C 3.59Å; L118-K128 WeakPolarHBondContact O-CA 3.44Å; F119-K128 HydrophobicContact CD1-CB 4Å; F119-K128 HydrophobicContact CD1-CG 4.06Å; F119-K128 HydrophobicContact CE1-CB 3.95Å; F119-K128 HydrophobicContact CE1-CD 3.74Å; F119-K128 HydrophobicContact CE1-CG 3.66Å; F119-K128 HydrophobicContact CZ-CD 3.97Å; F119-K128 HydrophobicContact CZ-CG 4.03Å; K128-E130 IonicContact NZ-OE2 3.51Å
129	M	98.3	Very high	97.7	Very high	18 Å²	18	49.9 Å²	49.9	9%	0.089	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	133.5	165	-178.3	172.3	-178.7	0	0	109.3	H117 L118 I131 V136 L139 H142 F144	H117-M129 CarbonylContact C-O 3.55Å; H117-M129 WeakPolarHBondContact CA-O 3.44Å; L118-M129 HydrophobicContact CB-CB 4.39Å; L118-M129 PolarHBondContact N-O 2.92Å; L118-M129 PolarHBondContact O-N 2.87Å; M129-I131 HydrophobicContact CE-CD1 4.15Å; M129-I131 HydrophobicContact CE-CG1 3.97Å; M129-I131 HydrophobicContact CG-CG1 4.19Å; M129-V136 HydrophobicContact CE-CG1 4.08Å; M129-V136 HydrophobicContact CE-CG2 4.09Å; M129-L139 HydrophobicContact CE-CD2 4.39Å; M129-L139 HydrophobicContact SD-CD2 3.97Å; M129-H142 HydrophobicContact CE-CB 3.39Å; M129-H142 VanDerWaalsContact CE-CG 3.49Å; M129-H142 HydrophobicContact SD-CB 4.19Å; M129-F144 HydrophobicContact CB-CD2 3.64Å; M129-F144 HydrophobicContact CB-CE2 3.73Å; M129-F144 HydrophobicContact CB-CG 4.26Å; M129-F144 HydrophobicContact CB-CZ 4.43Å; M129-F144 HydrophobicContact SD-CB 4.03Å; M129-F144 HydrophobicContact SD-CD2 4.39Å; M129-F144 HydrophobicContact SD-CG 4.2Å
130	E	98.4	Very high	97.6	Very high	96 Å²	96	55.1 Å²	55.1	45%	0.449	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	132	171.9	174.8	170.5	121.3	0	0	109	K115 L116 H117 K128 V132	K115-E130 WeakPolarHBondContact CE-OE2 3.24Å; K115-E130 VanDerWaalsContact NZ-CD 3.26Å; K115-E130 IonicContact NZ-OE1 3.75Å; K115-E130 PolarHBondContact NZ-OE1 3.29Å; K115-E130 IonicContact NZ-OE2 3.78Å; K115-E130 PolarHBondContact NZ-OE2 3.26Å; L116-E130 WeakPolarHBondContact O-CA 3.4Å; H117-E130 IonicContact CD2-OE2 2.92Å; H117-E130 IonicContact CE1-OE2 3.38Å; H117-E130 IonicContact NE2-OE2 2.95Å; H117-E130 PolarHBondContact NE2-OE2 2.8Å; K128-E130 IonicContact NZ-OE2 3.51Å; E130-V132 HydrophobicContact CG-CG2 3.91Å
131	I	98.1	Very high	97.4	Very high	6 Å²	6	56.7 Å²	56.7	3%	0.031	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.6	177.5	-52	170.4	0	0	0	106.9	K115 L116 L118 M129 D134 V136 W158 V194	K115-I131 WeakPolarHBondContact CA-O 3.28Å; L116-I131 HydrophobicContact CB-CB 4.47Å; L116-I131 PolarHBondContact N-O 2.89Å; L116-I131 PolarHBondContact O-N 2.64Å; L118-I131 HydrophobicContact CD1-CD1 4.07Å; M129-I131 HydrophobicContact CE-CD1 4.15Å; M129-I131 HydrophobicContact CE-CG1 3.97Å; M129-I131 HydrophobicContact CG-CG1 4.19Å; I131-D134 HydrophobicContact CG2-CB 4.35Å; I131-D134 WeakPolarHBondContact CG2-O 3.49Å; I131-V136 HydrophobicContact CD1-CB 4.35Å; I131-V136 HydrophobicContact CD1-CG2 3.74Å; I131-V136 HydrophobicContact CG1-CG2 4.08Å; I131-V136 HydrophobicContact CG2-CG2 3.9Å; I131-W158 HydrophobicContact CB-CH2 4.17Å; I131-W158 HydrophobicContact CB-CZ3 4.5Å; I131-W158 HydrophobicContact CG2-CH2 3.72Å; I131-W158 HydrophobicContact CG2-CZ3 3.9Å; I131-V194 HydrophobicContact CD1-CG1 3.39Å
132	V	97.3	Very high	97.1	Very high	69 Å²	69	59.4 Å²	59.4	42%	0.418	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	121.4	179.9	-177.8	0	0	0	0	107.9	H114 K115 E130 D134	H114-V132 WeakPolarHBondContact O-CA 3.29Å; K115-V132 HydrophobicContact CD-CG2 4.18Å; K115-V132 HydrophobicContact CG-CG2 4.12Å; E130-V132 HydrophobicContact CG-CG2 3.91Å; V132-D134 PolarHBondContact O-N 2.79Å
133	D	94.6	Very high	96.7	Very high	68 Å²	68	59.7 Å²	59.7	36%	0.364	35%	0.345	S	S	.	.	S	Bend	trans	45.6	36.6	175.6	-63.3	-50.1	0	0	0	115.3	H114 R196	H114-D133 PolarHBondContact N-OD1 3.46Å; H114-D133 IonicContact ND1-OD1 3.84Å; H114-D133 PolarHBondContact O-N 2.92Å; D133-R196 PolarHBondContact O-NH1 2.93Å; D133-R196 PolarHBondContact O-NH2 3.4Å; D133-R196 IonicContact OD1-NH1 2.98Å
134	D	94.9	Very high	96.4	Very high	86 Å²	86	56.9 Å²	56.9	46%	0.46	32%	0.321	S	S	.	.			trans	-136.4	157.4	176.4	-153.6	4.4	0	0	0	112.3	I131 V132 W158 R196	I131-D134 HydrophobicContact CG2-CB 4.35Å; I131-D134 WeakPolarHBondContact CG2-O 3.49Å; V132-D134 PolarHBondContact O-N 2.79Å; D134-W158 WeakPolarHBondContact O-CZ3 3.46Å; D134-R196 VanDerWaalsContact N-CZ 3.33Å; D134-R196 PolarHBondContact O-NE 2.89Å
135	D	96.4	Very high	96.1	Very high	43 Å²	43	58.7 Å²	58.7	23%	0.23	33%	0.329	C	S	.	.			trans	-105.8	139.1	168.5	-53.5	-30.7	0	0	0	109.2	P137 Y166 R195 R196 R198	D135-P137 WeakPolarHBondContact O-CD 3.37Å; D135-Y166 WeakPolarHBondContact CB-OH 3.35Å; D135-R195 HydrophobicContact CB-CB 3.87Å; D135-R196 IonicContact OD1-CZ 4Å; D135-R196 PolarHBondContact OD1-N 3.31Å; D135-R196 IonicContact OD1-NE 3.93Å; D135-R196 PolarHBondContact OD1-NE 3.47Å; D135-R196 IonicContact OD1-NH2 3.93Å; D135-R198 IonicContact OD1-CZ 2.78Å; D135-R198 IonicContact OD1-NH2 3.37Å; D135-R198 PolarHBondContact OD1-NH2 3.05Å; D135-R198 IonicContact OD2-CZ 3.52Å; D135-R198 IonicContact OD2-NH2 3.17Å; D135-R198 PolarHBondContact OD2-NH2 2.81Å
136	V	97.8	Very high	95.9	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.012	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-117.1	97.5	-175.1	-178.2	0	0	0	0	109.7	M129 I131 S138 L139 S193 V194	M129-V136 HydrophobicContact CE-CG1 4.08Å; M129-V136 HydrophobicContact CE-CG2 4.09Å; I131-V136 HydrophobicContact CD1-CB 4.35Å; I131-V136 HydrophobicContact CD1-CG2 3.74Å; I131-V136 HydrophobicContact CG1-CG2 4.08Å; I131-V136 HydrophobicContact CG2-CG2 3.9Å; V136-S138 WeakPolarHBondContact CG1-O 3.48Å; V136-S138 PolarHBondContact O-N 2.67Å; V136-L139 HydrophobicContact CB-CD2 4.4Å; V136-L139 HydrophobicContact CG1-CD2 3.82Å; V136-S193 VanDerWaalsContact O-CA 3.29Å; V136-S193 WeakPolarHBondContact O-CA 3.32Å; V136-S193 VanDerWaalsContact O-CB 3.28Å; V136-S193 WeakPolarHBondContact O-CB 3.39Å; V136-V194 CarbonylContact C-O 3.59Å; V136-V194 HydrophobicContact CB-CG1 4.1Å; V136-V194 PolarHBondContact N-O 2.94Å; V136-V194 PolarHBondContact O-N 2.89Å
137	P	97.5	Very high	95.9	Very high	63 Å²	63	60.5 Å²	60.5	41%	0.409	32%	0.317	S	S	.	.	S	Bend	trans	-72.6	-12.9	179.1	29.1	-34.9	0	0	0	113	D135 P164 G165 Y166 S193	D135-P137 WeakPolarHBondContact O-CD 3.37Å; P137-P164 CarbonylContact O-C 3.6Å; P137-P164 WeakPolarHBondContact O-CA 3.43Å; P137-G165 PolarHBondContact O-N 2.98Å; P137-Y166 HydrophobicContact CB-CE1 4.28Å; P137-Y166 HydrophobicContact CB-CE2 4.31Å; P137-S193 VanDerWaalsContact O-CB 3.3Å; P137-S193 WeakPolarHBondContact O-CB 3.33Å
138	S	97.9	Very high	96	Very high	31 Å²	31	55.4 Å²	55.4	22%	0.217	30%	0.297	C	S	.	.			trans	-152.4	113.2	174.7	179.6	0	0	0	0	110.6	V136 W140 A141 Q192	V136-S138 WeakPolarHBondContact CG1-O 3.48Å; V136-S138 PolarHBondContact O-N 2.67Å; S138-W140 PolarHBondContact O-N 2.95Å; S138-A141 WeakPolarHBondContact O-CB 3.49Å; S138-A141 PolarHBondContact O-N 2.95Å; S138-A141 VanDerWaalsContact O-N 3.16Å; S138-Q192 CarbonylContact C-O 3.56Å; S138-Q192 WeakPolarHBondContact CA-O 3.33Å
139	L	97.6	Very high	96	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-61.8	-31.1	175.2	-63.4	-172	0	0	0	111.6	L118 M129 V136 A141 H142 F144 V148 L191 Q192 V194	L118-L139 HydrophobicContact CD1-CD1 3.97Å; L118-L139 HydrophobicContact CD1-CD2 3.74Å; M129-L139 HydrophobicContact CE-CD2 4.39Å; M129-L139 HydrophobicContact SD-CD2 3.97Å; V136-L139 HydrophobicContact CB-CD2 4.4Å; V136-L139 HydrophobicContact CG1-CD2 3.82Å; L139-A141 VanDerWaalsContact C-N 3.27Å; L139-A141 PolarHBondContact O-N 3.28Å; L139-H142 PolarHBondContact O-N 3.43Å; L139-H142 VanDerWaalsContact O-N 3.13Å; L139-F144 HydrophobicContact CB-CB 4.04Å; L139-F144 HydrophobicContact CD1-CD1 4.18Å; L139-F144 WeakPolarHBondContact O-CB 3.43Å; L139-F144 PolarHBondContact O-N 3.42Å; L139-V148 HydrophobicContact CD1-CG2 3.88Å; L139-L191 VanDerWaalsContact CD1-O 3.32Å; L139-L191 WeakPolarHBondContact CD1-O 3.43Å; L139-Q192 PolarHBondContact N-O 2.92Å; L139-V194 HydrophobicContact CD2-CG1 4.16Å
140	W	96.2	Very high	96	Very high	120 Å²	120	49.8 Å²	49.8	46%	0.455	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-60.5	-34.1	175.8	-61.7	99.8	0	0	0	113.1	S138 H142 G143 Q145 D146	S138-W140 PolarHBondContact O-N 2.95Å; W140-H142 PolarHBondContact O-N 2.85Å; W140-H142 VanDerWaalsContact O-N 3.13Å; W140-G143 PolarHBondContact O-N 2.85Å; W140-Q145 HydrophobicContact CH2-CB 4.13Å; W140-Q145 HydrophobicContact CH2-CG 4.31Å; W140-Q145 HydrophobicContact CZ3-CB 4.22Å; W140-Q145 HydrophobicContact CZ3-CG 4.02Å; W140-D146 HydrophobicContact CZ2-CB 3.73Å
141	A	95.2	Very high	96.1	Very high	81 Å²	81	45.2 Å²	45.2	67%	0.669	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-64.2	-17.9	179.1	0	0	0	0	0	112.7	S138 L139	S138-A141 WeakPolarHBondContact O-CB 3.49Å; S138-A141 PolarHBondContact O-N 2.95Å; S138-A141 VanDerWaalsContact O-N 3.16Å; L139-A141 VanDerWaalsContact C-N 3.27Å; L139-A141 PolarHBondContact O-N 3.28Å
142	H	91.9	Very high	96.1	Very high	110 Å²	110	48.5 Å²	48.5	51%	0.509	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-107.9	18	177.5	-60.8	-94.5	0	0	0	112.5	M129 L139 W140 F144	M129-H142 HydrophobicContact CE-CB 3.39Å; M129-H142 VanDerWaalsContact CE-CG 3.49Å; M129-H142 HydrophobicContact SD-CB 4.19Å; L139-H142 PolarHBondContact O-N 3.43Å; L139-H142 VanDerWaalsContact O-N 3.13Å; W140-H142 PolarHBondContact O-N 2.85Å; W140-H142 VanDerWaalsContact O-N 3.13Å; H142-F144 PolarHBondContact O-N 2.87Å
143	G	89.7	Confident	96.1	Very high	49 Å²	49	45.3 Å²	45.3	51%	0.505	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	13	178.2	0	0	0	0	0	114.6	R127 W140	R127-G143 PolarHBondContact NH1-O 2.89Å; W140-G143 PolarHBondContact O-N 2.85Å
144	F	92.7	Very high	96.3	Very high	8 Å²	8	45.2 Å²	45.2	4%	0.035	24%	0.243	C	C	.	.			trans	-85.5	-179.6	169.6	-141.5	-107.1	0	0	0	110.8	L118 E120 R127 M129 L139 H142 R147 V148	L118-F144 HydrophobicContact CB-CE1 4.5Å; L118-F144 HydrophobicContact CB-CZ 4.44Å; E120-F144 HydrophobicContact CB-CZ 4.48Å; R127-F144 HydrophobicContact CB-CE2 4.13Å; R127-F144 HydrophobicContact CG-CD2 4.09Å; R127-F144 HydrophobicContact CG-CE2 3.77Å; M129-F144 HydrophobicContact CB-CD2 3.64Å; M129-F144 HydrophobicContact CB-CE2 3.73Å; M129-F144 HydrophobicContact CB-CG 4.26Å; M129-F144 HydrophobicContact CB-CZ 4.43Å; M129-F144 HydrophobicContact SD-CB 4.03Å; M129-F144 HydrophobicContact SD-CD2 4.39Å; M129-F144 HydrophobicContact SD-CG 4.2Å; L139-F144 HydrophobicContact CB-CB 4.04Å; L139-F144 HydrophobicContact CD1-CD1 4.18Å; L139-F144 WeakPolarHBondContact O-CB 3.43Å; L139-F144 PolarHBondContact O-N 3.42Å; H142-F144 PolarHBondContact O-N 2.87Å; F144-R147 WeakPolarHBondContact CE1-O 3.43Å; F144-V148 HydrophobicContact CD1-CG2 4.44Å; F144-V148 HydrophobicContact CE1-CG2 3.89Å
145	Q	92.4	Very high	96.2	Very high	69 Å²	69	43.8 Å²	43.8	32%	0.322	24%	0.235	S	C	.	.			trans	-118.6	-175.2	177.6	-65.6	177.7	11.1	0	0	109.9	W140 R147	W140-Q145 HydrophobicContact CH2-CB 4.13Å; W140-Q145 HydrophobicContact CH2-CG 4.31Å; W140-Q145 HydrophobicContact CZ3-CB 4.22Å; W140-Q145 HydrophobicContact CZ3-CG 4.02Å; Q145-R147 PolarHBondContact O-N 3.36Å
146	D	94	Very high	96.1	Very high	57 Å²	57	41.8 Å²	41.8	31%	0.305	22%	0.224	S	C	.	.	S	Bend	trans	-80.9	0.3	174.3	64.5	-25.8	0	0	0	113.9	W140 Q190 L191 Q192	W140-D146 HydrophobicContact CZ2-CB 3.73Å; D146-Q190 CarbonylContact O-C 3.6Å; D146-Q190 VanDerWaalsContact O-CA 3.27Å; D146-Q190 WeakPolarHBondContact O-CA 3.4Å; D146-L191 CarbonylContact C-O 3.57Å; D146-L191 WeakPolarHBondContact CA-O 3.47Å; D146-L191 PolarHBondContact O-N 3.21Å; D146-Q192 HydrophobicContact CB-CG 3.39Å
147	R	98.2	Very high	96	Very high	86 Å²	86	41.8 Å²	41.8	33%	0.325	22%	0.224	S	C	.	.	B	Isolated β-bridge	trans	-99.7	114.1	179.5	-175	-176.9	173	82.3	2	112.2	E120 F144 Q145 P189	E120-R147 PolarHBondContact O-NE 2.88Å; E120-R147 VanDerWaalsContact O-NE 3.16Å; F144-R147 WeakPolarHBondContact CE1-O 3.43Å; Q145-R147 PolarHBondContact O-N 3.36Å; R147-P189 CarbonylContact C-O 3.39Å; R147-P189 WeakPolarHBondContact CA-O 3.12Å; R147-P189 HydrophobicContact CG-CB 4.32Å; R147-P189 HydrophobicContact CG-CG 4.26Å; R147-P189 VanDerWaalsContact NH1-CG 3.29Å
148	V	98.6	Very high	96	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.205	C	C	.	.			trans	-125.9	114	169.7	178.5	0	0	0	0	108.5	L118 F119 L139 F144 V151 W184 P189 L191	L118-V148 HydrophobicContact CB-CG1 4.17Å; L118-V148 HydrophobicContact CB-CG2 4.34Å; L118-V148 HydrophobicContact CD1-CG2 4.28Å; L118-V148 HydrophobicContact CD2-CG1 4.13Å; F119-V148 CarbonylContact O-C 3.59Å; F119-V148 WeakPolarHBondContact O-CA 3.46Å; L139-V148 HydrophobicContact CD1-CG2 3.88Å; F144-V148 HydrophobicContact CD1-CG2 4.44Å; F144-V148 HydrophobicContact CE1-CG2 3.89Å; V148-V151 HydrophobicContact CG1-CG2 3.66Å; V148-W184 HydrophobicContact CG1-CH2 4.44Å; V148-W184 WeakPolarHBondContact O-CZ2 3.35Å; V148-P189 PolarHBondContact N-O 3.49Å; V148-P189 CarbonylContact O-C 3.56Å; V148-P189 WeakPolarHBondContact O-CA 3.5Å; V148-P189 WeakPolarHBondContact O-CB 3.29Å; V148-L191 HydrophobicContact CB-CB 4.03Å; V148-L191 HydrophobicContact CB-CD1 3.98Å; V148-L191 HydrophobicContact CB-CG 4.4Å; V148-L191 HydrophobicContact CG1-CD1 4.04Å; V148-L191 HydrophobicContact CG2-CB 3.81Å; V148-L191 HydrophobicContact CG2-CD1 4.36Å
149	A	98.7	Very high	96	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.194	C	C	.	.			trans	-113.8	-12	-173.7	0	0	0	0	0	114.5	F119 E120 N121 P122 H180 W181 P189	F119-A149 PolarHBondContact O-N 3.21Å; E120-A149 WeakPolarHBondContact O-CB 3.41Å; N121-A149 VanDerWaalsContact C-CB 3.5Å; P122-A149 HydrophobicContact CG-CB 4.09Å; A149-H180 CarbonylContact O-C 3.54Å; A149-H180 WeakPolarHBondContact O-CA 3.36Å; A149-W181 HydrophobicContact CB-CE3 3.62Å; A149-W181 HydrophobicContact CB-CZ3 3.76Å; A149-W181 PolarHBondContact O-N 2.54Å; A149-P189 HydrophobicContact CB-CB 4.1Å
150	S	98.8	Very high	96	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	155.8	164.2	58.2	0	0	0	0	111.6	F119 N121 F124 Y178 R179	F119-S150 WeakPolarHBondContact CB-OG 3.3Å; F119-S150 PolarHBondContact N-O 3.25Å; F119-S150 PolarHBondContact O-N 2.78Å; N121-S150 PolarHBondContact O-OG 2.81Å; F124-S150 VanDerWaalsContact CA-OG 3.29Å; F124-S150 WeakPolarHBondContact CA-OG 3.49Å; F124-S150 PolarHBondContact N-OG 2.9Å; S150-Y178 CarbonylContact C-O 3.58Å; S150-Y178 VanDerWaalsContact CA-O 3.25Å; S150-Y178 WeakPolarHBondContact CA-O 3.33Å; S150-Y178 WeakPolarHBondContact CB-O 3.42Å; S150-R179 WeakPolarHBondContact CB-O 3.36Å
151	V	98.9	Very high	96.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	140.8	-173.3	176.9	0	0	0	0	110.3	L116 H117 L118 F124 V148 F173 Y178 W184	L116-V151 HydrophobicContact CD1-CG1 3.47Å; L116-V151 VanDerWaalsContact CD1-CG1 3.47Å; L116-V151 HydrophobicContact CG-CG1 4.24Å; H117-V151 CarbonylContact O-C 3.56Å; H117-V151 WeakPolarHBondContact O-CA 3.32Å; L118-V151 HydrophobicContact CD2-CG1 4.15Å; L118-V151 HydrophobicContact CD2-CG2 3.81Å; F124-V151 WeakPolarHBondContact CE1-O 3.33Å; V148-V151 HydrophobicContact CG1-CG2 3.66Å; V151-F173 HydrophobicContact CB-CD1 4.11Å; V151-F173 HydrophobicContact CB-CE1 3.97Å; V151-F173 HydrophobicContact CG1-CD1 3.81Å; V151-F173 HydrophobicContact CG1-CE1 4.08Å; V151-F173 HydrophobicContact CG1-CG 4.18Å; V151-F173 HydrophobicContact CG2-CD1 4.32Å; V151-F173 HydrophobicContact CG2-CE1 3.74Å; V151-F173 HydrophobicContact CG2-CZ 4.02Å; V151-Y178 HydrophobicContact CB-CD2 4.36Å; V151-Y178 HydrophobicContact CG1-CD2 4.48Å; V151-Y178 PolarHBondContact N-O 3.45Å; V151-Y178 PolarHBondContact O-N 2.79Å; V151-W184 HydrophobicContact CB-CZ3 4.37Å; V151-W184 HydrophobicContact CG2-CH2 4Å; V151-W184 HydrophobicContact CG2-CZ3 3.98Å
152	R	98.8	Very high	96.2	Very high	76 Å²	76	29 Å²	29	29%	0.287	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	108.7	162.4	-63.1	-178.5	164.9	143.4	-1.5	109.7	H117 F119 F124 I154 E177	H117-R152 HydrophobicContact CB-CB 4.17Å; H117-R152 PolarHBondContact N-O 3.35Å; H117-R152 PolarHBondContact O-N 3Å; F119-R152 HydrophobicContact CE2-CG 4.09Å; F124-R152 HydrophobicContact CD1-CG 3.72Å; F124-R152 HydrophobicContact CE1-CG 3.63Å; F124-R152 HydrophobicContact CG-CG 4.37Å; F124-R152 HydrophobicContact CZ-CG 4.18Å; R152-I154 HydrophobicContact CB-CD1 3.75Å; R152-I154 HydrophobicContact CB-CG1 4.47Å; R152-I154 PolarHBondContact O-N 2.94Å; R152-E177 HydrophobicContact CG-CG 4.2Å; R152-E177 IonicContact CZ-OE1 2.72Å; R152-E177 IonicContact NE-OE1 3.53Å; R152-E177 PolarHBondContact NE-OE1 3.29Å; R152-E177 IonicContact NH2-OE1 3.29Å; R152-E177 PolarHBondContact NH2-OE1 3.31Å
153	A	97.7	Very high	96.5	Very high	2 Å²	2	27.9 Å²	27.9	2%	0.017	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	92.9	169.2	0	0	0	0	0	107.9	L116 F173 E174 R175 G176	L116-A153 HydrophobicContact CD1-CB 3.82Å; A153-F173 HydrophobicContact CB-CB 4.17Å; A153-E174 VanDerWaalsContact CB-O 3.24Å; A153-E174 WeakPolarHBondContact CB-O 3.32Å; A153-R175 WeakPolarHBondContact O-CA 3.25Å; A153-G176 PolarHBondContact N-O 3.31Å; A153-G176 PolarHBondContact O-N 2.88Å
154	I	97.4	Very high	96.9	Very high	65 Å²	65	27.2 Å²	27.2	33%	0.333	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	-49.4	-175	-53.1	-61.3	0	0	0	109.8	K115 R152 R175	K115-I154 HydrophobicContact CB-CB 4.06Å; K115-I154 HydrophobicContact CD-CB 4.45Å; K115-I154 HydrophobicContact CD-CG2 4.44Å; K115-I154 HydrophobicContact CG-CB 4.01Å; K115-I154 HydrophobicContact CG-CG1 4.14Å; K115-I154 WeakPolarHBondContact O-CB 3.44Å; K115-I154 PolarHBondContact O-N 3.17Å; R152-I154 HydrophobicContact CB-CD1 3.75Å; R152-I154 HydrophobicContact CB-CG1 4.47Å; R152-I154 PolarHBondContact O-N 2.94Å; I154-R175 WeakPolarHBondContact O-CD 3.47Å; I154-R175 WeakPolarHBondContact O-CG 3.48Å
155	N	94.7	Very high	97.1	Very high	57 Å²	57	28.9 Å²	28.9	31%	0.305	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	148.5	178	-67.7	-26.3	0	0	0	110.6	D113 H114 K115 W158	D113-N155 WeakPolarHBondContact O-CB 3.44Å; H114-N155 WeakPolarHBondContact CA-O 3.37Å; K115-N155 HydrophobicContact CB-CB 4.36Å; K115-N155 PolarHBondContact N-O 2.95Å; K115-N155 PolarHBondContact O-N 2.91Å; K115-N155 VanDerWaalsContact O-N 3.14Å; N155-W158 PolarHBondContact O-NE1 3.29Å
156	G	92.7	Very high	97.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	75.3	170.5	176.7	0	0	0	0	0	114.1
157	T	95.6	Very high	97.4	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.012	15%	0.15	C	C	.	.			trans	-104.4	133.6	177.9	-51	0	0	0	0	109.3	L107 N108 V172 E174 I197	L107-T157 HydrophobicContact CD1-CG2 4.23Å; L107-T157 HydrophobicContact CD2-CG2 4.27Å; L107-T157 HydrophobicContact CG-CG2 4.33Å; N108-T157 PolarHBondContact O-OG1 3.06Å; T157-V172 HydrophobicContact CG2-CG1 3.93Å; T157-E174 HydrophobicContact CG2-CG 4.07Å; T157-I197 HydrophobicContact CG2-CD1 3.91Å; T157-I197 PolarHBondContact O-N 2.96Å
158	W	97.3	Very high	97.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	157.5	-174.6	-58.4	78.4	0	0	0	111.4	H114 L116 I131 D134 N155 V172 F173 V194 R195 R196	H114-W158 HydrophobicContact CB-CH2 4.04Å; H114-W158 HydrophobicContact CB-CZ2 3.49Å; H114-W158 VanDerWaalsContact CB-CZ2 3.49Å; L116-W158 HydrophobicContact CB-CD2 3.97Å; L116-W158 HydrophobicContact CB-CE3 4.38Å; L116-W158 HydrophobicContact CB-CG 4.49Å; L116-W158 HydrophobicContact CB-CH2 4.06Å; L116-W158 HydrophobicContact CB-CZ2 3.6Å; L116-W158 HydrophobicContact CB-CZ3 4.42Å; L116-W158 HydrophobicContact CD1-CG 4.17Å; L116-W158 HydrophobicContact CD2-CB 4.29Å; L116-W158 HydrophobicContact CD2-CD2 3.84Å; L116-W158 HydrophobicContact CD2-CE3 3.94Å; L116-W158 HydrophobicContact CD2-CG 4.02Å; L116-W158 HydrophobicContact CD2-CZ3 4.48Å; L116-W158 HydrophobicContact CG-CD2 4.34Å; L116-W158 HydrophobicContact CG-CG 4.48Å; I131-W158 HydrophobicContact CB-CH2 4.17Å; I131-W158 HydrophobicContact CB-CZ3 4.5Å; I131-W158 HydrophobicContact CG2-CH2 3.72Å; I131-W158 HydrophobicContact CG2-CZ3 3.9Å; D134-W158 WeakPolarHBondContact O-CZ3 3.46Å; N155-W158 PolarHBondContact O-NE1 3.29Å; W158-V172 CarbonylContact O-C 3.59Å; W158-V172 WeakPolarHBondContact O-CA 3.34Å; W158-F173 HydrophobicContact CB-CB 4.25Å; W158-F173 PolarHBondContact N-O 2.84Å; W158-F173 PolarHBondContact O-N 3.05Å; W158-V194 HydrophobicContact CB-CG2 4.3Å; W158-V194 HydrophobicContact CE3-CG2 3.96Å; W158-R195 WeakPolarHBondContact CA-O 3.35Å; W158-R196 HydrophobicContact CD2-CG 4.13Å; W158-R196 HydrophobicContact CE3-CB 4.48Å; W158-R196 HydrophobicContact CE3-CG 3.65Å; W158-R196 HydrophobicContact CH2-CG 3.63Å; W158-R196 HydrophobicContact CZ2-CG 4.09Å; W158-R196 HydrophobicContact CZ3-CG 3.38Å
159	V	97.9	Very high	97.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	121.6	167.5	55.3	0	0	0	0	109.9	V80 Y161 Q170 Y171 V194 R195 I197	V80-V159 HydrophobicContact CG2-CB 4.12Å; V80-V159 HydrophobicContact CG2-CG2 3.94Å; V159-Y161 HydrophobicContact CB-CE2 4.31Å; V159-Y161 HydrophobicContact CG1-CE2 3.75Å; V159-Y161 WeakPolarHBondContact CG1-OH 3.43Å; V159-Y161 HydrophobicContact CG2-CD2 4.48Å; V159-Y161 HydrophobicContact CG2-CE1 4.27Å; V159-Y161 HydrophobicContact CG2-CE2 3.86Å; V159-Q170 HydrophobicContact CG2-CB 3.83Å; V159-Y171 CarbonylContact C-O 3.52Å; V159-Y171 WeakPolarHBondContact CA-O 3.5Å; V159-V194 WeakPolarHBondContact O-CA 3.5Å; V159-V194 WeakPolarHBondContact O-CG2 3.33Å; V159-R195 HydrophobicContact CG1-CG 3.56Å; V159-R195 PolarHBondContact N-O 3.13Å; V159-R195 PolarHBondContact O-N 3.13Å; V159-I197 HydrophobicContact CB-CD1 4.01Å; V159-I197 HydrophobicContact CB-CG1 4.05Å; V159-I197 HydrophobicContact CG1-CD1 4.23Å; V159-I197 HydrophobicContact CG1-CG1 3.77Å
160	G	98.4	Very high	97.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	153.1	172.1	0	0	0	0	0	111.8	Q170 Y171 S193	G160-Q170 CarbonylContact O-C 3.6Å; G160-Q170 WeakPolarHBondContact O-CA 3.39Å; G160-Y171 PolarHBondContact N-O 2.75Å; G160-Y171 PolarHBondContact O-N 3.41Å; G160-S193 CarbonylContact C-O 3.6Å; G160-S193 WeakPolarHBondContact CA-O 3.26Å
161	Y	98.4	Very high	97.2	Very high	3 Å²	3	32.2 Å²	32.2	1%	0.012	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	146.5	-178.4	-59.8	-96	0	0	0	112.1	V159 F163 Y166 R167 R169 Q170 L191 Q192 S193 R195	V159-Y161 HydrophobicContact CB-CE2 4.31Å; V159-Y161 HydrophobicContact CG1-CE2 3.75Å; V159-Y161 WeakPolarHBondContact CG1-OH 3.43Å; V159-Y161 HydrophobicContact CG2-CD2 4.48Å; V159-Y161 HydrophobicContact CG2-CE1 4.27Å; V159-Y161 HydrophobicContact CG2-CE2 3.86Å; Y161-F163 VanDerWaalsContact C-N 3.26Å; Y161-F163 PolarHBondContact O-N 3.33Å; Y161-Y166 VanDerWaalsContact CD1-O 3.32Å; Y161-Y166 WeakPolarHBondContact CD1-O 3.18Å; Y161-Y166 AromaticContact CD2-CD1 3.87Å; Y161-Y166 HydrophobicContact CD2-CD1 3.87Å; Y161-Y166 HydrophobicContact CD2-CG 4.34Å; Y161-Y166 WeakPolarHBondContact CE1-O 3.43Å; Y161-Y166 AromaticContact CE2-CD1 3.85Å; Y161-Y166 HydrophobicContact CE2-CD1 3.85Å; Y161-Y166 HydrophobicContact CE2-CG 4.11Å; Y161-R167 WeakPolarHBondContact CB-O 3.37Å; Y161-R169 WeakPolarHBondContact CA-O 3.33Å; Y161-Q170 HydrophobicContact CD1-CG 3.97Å; Y161-Q170 HydrophobicContact CE1-CB 4.27Å; Y161-Q170 HydrophobicContact CE1-CG 3.6Å; Y161-L191 WeakPolarHBondContact O-CA 3.36Å; Y161-L191 WeakPolarHBondContact O-CD2 3.33Å; Y161-Q192 PolarHBondContact O-N 3.48Å; Y161-S193 PolarHBondContact N-O 3.04Å; Y161-S193 PolarHBondContact O-N 3.29Å; Y161-R195 HydrophobicContact CE2-CG 4.09Å; Y161-R195 PolarHBondContact OH-NE 3.34Å; Y161-R195 PolarHBondContact OH-NH2 3.2Å
162	E	97.6	Very high	97.1	Very high	26 Å²	26	32.7 Å²	32.7	12%	0.121	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	-34.2	179	-68.1	176.7	138.2	0	0	113	R169 Y171 Q192	E162-R169 VanDerWaalsContact CD-CB 3.5Å; E162-R169 HydrophobicContact CG-CB 3.98Å; E162-R169 PolarHBondContact N-O 3.14Å; E162-R169 WeakPolarHBondContact OE1-CD 3.38Å; E162-R169 WeakPolarHBondContact OE2-CB 3.28Å; E162-R169 VanDerWaalsContact OE2-CG 3.28Å; E162-R169 WeakPolarHBondContact OE2-CG 3.5Å; E162-R169 PolarHBondContact OE2-N 3.37Å; E162-Y171 HydrophobicContact CG-CE2 3.98Å; E162-Q192 WeakPolarHBondContact O-CB 3.42Å; E162-Q192 WeakPolarHBondContact O-CG 3.41Å; E162-Q192 PolarHBondContact O-NE2 3.18Å
163	F	97.9	Very high	97.1	Very high	85 Å²	85	29.1 Å²	29.1	37%	0.373	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	159.8	-174.2	-56.1	-56.5	0	0	0	113.3	Y161 R167 S193	Y161-F163 VanDerWaalsContact C-N 3.26Å; Y161-F163 PolarHBondContact O-N 3.33Å; F163-R167 HydrophobicContact CB-CB 4.07Å; F163-R167 WeakPolarHBondContact CB-O 3.29Å; F163-R167 PolarHBondContact N-O 2.99Å; F163-S193 PolarHBondContact O-OG 3.32Å
164	P	97.6	Very high	97	Very high	36 Å²	36	31.8 Å²	31.8	23%	0.234	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	150.3	172.5	-21	33	0	0	0	112.1	P137 R167 Q192	P137-P164 CarbonylContact O-C 3.6Å; P137-P164 WeakPolarHBondContact O-CA 3.43Å; P164-R167 PolarHBondContact O-NE 3.28Å; P164-R167 PolarHBondContact O-NH2 2.86Å; P164-R167 VanDerWaalsContact O-NH2 3.14Å; P164-Q192 HydrophobicContact CG-CB 3.98Å
165	G	96.8	Very high	96.9	Very high	42 Å²	42	36.6 Å²	36.6	43%	0.433	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	30.4	179.8	0	0	0	0	0	113.6	P137 R167	P137-G165 PolarHBondContact O-N 2.98Å; G165-R167 PolarHBondContact O-N 3.16Å
166	Y	96.8	Very high	97	Very high	37 Å²	37	35.3 Å²	35.3	15%	0.145	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	39.9	174.9	-40.2	-52.8	0	0	0	114.2	N94 D135 P137 Y161 S193 R195 F208	N94-Y166 PolarHBondContact ND2-O 2.78Å; D135-Y166 WeakPolarHBondContact CB-OH 3.35Å; P137-Y166 HydrophobicContact CB-CE1 4.28Å; P137-Y166 HydrophobicContact CB-CE2 4.31Å; Y161-Y166 VanDerWaalsContact CD1-O 3.32Å; Y161-Y166 WeakPolarHBondContact CD1-O 3.18Å; Y161-Y166 AromaticContact CD2-CD1 3.87Å; Y161-Y166 HydrophobicContact CD2-CD1 3.87Å; Y161-Y166 HydrophobicContact CD2-CG 4.34Å; Y161-Y166 WeakPolarHBondContact CE1-O 3.43Å; Y161-Y166 AromaticContact CE2-CD1 3.85Å; Y161-Y166 HydrophobicContact CE2-CD1 3.85Å; Y161-Y166 HydrophobicContact CE2-CG 4.11Å; Y166-S193 WeakPolarHBondContact CA-OG 3.3Å; Y166-S193 PolarHBondContact N-OG 3.31Å; Y166-R195 HydrophobicContact CD1-CB 4.24Å; Y166-R195 HydrophobicContact CD1-CG 4.36Å; Y166-R195 HydrophobicContact CE1-CB 3.76Å; Y166-R195 HydrophobicContact CE1-CG 4.37Å; Y166-F208 HydrophobicContact CD2-CZ 4.43Å; Y166-F208 HydrophobicContact CE2-CZ 4.35Å
167	R	96.2	Very high	97.3	Very high	145 Å²	145	39.6 Å²	39.6	55%	0.547	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	158.8	-176	-66.7	-179.6	-62.9	141.9	2.9	112.3	Y161 F163 P164 G165	Y161-R167 WeakPolarHBondContact CB-O 3.37Å; F163-R167 HydrophobicContact CB-CB 4.07Å; F163-R167 WeakPolarHBondContact CB-O 3.29Å; F163-R167 PolarHBondContact N-O 2.99Å; P164-R167 PolarHBondContact O-NE 3.28Å; P164-R167 PolarHBondContact O-NH2 2.86Å; P164-R167 VanDerWaalsContact O-NH2 3.14Å; G165-R167 PolarHBondContact O-N 3.16Å
168	G	96.6	Very high	97.5	Very high	3 Å²	3	41 Å²	41	3%	0.031	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	86.9	-162	-176.5	0	0	0	0	0	112	N94	N94-G168 CarbonylContact C-O 3.54Å; N94-G168 WeakPolarHBondContact CB-O 3.44Å; N94-G168 PolarHBondContact O-N 3.49Å
169	R	97.3	Very high	97.5	Very high	82 Å²	82	47.8 Å²	47.8	31%	0.309	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	149.5	178	-63.4	178.7	178.1	179.1	-4.7	111.1	E77 N97 Y161 E162 Y171	E77-R169 HydrophobicContact CG-CG 4.4Å; N97-R169 PolarHBondContact ND2-NE 2.98Å; Y161-R169 WeakPolarHBondContact CA-O 3.33Å; E162-R169 VanDerWaalsContact CD-CB 3.5Å; E162-R169 HydrophobicContact CG-CB 3.98Å; E162-R169 PolarHBondContact N-O 3.14Å; E162-R169 WeakPolarHBondContact OE1-CD 3.38Å; E162-R169 WeakPolarHBondContact OE2-CB 3.28Å; E162-R169 VanDerWaalsContact OE2-CG 3.28Å; E162-R169 WeakPolarHBondContact OE2-CG 3.5Å; E162-R169 PolarHBondContact OE2-N 3.37Å; R169-Y171 HydrophobicContact CB-CE2 4.1Å
170	Q	97.7	Very high	97.6	Very high	6 Å²	6	50.4 Å²	50.4	3%	0.028	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	143.8	-178.9	-43.1	-173.6	34	0	0	110.1	W92 V159 G160 Y161	W92-Q170 PolarHBondContact O-NE2 3.39Å; V159-Q170 HydrophobicContact CG2-CB 3.83Å; G160-Q170 CarbonylContact O-C 3.6Å; G160-Q170 WeakPolarHBondContact O-CA 3.39Å; Y161-Q170 HydrophobicContact CD1-CG 3.97Å; Y161-Q170 HydrophobicContact CE1-CB 4.27Å; Y161-Q170 HydrophobicContact CE1-CG 3.6Å
171	Y	98.3	Very high	97.6	Very high	10 Å²	10	52.5 Å²	52.5	4%	0.039	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	116.2	176.2	-57.3	-75.8	0	0	0	109.9	V159 G160 E162 R169 F173 W184 A186 L191	V159-Y171 CarbonylContact C-O 3.52Å; V159-Y171 WeakPolarHBondContact CA-O 3.5Å; G160-Y171 PolarHBondContact N-O 2.75Å; G160-Y171 PolarHBondContact O-N 3.41Å; E162-Y171 HydrophobicContact CG-CE2 3.98Å; R169-Y171 HydrophobicContact CB-CE2 4.1Å; Y171-F173 WeakPolarHBondContact O-CE2 3.16Å; Y171-W184 AromaticContact CD1-CD1 3.68Å; Y171-W184 WeakPolarHBondContact CD1-O 3.45Å; Y171-W184 AromaticContact CG-CD1 3.72Å; Y171-A186 HydrophobicContact CD1-CB 4.08Å; Y171-A186 HydrophobicContact CE1-CB 3.55Å; Y171-A186 HydrophobicContact CE2-CB 4.35Å; Y171-L191 HydrophobicContact CD2-CD2 3.72Å; Y171-L191 HydrophobicContact CE2-CD2 4.29Å
172	V	97.9	Very high	97.5	Very high	9 Å²	9	57 Å²	57	6%	0.055	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	132.5	179.9	177.5	0	0	0	0	110.6	L67 V80 L107 T157 W158 E174 I197	L67-V172 HydrophobicContact CD1-CG2 3.6Å; L67-V172 HydrophobicContact CD2-CB 4.24Å; L67-V172 HydrophobicContact CD2-CG2 4.05Å; L67-V172 HydrophobicContact CG-CG2 4.47Å; V80-V172 HydrophobicContact CG2-CG2 3.67Å; L107-V172 HydrophobicContact CD1-CG1 4.08Å; L107-V172 HydrophobicContact CD2-CG1 4.26Å; T157-V172 HydrophobicContact CG2-CG1 3.93Å; W158-V172 CarbonylContact O-C 3.59Å; W158-V172 WeakPolarHBondContact O-CA 3.34Å; V172-E174 HydrophobicContact CG1-CG 4.2Å; V172-I197 HydrophobicContact CG1-CD1 4.35Å; V172-I197 HydrophobicContact CG2-CD1 4.29Å
173	F	97.7	Very high	97.6	Very high	1 Å²	1	60 Å²	60	0%	0.004	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	101.8	170.7	-55	-81.7	0	0	0	108.7	V151 A153 W158 Y171 Y178 W184 L191	V151-F173 HydrophobicContact CB-CD1 4.11Å; V151-F173 HydrophobicContact CB-CE1 3.97Å; V151-F173 HydrophobicContact CG1-CD1 3.81Å; V151-F173 HydrophobicContact CG1-CE1 4.08Å; V151-F173 HydrophobicContact CG1-CG 4.18Å; V151-F173 HydrophobicContact CG2-CD1 4.32Å; V151-F173 HydrophobicContact CG2-CE1 3.74Å; V151-F173 HydrophobicContact CG2-CZ 4.02Å; A153-F173 HydrophobicContact CB-CB 4.17Å; W158-F173 HydrophobicContact CB-CB 4.25Å; W158-F173 PolarHBondContact N-O 2.84Å; W158-F173 PolarHBondContact O-N 3.05Å; Y171-F173 WeakPolarHBondContact O-CE2 3.16Å; F173-Y178 HydrophobicContact CB-CE2 4.17Å; F173-Y178 AromaticContact CD1-CD2 3.89Å; F173-Y178 HydrophobicContact CD1-CD2 3.89Å; F173-Y178 HydrophobicContact CD1-CE1 4.47Å; F173-Y178 AromaticContact CD1-CE2 3.84Å; F173-Y178 HydrophobicContact CD1-CE2 3.84Å; F173-Y178 HydrophobicContact CD1-CG 4.25Å; F173-W184 HydrophobicContact CD1-CB 4.21Å; F173-W184 HydrophobicContact CE1-CB 3.6Å; F173-W184 AromaticContact CE1-CD2 3.51Å; F173-W184 HydrophobicContact CE1-CD2 3.51Å; F173-W184 AromaticContact CE1-CE3 3.72Å; F173-W184 HydrophobicContact CE1-CE3 3.72Å; F173-W184 AromaticContact CE1-CG 3.51Å; F173-W184 HydrophobicContact CE1-CG 3.51Å; F173-W184 HydrophobicContact CE1-CZ3 4.43Å; F173-W184 HydrophobicContact CZ-CB 4.21Å; F173-W184 AromaticContact CZ-CD2 3.91Å; F173-W184 HydrophobicContact CZ-CD2 3.91Å; F173-W184 HydrophobicContact CZ-CE3 4.46Å; F173-W184 AromaticContact CZ-CG 3.82Å; F173-W184 HydrophobicContact CZ-CG 3.82Å; F173-L191 HydrophobicContact CE2-CD1 4.14Å; F173-L191 HydrophobicContact CZ-CD1 3.86Å
174	E	95.9	Very high	97.5	Very high	59 Å²	59	56.1 Å²	56.1	28%	0.276	26%	0.262	S	S	.	.			trans	-78.7	166	165.3	-70.1	174.7	104.4	0	0	108.9	R105 L107 A153 T157 V172 G176 Y178	R105-E174 IonicContact CZ-OE2 3.73Å; R105-E174 IonicContact NH1-OE1 2.67Å; R105-E174 IonicContact NH1-OE2 2.64Å; R105-E174 IonicContact NH2-OE1 3.64Å; R105-E174 IonicContact NH2-OE2 3.94Å; R105-E174 PolarHBondContact NH2-OE2 3.38Å; L107-E174 HydrophobicContact CD1-CG 4.15Å; A153-E174 VanDerWaalsContact CB-O 3.24Å; A153-E174 WeakPolarHBondContact CB-O 3.32Å; T157-E174 HydrophobicContact CG2-CG 4.07Å; V172-E174 HydrophobicContact CG1-CG 4.2Å; E174-G176 PolarHBondContact O-N 3.01Å; E174-G176 VanDerWaalsContact O-N 3.11Å; E174-Y178 PolarHBondContact N-OH 2.91Å; E174-Y178 VanDerWaalsContact N-OH 3.14Å; E174-Y178 PolarHBondContact O-OH 2.9Å
175	R	95.9	Very high	97.4	Very high	165 Å²	165	59.4 Å²	59.4	62%	0.623	28%	0.277	S	S	*	.	S	Bend	trans	-54.7	121.3	-178.3	-172.3	177.9	70.7	177.3	-1.7	111.1	A153 I154	A153-R175 WeakPolarHBondContact O-CA 3.25Å; I154-R175 WeakPolarHBondContact O-CD 3.47Å; I154-R175 WeakPolarHBondContact O-CG 3.48Å
176	G	96.9	Very high	97.4	Very high	31 Å²	31	57.6 Å²	57.6	32%	0.32	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	163.6	-179.2	-175.2	0	0	0	0	0	114.6	A153 E174	A153-G176 PolarHBondContact N-O 3.31Å; A153-G176 PolarHBondContact O-N 2.88Å; E174-G176 PolarHBondContact O-N 3.01Å; E174-G176 VanDerWaalsContact O-N 3.11Å
177	E	98.6	Very high	97.4	Very high	89 Å²	89	59.7 Å²	59.7	42%	0.416	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	129.4	175.8	-71.8	-154.3	143.3	0	0	109.4	F124 R152 R179	F124-E177 HydrophobicContact CZ-CB 3.81Å; F124-E177 HydrophobicContact CZ-CG 4.2Å; R152-E177 HydrophobicContact CG-CG 4.2Å; R152-E177 IonicContact CZ-OE1 2.72Å; R152-E177 IonicContact NE-OE1 3.53Å; R152-E177 PolarHBondContact NE-OE1 3.29Å; R152-E177 IonicContact NH2-OE1 3.29Å; R152-E177 PolarHBondContact NH2-OE1 3.31Å; E177-R179 IonicContact OE2-NE 3.98Å; E177-R179 IonicContact OE2-NH2 3.51Å
178	Y	98.7	Very high	97.4	Very high	33 Å²	33	58.8 Å²	58.8	13%	0.129	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	102.4	177.3	-57.8	-98.6	0	0	0	109.3	F124 S150 V151 F173 E174 E183 W184	F124-Y178 WeakPolarHBondContact CE1-O 3.38Å; S150-Y178 CarbonylContact C-O 3.58Å; S150-Y178 VanDerWaalsContact CA-O 3.25Å; S150-Y178 WeakPolarHBondContact CA-O 3.33Å; S150-Y178 WeakPolarHBondContact CB-O 3.42Å; V151-Y178 HydrophobicContact CB-CD2 4.36Å; V151-Y178 HydrophobicContact CG1-CD2 4.48Å; V151-Y178 PolarHBondContact N-O 3.45Å; V151-Y178 PolarHBondContact O-N 2.79Å; F173-Y178 HydrophobicContact CB-CE2 4.17Å; F173-Y178 AromaticContact CD1-CD2 3.89Å; F173-Y178 HydrophobicContact CD1-CD2 3.89Å; F173-Y178 HydrophobicContact CD1-CE1 4.47Å; F173-Y178 AromaticContact CD1-CE2 3.84Å; F173-Y178 HydrophobicContact CD1-CE2 3.84Å; F173-Y178 HydrophobicContact CD1-CG 4.25Å; E174-Y178 PolarHBondContact N-OH 2.91Å; E174-Y178 VanDerWaalsContact N-OH 3.14Å; E174-Y178 PolarHBondContact O-OH 2.9Å; Y178-E183 VanDerWaalsContact CA-OE2 3.29Å; Y178-E183 WeakPolarHBondContact CA-OE2 3.43Å; Y178-E183 HydrophobicContact CD1-CB 3.93Å; Y178-W184 HydrophobicContact CD1-CB 4.13Å; Y178-W184 HydrophobicContact CD1-CE3 4.27Å; Y178-W184 HydrophobicContact CE1-CB 4.31Å; Y178-W184 HydrophobicContact CG-CE3 4.15Å
179	R	98.7	Very high	97.5	Very high	141 Å²	141	59.5 Å²	59.5	53%	0.532	29%	0.285	S	S	.	.	S	Bend	trans	-80.9	-17.8	-170.3	-66.8	174.8	178.5	164.3	3	113.6	P122 A123 F124 S150 E177 E183	P122-R179 CarbonylContact C-O 3.59Å; P122-R179 WeakPolarHBondContact CA-O 3.35Å; P122-R179 WeakPolarHBondContact CB-O 3.43Å; A123-R179 PolarHBondContact N-O 2.85Å; F124-R179 HydrophobicContact CE1-CG 4.28Å; F124-R179 HydrophobicContact CE2-CG 3.61Å; F124-R179 HydrophobicContact CZ-CB 4.3Å; F124-R179 HydrophobicContact CZ-CG 3.36Å; S150-R179 WeakPolarHBondContact CB-O 3.36Å; E177-R179 IonicContact OE2-NE 3.98Å; E177-R179 IonicContact OE2-NH2 3.51Å; R179-E183 WeakPolarHBondContact CB-OE1 3.17Å; R179-E183 VanDerWaalsContact N-CD 3.27Å; R179-E183 PolarHBondContact N-OE1 2.93Å; R179-E183 PolarHBondContact N-OE2 3.39Å
180	H	98.8	Very high	97.6	Very high	55 Å²	55	58 Å²	58	26%	0.255	28%	0.281	S	S	.	.	S	Bend	trans	-147.1	152.5	180	-169.7	-89.5	0	0	0	110.4	A149 N182 E183 W184	A149-H180 CarbonylContact O-C 3.54Å; A149-H180 WeakPolarHBondContact O-CA 3.36Å; H180-N182 VanDerWaalsContact ND1-CG 3.32Å; H180-N182 PolarHBondContact ND1-N 3.2Å; H180-N182 PolarHBondContact O-N 3.15Å; H180-N182 VanDerWaalsContact O-N 3.12Å; H180-E183 PolarHBondContact N-OE1 3.06Å; H180-E183 WeakPolarHBondContact O-CB 3.49Å; H180-E183 PolarHBondContact O-N 3.2Å; H180-W184 WeakPolarHBondContact O-CZ3 3.33Å
181	W	98.6	Very high	97.6	Very high	44 Å²	44	57.9 Å²	57.9	17%	0.167	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-61.6	-24.6	-175.9	59.6	82.6	0	0	0	115.5	P122 A149 E183 W184 A186 P189	P122-W181 HydrophobicContact CG-CZ3 3.9Å; A149-W181 HydrophobicContact CB-CE3 3.62Å; A149-W181 HydrophobicContact CB-CZ3 3.76Å; A149-W181 PolarHBondContact O-N 2.54Å; W181-E183 PolarHBondContact O-N 2.68Å; W181-W184 VanDerWaalsContact CA-CE2 3.44Å; W181-W184 HydrophobicContact CB-CD2 4.38Å; W181-W184 HydrophobicContact CB-CH2 3.68Å; W181-W184 HydrophobicContact CB-CZ2 3.26Å; W181-W184 HydrophobicContact CB-CZ3 4.35Å; W181-W184 PolarHBondContact O-N 2.88Å; W181-A186 HydrophobicContact CB-CB 4.38Å; W181-A186 PolarHBondContact O-N 2.85Å; W181-P189 HydrophobicContact CB-CB 4.27Å; W181-P189 HydrophobicContact CD2-CB 3.77Å; W181-P189 HydrophobicContact CD2-CG 4.09Å; W181-P189 HydrophobicContact CE3-CB 3.58Å; W181-P189 HydrophobicContact CE3-CG 3.97Å; W181-P189 HydrophobicContact CG-CB 4.1Å; W181-P189 HydrophobicContact CH2-CG 4.37Å; W181-P189 HydrophobicContact CZ3-CB 4.14Å; W181-P189 HydrophobicContact CZ3-CG 4.09Å
182	N	97.8	Very high	97.6	Very high	97 Å²	97	58.5 Å²	58.5	52%	0.519	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-62	-26.8	172.2	-63.2	-3.4	0	0	0	112.8	H180 W184 N185 A186	H180-N182 VanDerWaalsContact ND1-CG 3.32Å; H180-N182 PolarHBondContact ND1-N 3.2Å; H180-N182 PolarHBondContact O-N 3.15Å; H180-N182 VanDerWaalsContact O-N 3.12Å; N182-W184 VanDerWaalsContact C-N 3.25Å; N182-W184 PolarHBondContact O-N 3.32Å; N182-N185 PolarHBondContact O-N 3.23Å; N182-A186 PolarHBondContact OD1-O 3.41Å
183	E	98.2	Very high	97.6	Very high	90 Å²	90	58.1 Å²	58.1	42%	0.421	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-71.7	-19.3	-177.8	-66.1	174.5	-138.8	0	0	112.8	Y178 R179 H180 W181	Y178-E183 VanDerWaalsContact CA-OE2 3.29Å; Y178-E183 WeakPolarHBondContact CA-OE2 3.43Å; Y178-E183 HydrophobicContact CD1-CB 3.93Å; R179-E183 WeakPolarHBondContact CB-OE1 3.17Å; R179-E183 VanDerWaalsContact N-CD 3.27Å; R179-E183 PolarHBondContact N-OE1 2.93Å; R179-E183 PolarHBondContact N-OE2 3.39Å; H180-E183 PolarHBondContact N-OE1 3.06Å; H180-E183 WeakPolarHBondContact O-CB 3.49Å; H180-E183 PolarHBondContact O-N 3.2Å; W181-E183 PolarHBondContact O-N 2.68Å
184	W	97.3	Very high	97.7	Very high	3 Å²	3	58.2 Å²	58.2	1%	0.011	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-104.7	17.8	168.8	62.6	85.2	0	0	0	113	Q78 V148 V151 Y171 F173 Y178 H180 W181 N182 A186	Q78-W184 PolarHBondContact NE2-O 2.79Å; V148-W184 HydrophobicContact CG1-CH2 4.44Å; V148-W184 WeakPolarHBondContact O-CZ2 3.35Å; V151-W184 HydrophobicContact CB-CZ3 4.37Å; V151-W184 HydrophobicContact CG2-CH2 4Å; V151-W184 HydrophobicContact CG2-CZ3 3.98Å; Y171-W184 AromaticContact CD1-CD1 3.68Å; Y171-W184 WeakPolarHBondContact CD1-O 3.45Å; Y171-W184 AromaticContact CG-CD1 3.72Å; F173-W184 HydrophobicContact CD1-CB 4.21Å; F173-W184 HydrophobicContact CE1-CB 3.6Å; F173-W184 AromaticContact CE1-CD2 3.51Å; F173-W184 HydrophobicContact CE1-CD2 3.51Å; F173-W184 AromaticContact CE1-CE3 3.72Å; F173-W184 HydrophobicContact CE1-CE3 3.72Å; F173-W184 AromaticContact CE1-CG 3.51Å; F173-W184 HydrophobicContact CE1-CG 3.51Å; F173-W184 HydrophobicContact CE1-CZ3 4.43Å; F173-W184 HydrophobicContact CZ-CB 4.21Å; F173-W184 AromaticContact CZ-CD2 3.91Å; F173-W184 HydrophobicContact CZ-CD2 3.91Å; F173-W184 HydrophobicContact CZ-CE3 4.46Å; F173-W184 AromaticContact CZ-CG 3.82Å; F173-W184 HydrophobicContact CZ-CG 3.82Å; Y178-W184 HydrophobicContact CD1-CB 4.13Å; Y178-W184 HydrophobicContact CD1-CE3 4.27Å; Y178-W184 HydrophobicContact CE1-CB 4.31Å; Y178-W184 HydrophobicContact CG-CE3 4.15Å; H180-W184 WeakPolarHBondContact O-CZ3 3.33Å; W181-W184 VanDerWaalsContact CA-CE2 3.44Å; W181-W184 HydrophobicContact CB-CD2 4.38Å; W181-W184 HydrophobicContact CB-CH2 3.68Å; W181-W184 HydrophobicContact CB-CZ2 3.26Å; W181-W184 HydrophobicContact CB-CZ3 4.35Å; W181-W184 PolarHBondContact O-N 2.88Å; N182-W184 VanDerWaalsContact C-N 3.25Å; N182-W184 PolarHBondContact O-N 3.32Å; W184-A186 VanDerWaalsContact C-N 3.31Å; W184-A186 PolarHBondContact O-N 2.98Å
185	N	95.5	Very high	97.8	Very high	105 Å²	105	56.6 Å²	56.6	56%	0.561	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	24.4	179	-55.2	-65.1	0	0	0	115.3	N182	N182-N185 PolarHBondContact O-N 3.23Å
186	A	96.9	Very high	97.7	Very high	5 Å²	5	49.8 Å²	49.8	4%	0.041	25%	0.248	C	C	.	.			trans	-83.8	146.2	168.6	0	0	0	0	0	111.4	Y171 W181 N182 W184 Q188	Y171-A186 HydrophobicContact CD1-CB 4.08Å; Y171-A186 HydrophobicContact CE1-CB 3.55Å; Y171-A186 HydrophobicContact CE2-CB 4.35Å; W181-A186 HydrophobicContact CB-CB 4.38Å; W181-A186 PolarHBondContact O-N 2.85Å; N182-A186 PolarHBondContact OD1-O 3.41Å; W184-A186 VanDerWaalsContact C-N 3.31Å; W184-A186 PolarHBondContact O-N 2.98Å; A186-Q188 WeakPolarHBondContact CB-O 3.35Å
187	S	95.1	Very high	97.5	Very high	81 Å²	81	48.3 Å²	48.3	57%	0.566	23%	0.233	S	C	*	.	S	Bend	trans	-85.3	-23.9	172.4	54.2	0	0	0	0	112.7
188	Q	97.6	Very high	96.7	Very high	125 Å²	125	46.8 Å²	46.8	58%	0.584	22%	0.223	S	C	*	.	S	Bend	trans	-137	152.5	179.4	-66.4	-176.4	-8.5	0	0	109.5	A186 Q190	A186-Q188 WeakPolarHBondContact CB-O 3.35Å; Q188-Q190 PolarHBondContact O-N 3.12Å
189	P	98.3	Very high	95.3	Very high	19 Å²	19	47 Å²	47	12%	0.123	23%	0.227	C	C	.	.			trans	-77.6	34.9	-179.8	31.5	-33.7	0	0	0	113	R147 V148 A149 W181	R147-P189 CarbonylContact C-O 3.39Å; R147-P189 WeakPolarHBondContact CA-O 3.12Å; R147-P189 HydrophobicContact CG-CB 4.32Å; R147-P189 HydrophobicContact CG-CG 4.26Å; R147-P189 VanDerWaalsContact NH1-CG 3.29Å; V148-P189 PolarHBondContact N-O 3.49Å; V148-P189 CarbonylContact O-C 3.56Å; V148-P189 WeakPolarHBondContact O-CA 3.5Å; V148-P189 WeakPolarHBondContact O-CB 3.29Å; A149-P189 HydrophobicContact CB-CB 4.1Å; W181-P189 HydrophobicContact CB-CB 4.27Å; W181-P189 HydrophobicContact CD2-CB 3.77Å; W181-P189 HydrophobicContact CD2-CG 4.09Å; W181-P189 HydrophobicContact CE3-CB 3.58Å; W181-P189 HydrophobicContact CE3-CG 3.97Å; W181-P189 HydrophobicContact CG-CB 4.1Å; W181-P189 HydrophobicContact CH2-CG 4.37Å; W181-P189 HydrophobicContact CZ3-CB 4.14Å; W181-P189 HydrophobicContact CZ3-CG 4.09Å
190	Q	98.4	Very high	93.2	Very high	50 Å²	50	45.1 Å²	45.1	23%	0.234	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-89.1	116.1	-176.8	-170.3	176	36.7	0	0	110.9	D146 Q188	D146-Q190 CarbonylContact O-C 3.6Å; D146-Q190 VanDerWaalsContact O-CA 3.27Å; D146-Q190 WeakPolarHBondContact O-CA 3.4Å; Q188-Q190 PolarHBondContact O-N 3.12Å
191	L	98.4	Very high	91	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.021	24%	0.236	C	C	.	.			trans	-145.2	135.5	171.3	-75.9	177.9	0	0	0	109.4	L139 D146 V148 Y161 Y171 F173	L139-L191 VanDerWaalsContact CD1-O 3.32Å; L139-L191 WeakPolarHBondContact CD1-O 3.43Å; D146-L191 CarbonylContact C-O 3.57Å; D146-L191 WeakPolarHBondContact CA-O 3.47Å; D146-L191 PolarHBondContact O-N 3.21Å; V148-L191 HydrophobicContact CB-CB 4.03Å; V148-L191 HydrophobicContact CB-CD1 3.98Å; V148-L191 HydrophobicContact CB-CG 4.4Å; V148-L191 HydrophobicContact CG1-CD1 4.04Å; V148-L191 HydrophobicContact CG2-CB 3.81Å; V148-L191 HydrophobicContact CG2-CD1 4.36Å; Y161-L191 WeakPolarHBondContact O-CA 3.36Å; Y161-L191 WeakPolarHBondContact O-CD2 3.33Å; Y171-L191 HydrophobicContact CD2-CD2 3.72Å; Y171-L191 HydrophobicContact CE2-CD2 4.29Å; F173-L191 HydrophobicContact CE2-CD1 4.14Å; F173-L191 HydrophobicContact CZ-CD1 3.86Å
192	Q	98.6	Very high	88.6	Confident	22 Å²	22	53.5 Å²	53.5	10%	0.103	26%	0.257	C	S	.	.			trans	-134.3	-9.5	-176.7	-70.1	-175.4	74.5	0	0	114.4	S138 L139 D146 Y161 E162 P164	S138-Q192 CarbonylContact C-O 3.56Å; S138-Q192 WeakPolarHBondContact CA-O 3.33Å; L139-Q192 PolarHBondContact N-O 2.92Å; D146-Q192 HydrophobicContact CB-CG 3.39Å; Y161-Q192 PolarHBondContact O-N 3.48Å; E162-Q192 WeakPolarHBondContact O-CB 3.42Å; E162-Q192 WeakPolarHBondContact O-CG 3.41Å; E162-Q192 PolarHBondContact O-NE2 3.18Å; P164-Q192 HydrophobicContact CG-CB 3.98Å
193	S	98.7	Very high	86.2	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.007	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	156.8	167.3	61.7	0	0	0	0	111	V136 P137 G160 Y161 F163 Y166	V136-S193 VanDerWaalsContact O-CA 3.29Å; V136-S193 WeakPolarHBondContact O-CA 3.32Å; V136-S193 VanDerWaalsContact O-CB 3.28Å; V136-S193 WeakPolarHBondContact O-CB 3.39Å; P137-S193 VanDerWaalsContact O-CB 3.3Å; P137-S193 WeakPolarHBondContact O-CB 3.33Å; G160-S193 CarbonylContact C-O 3.6Å; G160-S193 WeakPolarHBondContact CA-O 3.26Å; Y161-S193 PolarHBondContact N-O 3.04Å; Y161-S193 PolarHBondContact O-N 3.29Å; F163-S193 PolarHBondContact O-OG 3.32Å; Y166-S193 WeakPolarHBondContact CA-OG 3.3Å; Y166-S193 PolarHBondContact N-OG 3.31Å
194	V	98.5	Very high	83.5	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.024	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	141	179.2	62.1	0	0	0	0	109.2	L116 L118 I131 V136 L139 W158 V159	L116-V194 HydrophobicContact CD2-CG1 4.43Å; L116-V194 HydrophobicContact CD2-CG2 3.64Å; L118-V194 HydrophobicContact CD1-CG1 4.4Å; I131-V194 HydrophobicContact CD1-CG1 3.39Å; V136-V194 CarbonylContact C-O 3.59Å; V136-V194 HydrophobicContact CB-CG1 4.1Å; V136-V194 PolarHBondContact N-O 2.94Å; V136-V194 PolarHBondContact O-N 2.89Å; L139-V194 HydrophobicContact CD2-CG1 4.16Å; W158-V194 HydrophobicContact CB-CG2 4.3Å; W158-V194 HydrophobicContact CE3-CG2 3.96Å; V159-V194 WeakPolarHBondContact O-CA 3.5Å; V159-V194 WeakPolarHBondContact O-CG2 3.33Å
195	R	97.4	Very high	80.6	Confident	24 Å²	24	66.6 Å²	66.6	9%	0.091	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	161.2	174.4	69.5	-176	-175.8	87.1	-11.3	110.5	E82 D135 W158 V159 Y161 Y166	E82-R195 IonicContact OE1-CZ 3.06Å; E82-R195 IonicContact OE1-NH1 3.21Å; E82-R195 PolarHBondContact OE1-NH1 2.77Å; E82-R195 IonicContact OE1-NH2 3.93Å; E82-R195 PolarHBondContact OE1-NH2 3.02Å; E82-R195 IonicContact OE2-NH2 2.97Å; D135-R195 HydrophobicContact CB-CB 3.87Å; W158-R195 WeakPolarHBondContact CA-O 3.35Å; V159-R195 HydrophobicContact CG1-CG 3.56Å; V159-R195 PolarHBondContact N-O 3.13Å; V159-R195 PolarHBondContact O-N 3.13Å; Y161-R195 HydrophobicContact CE2-CG 4.09Å; Y161-R195 PolarHBondContact OH-NE 3.34Å; Y161-R195 PolarHBondContact OH-NH2 3.2Å; Y166-R195 HydrophobicContact CD1-CB 4.24Å; Y166-R195 HydrophobicContact CD1-CG 4.36Å; Y166-R195 HydrophobicContact CE1-CB 3.76Å; Y166-R195 HydrophobicContact CE1-CG 4.37Å
196	R	95.4	Very high	78	Confident	23 Å²	23	64.9 Å²	64.9	9%	0.087	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	143.5	170.8	-62	170.4	-74.4	178.6	-14.6	109.7	H114 D133 D134 D135 W158 R198	H114-R196 HydrophobicContact CB-CG 3.79Å; H114-R196 VanDerWaalsContact CD2-CG 3.49Å; H114-R196 WeakPolarHBondContact CD2-CG 3.36Å; D133-R196 PolarHBondContact O-NH1 2.93Å; D133-R196 PolarHBondContact O-NH2 3.4Å; D133-R196 IonicContact OD1-NH1 2.98Å; D134-R196 VanDerWaalsContact N-CZ 3.33Å; D134-R196 PolarHBondContact O-NE 2.89Å; D135-R196 IonicContact OD1-CZ 4Å; D135-R196 PolarHBondContact OD1-N 3.31Å; D135-R196 IonicContact OD1-NE 3.93Å; D135-R196 PolarHBondContact OD1-NE 3.47Å; D135-R196 IonicContact OD1-NH2 3.93Å; W158-R196 HydrophobicContact CD2-CG 4.13Å; W158-R196 HydrophobicContact CE3-CB 4.48Å; W158-R196 HydrophobicContact CE3-CG 3.65Å; W158-R196 HydrophobicContact CH2-CG 3.63Å; W158-R196 HydrophobicContact CZ2-CG 4.09Å; W158-R196 HydrophobicContact CZ3-CG 3.38Å; R196-R198 HydrophobicContact CB-CG 4.08Å
197	I	93	Very high	75.4	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.328	C	S	.	.			trans	-92.8	122.6	166.7	-53.7	-179.4	0	0	0	107.1	P65 V80 L107 I109 T157 V159 V172	P65-I197 HydrophobicContact CB-CG2 4.37Å; P65-I197 HydrophobicContact CG-CG2 3.89Å; V80-I197 HydrophobicContact CG1-CD1 4.04Å; V80-I197 HydrophobicContact CG1-CG1 4.49Å; V80-I197 HydrophobicContact CG1-CG2 4.24Å; V80-I197 HydrophobicContact CG2-CD1 3.86Å; L107-I197 HydrophobicContact CD2-CD1 3.51Å; L107-I197 HydrophobicContact CD2-CG2 4.4Å; I109-I197 HydrophobicContact CD1-CG2 4.1Å; I109-I197 HydrophobicContact CG1-CG2 4.5Å; T157-I197 HydrophobicContact CG2-CD1 3.91Å; T157-I197 PolarHBondContact O-N 2.96Å; V159-I197 HydrophobicContact CB-CD1 4.01Å; V159-I197 HydrophobicContact CB-CG1 4.05Å; V159-I197 HydrophobicContact CG1-CD1 4.23Å; V159-I197 HydrophobicContact CG1-CG1 3.77Å; V172-I197 HydrophobicContact CG1-CD1 4.35Å; V172-I197 HydrophobicContact CG2-CD1 4.29Å
198	R	81.5	Confident	72.8	Confident	57 Å²	57	71.3 Å²	71.3	22%	0.215	33%	0.334	C	S	.	.			trans	-126.4	140.4	-170.7	-64.7	-178.4	-162.4	164.5	31.5	110.3	D135 R196 H203	D135-R198 IonicContact OD1-CZ 2.78Å; D135-R198 IonicContact OD1-NH2 3.37Å; D135-R198 PolarHBondContact OD1-NH2 3.05Å; D135-R198 IonicContact OD2-CZ 3.52Å; D135-R198 IonicContact OD2-NH2 3.17Å; D135-R198 PolarHBondContact OD2-NH2 2.81Å; R196-R198 HydrophobicContact CB-CG 4.08Å; R198-H203 HydrophobicContact CB-CB 4.18Å; R198-H203 VanDerWaalsContact CB-CD2 3.47Å; R198-H203 WeakPolarHBondContact CB-CD2 3.17Å; R198-H203 VanDerWaalsContact CD-CD2 3.42Å; R198-H203 WeakPolarHBondContact CD-CD2 3.5Å; R198-H203 VanDerWaalsContact CD-CG 3.45Å; R198-H203 HydrophobicContact CG-CB 4.5Å; R198-H203 WeakPolarHBondContact CG-CD2 3.22Å
199	D	67.9	Low	69.6	Low	38 Å²	38	73 Å²	73	20%	0.203	35%	0.346	C	S	.	.			trans	-92.1	149.4	166.7	-173.5	9.7	0	0	0	109.6	I109 K201 W202 H203	I109-D199 HydrophobicContact CD1-CB 3.86Å; D199-K201 PolarHBondContact O-N 2.92Å; D199-K201 VanDerWaalsContact O-N 3.12Å; D199-K201 VanDerWaalsContact OD2-CD 3.26Å; D199-K201 WeakPolarHBondContact OD2-CD 3.45Å; D199-K201 VanDerWaalsContact OD2-CG 3.27Å; D199-K201 WeakPolarHBondContact OD2-CG 3.27Å; D199-W202 PolarHBondContact O-N 3.46Å; D199-W202 VanDerWaalsContact O-N 3.15Å; D199-H203 PolarHBondContact O-N 3.44Å; D199-H203 VanDerWaalsContact O-N 3.09Å
200	Q	55.2	Low	66.6	Low	100 Å²	100	77.7 Å²	77.7	47%	0.467	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-22.4	173	-65.3	-155.1	-36.1	0	0	112.8
201	K	52.3	Low	63.5	Low	118 Å²	118	84.4 Å²	84.4	51%	0.513	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-39	175.8	-69.9	-177.9	-169.1	168.1	0	113.2	G21 G22 D199	G21-K201 PolarHBondContact O-NZ 3.12Å; G22-K201 VanDerWaalsContact CA-NZ 3.27Å; D199-K201 PolarHBondContact O-N 2.92Å; D199-K201 VanDerWaalsContact O-N 3.12Å; D199-K201 VanDerWaalsContact OD2-CD 3.26Å; D199-K201 WeakPolarHBondContact OD2-CD 3.45Å; D199-K201 VanDerWaalsContact OD2-CG 3.27Å; D199-K201 WeakPolarHBondContact OD2-CG 3.27Å
202	W	47.6	Very low	61.7	Low	157 Å²	157	88.5 Å²	88.5	60%	0.595	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-28.3	-175.6	-57.6	111.8	0	0	0	112	D199	D199-W202 PolarHBondContact O-N 3.46Å; D199-W202 VanDerWaalsContact O-N 3.15Å
203	H	48.8	Very low	59.8	Low	38 Å²	38	91.9 Å²	91.9	18%	0.176	47%	0.47	C	S	.	.			trans	-128.8	92.5	-175.3	-57.3	-79.8	0	0	0	111.6	H114 R198 D199 R205	H114-H203 AromaticContact CE1-NE2 3.96Å; R198-H203 HydrophobicContact CB-CB 4.18Å; R198-H203 VanDerWaalsContact CB-CD2 3.47Å; R198-H203 WeakPolarHBondContact CB-CD2 3.17Å; R198-H203 VanDerWaalsContact CD-CD2 3.42Å; R198-H203 WeakPolarHBondContact CD-CD2 3.5Å; R198-H203 VanDerWaalsContact CD-CG 3.45Å; R198-H203 HydrophobicContact CG-CB 4.5Å; R198-H203 WeakPolarHBondContact CG-CD2 3.22Å; D199-H203 PolarHBondContact O-N 3.44Å; D199-H203 VanDerWaalsContact O-N 3.09Å; H203-R205 PolarHBondContact O-N 3.44Å
204	K	41.4	Very low	57.6	Low	199 Å²	199	97 Å²	97	87%	0.865	50%	0.496	S	S	*	.	S	Bend	trans	-72.6	-6.3	178.1	-65.6	-175.2	179.6	-180	0	114.6
205	R	36.9	Very low	55.2	Low	229 Å²	229	102.5 Å²	102.5	86%	0.864	52%	0.524	S	S	*	.	S	Bend	trans	-132.8	134.3	179.8	-76.1	-177.2	175.7	-178.4	-1.3	109.8	H203	H203-R205 PolarHBondContact O-N 3.44Å
206	G	39.6	Very low	52.6	Low	69 Å²	69	107.4 Å²	107.4	71%	0.711	55%	0.551	S	S	*	*			trans	110.6	3.3	173	0	0	0	0	0	116.2	F208	G206-F208 PolarHBondContact O-N 3.16Å
207	C	42.4	Very low	49.7	Very low	64 Å²	64	113 Å²	113	43%	0.432	58%	0.582	S	S	.	*			trans	-63.2	131.5	165.4	-61.2	0	0	0	0	108.5	L209	C207-L209 PolarHBondContact O-N 2.85Å
208	F	40.7	Very low	46.7	Very low	157 Å²	157	121.1 Å²	121.1	69%	0.689	62%	0.624	S	S	*	*			trans	-58.2	105.1	167.3	-69.8	-84.7	0	0	0	107.1	Y166 G206 S210	Y166-F208 HydrophobicContact CD2-CZ 4.43Å; Y166-F208 HydrophobicContact CE2-CZ 4.35Å; G206-F208 PolarHBondContact O-N 3.16Å; F208-S210 PolarHBondContact O-N 2.8Å; F208-S210 VanDerWaalsContact O-N 3.16Å
209	L	31	Very low	44	Very low	160 Å²	160	126 Å²	126	84%	0.838	66%	0.655	S	S	*	*			trans	-64.5	113.5	164.9	-69.1	166.3	0	0	0	104.8	C207 S211	C207-L209 PolarHBondContact O-N 2.85Å; L209-S211 PolarHBondContact O-N 2.91Å
210	S	34.1	Very low	42	Very low	117 Å²	117	133.3 Å²	133.3	82%	0.818	69%	0.693	S	S	*	*			trans	-60	109.7	161.6	53.6	0	0	0	0	106.4	F208	F208-S210 PolarHBondContact O-N 2.8Å; F208-S210 VanDerWaalsContact O-N 3.16Å
211	S	33.7	Very low	40.8	Very low	192 Å²	192	136.4 Å²	136.4	100%	1.343	71%	0.713	S	S	*	*			trans	-59.6	0	167.7	-55.8	0	0	0	0	111	L209	L209-S211 PolarHBondContact O-N 2.91Å

Retrieved 211 of 211 residues in 62.3 ms (Link to these results)

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