A0A023ILR2_RAT Loading...

RT1-Db2

AlphaFold DB , UniProt , Accession A0A023ILR2, Species RAT (Rattus norvegicus, Rat), Gene Db2, Length 180 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	33.9	Very low	46.9	Very low	240 Å²	240	150.2 Å²	150.2	100%	1.182	77%	0.772	S	S	*	*				0	88.1	0	-161.4	169.9	175.3	0	0	106.9
2	V	29.1	Very low	48.1	Very low	141 Å²	141	143.5 Å²	143.5	86%	0.855	74%	0.743	S	S	*	*			trans	-106.8	114.9	178.9	176.8	0	0	0	0	106.3	L4	V2-L4 PolarHBondContact O-N 3.12Å
3	C	34.5	Very low	49.3	Very low	99 Å²	99	135.3 Å²	135.3	67%	0.669	71%	0.709	S	S	*	*			trans	-76.7	111.4	179.2	-72.8	0	0	0	0	109.6	W5	C3-W5 PolarHBondContact O-N 3.17Å
4	L	38.1	Very low	50.7	Low	167 Å²	167	129.2 Å²	129.2	87%	0.874	69%	0.688	S	S	*	*			trans	-73.8	100.5	165.4	-82.4	155.8	0	0	0	108.5	V2 L6	V2-L4 PolarHBondContact O-N 3.12Å; L4-L6 PolarHBondContact O-N 3.06Å
5	W	44.2	Very low	51.8	Low	238 Å²	238	126.2 Å²	126.2	90%	0.902	68%	0.676	S	S	*	*			trans	-77.5	109	167.7	-91.5	56.8	0	0	0	109.1	C3	C3-W5 PolarHBondContact O-N 3.17Å
6	L	50.9	Low	52.7	Low	150 Å²	150	123 Å²	123	79%	0.785	66%	0.662	S	S	*	*			trans	-81.4	127.2	169.5	-76.4	162.5	0	0	0	109.4	L4	L4-L6 PolarHBondContact O-N 3.06Å
7	P	49.8	Very low	53.3	Low	70 Å²	70	121.9 Å²	121.9	46%	0.455	66%	0.656	S	S	.	*			trans	-67.4	137.2	177.5	26.9	-32.2	0	0	0	110.6	D9 V12	P7-D9 PolarHBondContact O-N 3.2Å; P7-V12 HydrophobicContact CB-CG1 4.36Å; P7-V12 HydrophobicContact CG-CB 4.35Å; P7-V12 HydrophobicContact CG-CG1 3.76Å
8	R	57	Low	54	Low	256 Å²	256	118.4 Å²	118.4	97%	0.966	64%	0.642	S	S	*	*	S	Bend	trans	-72.8	1	-174.4	-83	-179	171	175.8	-2.9	115.2
9	D	54.4	Low	54.3	Low	100 Å²	100	118.2 Å²	118.2	54%	0.535	64%	0.639	S	S	.	*			trans	-96.8	115.3	-174.7	-132.6	-41.9	0	0	0	110.6	P7 C11 V12 A13	P7-D9 PolarHBondContact O-N 3.2Å; D9-C11 PolarHBondContact O-N 3.48Å; D9-C11 VanDerWaalsContact O-N 3.12Å; D9-V12 HydrophobicContact CB-CB 4.4Å; D9-V12 HydrophobicContact CB-CG2 4.05Å; D9-V12 PolarHBondContact O-N 3Å; D9-A13 PolarHBondContact O-N 3.03Å
10	P	62.1	Low	54.8	Low	98 Å²	98	118.3 Å²	118.3	64%	0.636	64%	0.639	S	S	*	*	H	α-helix	trans	-60.5	-27.9	-171.2	20.7	-31.3	0	0	0	113.2	A14	P10-A14 WeakPolarHBondContact O-CB 3.39Å; P10-A14 PolarHBondContact O-N 3.44Å
11	C	61.5	Low	55.1	Low	93 Å²	93	120.4 Å²	120.4	63%	0.628	65%	0.647	S	S	*	*	H	α-helix	trans	-69.2	-37.7	175.1	-71	0	0	0	0	112.8	D9 A14 V15	D9-C11 PolarHBondContact O-N 3.48Å; D9-C11 VanDerWaalsContact O-N 3.12Å; C11-A14 PolarHBondContact O-N 2.94Å; C11-V15 VanDerWaalsContact O-CG2 3.3Å; C11-V15 WeakPolarHBondContact O-CG2 3.3Å; C11-V15 PolarHBondContact O-N 3.44Å
12	V	62.1	Low	56.3	Low	70 Å²	70	115.3 Å²	115.3	42%	0.424	62%	0.624	S	S	.	*	H	α-helix	trans	-73.3	-39.9	-180	-179.6	0	0	0	0	110.3	P7 D9 A14 V15 V16	P7-V12 HydrophobicContact CB-CG1 4.36Å; P7-V12 HydrophobicContact CG-CB 4.35Å; P7-V12 HydrophobicContact CG-CG1 3.76Å; D9-V12 HydrophobicContact CB-CB 4.4Å; D9-V12 HydrophobicContact CB-CG2 4.05Å; D9-V12 PolarHBondContact O-N 3Å; V12-A14 VanDerWaalsContact C-N 3.34Å; V12-A14 PolarHBondContact O-N 2.83Å; V12-V15 PolarHBondContact O-N 3.49Å; V12-V16 HydrophobicContact CG1-CG2 4.44Å; V12-V16 VanDerWaalsContact O-CG2 3.31Å; V12-V16 WeakPolarHBondContact O-CG2 3.48Å; V12-V16 PolarHBondContact O-N 3.32Å
13	A	63.1	Low	57.7	Low	37 Å²	37	111.4 Å²	111.4	31%	0.306	60%	0.603	S	S	.	*	H	α-helix	trans	-59.6	-44	172.2	0	0	0	0	0	111.9	D9 V16 L17	D9-A13 PolarHBondContact O-N 3.03Å; A13-V16 PolarHBondContact O-N 2.95Å; A13-L17 WeakPolarHBondContact O-CB 3.35Å; A13-L17 WeakPolarHBondContact O-CD1 3.31Å; A13-L17 WeakPolarHBondContact O-CG 3.49Å; A13-L17 PolarHBondContact O-N 2.61Å
14	A	68.4	Low	58.8	Low	50 Å²	50	111.7 Å²	111.7	41%	0.413	60%	0.603	S	S	.	*	H	α-helix	trans	-63.1	-41.7	176.7	0	0	0	0	0	112.3	P10 C11 V12 L17 S18	P10-A14 WeakPolarHBondContact O-CB 3.39Å; P10-A14 PolarHBondContact O-N 3.44Å; C11-A14 PolarHBondContact O-N 2.94Å; V12-A14 VanDerWaalsContact C-N 3.34Å; V12-A14 PolarHBondContact O-N 2.83Å; A14-L17 PolarHBondContact O-N 2.96Å; A14-S18 VanDerWaalsContact O-CB 3.28Å; A14-S18 WeakPolarHBondContact O-CB 3.47Å; A14-S18 PolarHBondContact O-N 3.4Å; A14-S18 PolarHBondContact O-OG 3.37Å
15	V	67.8	Low	59.8	Low	84 Å²	84	108.7 Å²	108.7	51%	0.509	59%	0.594	S	S	.	*	H	α-helix	trans	-67.3	-41.8	177.9	171.9	0	0	0	0	111.7	C11 V12 S18 L19	C11-V15 VanDerWaalsContact O-CG2 3.3Å; C11-V15 WeakPolarHBondContact O-CG2 3.3Å; C11-V15 PolarHBondContact O-N 3.44Å; V12-V15 PolarHBondContact O-N 3.49Å; V15-S18 PolarHBondContact O-N 2.98Å; V15-L19 HydrophobicContact CG1-CD1 3.86Å; V15-L19 HydrophobicContact CG1-CG 4.42Å; V15-L19 WeakPolarHBondContact O-CB 3.28Å; V15-L19 VanDerWaalsContact O-CG 3.31Å; V15-L19 WeakPolarHBondContact O-CG 3.3Å; V15-L19 PolarHBondContact O-N 3.4Å
16	V	66.6	Low	60.3	Low	75 Å²	75	104.4 Å²	104.4	46%	0.455	59%	0.594	S	S	.	*	H	α-helix	trans	-65.5	-42.1	176.9	173.9	0	0	0	0	111.1	V12 A13 L19 L20	V12-V16 HydrophobicContact CG1-CG2 4.44Å; V12-V16 VanDerWaalsContact O-CG2 3.31Å; V12-V16 WeakPolarHBondContact O-CG2 3.48Å; V12-V16 PolarHBondContact O-N 3.32Å; A13-V16 PolarHBondContact O-N 2.95Å; V16-L19 PolarHBondContact O-N 2.84Å; V16-L20 HydrophobicContact CG1-CD1 4.06Å; V16-L20 WeakPolarHBondContact O-CB 3.49Å; V16-L20 VanDerWaalsContact O-CG 3.3Å; V16-L20 WeakPolarHBondContact O-CG 3.31Å; V16-L20 PolarHBondContact O-N 3.29Å
17	L	62.3	Low	60.4	Low	105 Å²	105	100.5 Å²	100.5	55%	0.55	58%	0.583	S	S	.	*	H	α-helix	trans	-63.6	-41.5	173.3	-83	158.7	0	0	0	111.7	A13 A14 L20 M21	A13-L17 WeakPolarHBondContact O-CB 3.35Å; A13-L17 WeakPolarHBondContact O-CD1 3.31Å; A13-L17 WeakPolarHBondContact O-CG 3.49Å; A13-L17 PolarHBondContact O-N 2.61Å; A14-L17 PolarHBondContact O-N 2.96Å; L17-L20 PolarHBondContact O-N 3.33Å; L17-M21 WeakPolarHBondContact O-CB 3.39Å; L17-M21 VanDerWaalsContact O-CG 3.22Å; L17-M21 WeakPolarHBondContact O-CG 3.22Å; L17-M21 PolarHBondContact O-N 2.8Å
18	S	66	Low	60.6	Low	59 Å²	59	105.3 Å²	105.3	41%	0.413	60%	0.604	S	S	.	*	H	α-helix	trans	-63.5	-42.9	176.8	-56.2	0	0	0	0	111.3	A14 V15 M21 L22	A14-S18 VanDerWaalsContact O-CB 3.28Å; A14-S18 WeakPolarHBondContact O-CB 3.47Å; A14-S18 PolarHBondContact O-N 3.4Å; A14-S18 PolarHBondContact O-OG 3.37Å; V15-S18 PolarHBondContact O-N 2.98Å; S18-M21 PolarHBondContact O-N 3.26Å; S18-L22 WeakPolarHBondContact O-CB 3.46Å; S18-L22 WeakPolarHBondContact O-CD1 3.44Å; S18-L22 WeakPolarHBondContact O-CG 3.21Å; S18-L22 PolarHBondContact O-N 3.2Å
19	L	60.4	Low	60.6	Low	113 Å²	113	97.5 Å²	97.5	59%	0.592	58%	0.584	S	S	*	*	H	α-helix	trans	-65.8	-36.4	176.9	-76.7	165.6	0	0	0	112.4	V15 V16 S23	V15-L19 HydrophobicContact CG1-CD1 3.86Å; V15-L19 HydrophobicContact CG1-CG 4.42Å; V15-L19 WeakPolarHBondContact O-CB 3.28Å; V15-L19 VanDerWaalsContact O-CG 3.31Å; V15-L19 WeakPolarHBondContact O-CG 3.3Å; V15-L19 PolarHBondContact O-N 3.4Å; V16-L19 PolarHBondContact O-N 2.84Å; L19-S23 WeakPolarHBondContact O-CB 3.38Å; L19-S23 PolarHBondContact O-N 3.22Å; L19-S23 PolarHBondContact O-OG 2.89Å
20	L	63.1	Low	61.1	Low	120 Å²	120	103.8 Å²	103.8	63%	0.628	60%	0.601	S	S	*	*	H	α-helix	trans	-70.6	-30.5	174	-72.5	166.9	0	0	0	112.8	V16 L17 S23	V16-L20 HydrophobicContact CG1-CD1 4.06Å; V16-L20 WeakPolarHBondContact O-CB 3.49Å; V16-L20 VanDerWaalsContact O-CG 3.3Å; V16-L20 WeakPolarHBondContact O-CG 3.31Å; V16-L20 PolarHBondContact O-N 3.29Å; L17-L20 PolarHBondContact O-N 3.33Å; L20-S23 WeakPolarHBondContact CA-OG 3.18Å; L20-S23 PolarHBondContact O-OG 3.02Å
21	M	62.6	Low	61.4	Low	163 Å²	163	101.8 Å²	101.8	80%	0.803	59%	0.585	S	S	*	*	H	α-helix	trans	-81.2	-29.6	174.7	-68.1	-65.6	-152.8	0	0	113	L17 S18	L17-M21 WeakPolarHBondContact O-CB 3.39Å; L17-M21 VanDerWaalsContact O-CG 3.22Å; L17-M21 WeakPolarHBondContact O-CG 3.22Å; L17-M21 PolarHBondContact O-N 2.8Å; S18-M21 PolarHBondContact O-N 3.26Å
22	L	58.6	Low	61.7	Low	134 Å²	134	102.5 Å²	102.5	70%	0.702	59%	0.588	S	S	*	*	H	α-helix	trans	-92.4	-15.5	179.6	-77.5	160.3	0	0	0	113.3	S18 P24	S18-L22 WeakPolarHBondContact O-CB 3.46Å; S18-L22 WeakPolarHBondContact O-CD1 3.44Å; S18-L22 WeakPolarHBondContact O-CG 3.21Å; S18-L22 PolarHBondContact O-N 3.2Å; L22-P24 WeakPolarHBondContact O-CD 3.36Å; L22-P24 VanDerWaalsContact O-N 3.1Å
23	S	58.7	Low	62.7	Low	59 Å²	59	107.4 Å²	107.4	41%	0.413	60%	0.599	S	S	.	*	S	Bend	trans	-62.4	112.8	164.3	42.3	0	0	0	0	106.7	L19 L20	L19-S23 WeakPolarHBondContact O-CB 3.38Å; L19-S23 PolarHBondContact O-N 3.22Å; L19-S23 PolarHBondContact O-OG 2.89Å; L20-S23 WeakPolarHBondContact CA-OG 3.18Å; L20-S23 PolarHBondContact O-OG 3.02Å
24	P	57.3	Low	63.8	Low	104 Å²	104	110.4 Å²	110.4	68%	0.675	62%	0.615	S	S	*	*			trans	-53.6	136	172.4	24.8	-33.1	0	0	0	106	L22 V26	L22-P24 WeakPolarHBondContact O-CD 3.36Å; L22-P24 VanDerWaalsContact O-N 3.1Å; P24-V26 PolarHBondContact O-N 2.84Å; P24-V26 VanDerWaalsContact O-N 3.16Å
25	P	59.2	Low	64.8	Low	105 Å²	105	116.6 Å²	116.6	68%	0.682	63%	0.628	S	S	*	*			trans	-50.5	137	173.8	22.4	-30.9	0	0	0	105.8	A27	P25-A27 HydrophobicContact CB-CB 4.02Å; P25-A27 HydrophobicContact CG-CB 4.28Å; P25-A27 PolarHBondContact O-N 2.77Å
26	V	55.2	Low	66	Low	148 Å²	148	119.3 Å²	119.3	90%	0.897	63%	0.633	S	S	*	*	S	Bend	trans	-65.2	30	171.2	-172.8	0	0	0	0	110.2	P24 L28	P24-V26 PolarHBondContact O-N 2.84Å; P24-V26 VanDerWaalsContact O-N 3.16Å; V26-L28 PolarHBondContact O-N 3.16Å
27	A	52.7	Low	67.4	Low	67 Å²	67	119.9 Å²	119.9	55%	0.554	63%	0.633	S	S	*	*			trans	-87	43	166.9	0	0	0	0	0	110.8	P25 V29	P25-A27 HydrophobicContact CB-CB 4.02Å; P25-A27 HydrophobicContact CG-CB 4.28Å; P25-A27 PolarHBondContact O-N 2.77Å; A27-V29 HydrophobicContact CB-CG2 4.13Å; A27-V29 PolarHBondContact O-N 2.63Å; A27-V29 VanDerWaalsContact O-N 3.17Å
28	L	54.2	Low	69	Low	171 Å²	171	121.9 Å²	121.9	90%	0.895	64%	0.64	S	S	*	*			trans	-80.4	57.2	139	-119.5	156.2	0	0	0	106.6	V26 R30	V26-L28 PolarHBondContact O-N 3.16Å; L28-R30 PolarHBondContact O-N 2.95Å
29	V	56.7	Low	70.5	Confident	93 Å²	93	122.6 Å²	122.6	56%	0.564	64%	0.637	S	S	*	*			trans	-67.7	102.2	175.8	167.3	0	0	0	0	104.8	A27 D31 P32	A27-V29 HydrophobicContact CB-CG2 4.13Å; A27-V29 PolarHBondContact O-N 2.63Å; A27-V29 VanDerWaalsContact O-N 3.17Å; V29-D31 PolarHBondContact O-N 2.82Å; V29-P32 HydrophobicContact CG1-CB 4.11Å; V29-P32 HydrophobicContact CG1-CG 4.09Å
30	R	64.6	Low	72.2	Confident	232 Å²	232	121.8 Å²	121.8	88%	0.875	63%	0.633	S	S	*	*			trans	-37.9	128	152.4	-77.1	176.8	171.7	173.1	-3	107.1	L28 P32	L28-R30 PolarHBondContact O-N 2.95Å; R30-P32 WeakPolarHBondContact O-CD 3.38Å
31	D	68.1	Low	73.9	Confident	56 Å²	56	120.9 Å²	120.9	30%	0.299	62%	0.624	S	S	.	*			trans	-32.7	108.3	174.9	-178.8	-0.5	0	0	0	110.1	V29 R33 R35	V29-D31 PolarHBondContact O-N 2.82Å; D31-R33 PolarHBondContact O-N 3.29Å; D31-R33 VanDerWaalsContact O-N 3.13Å; D31-R33 WeakPolarHBondContact OD1-CB 3.49Å; D31-R33 WeakPolarHBondContact OD1-CG 3.39Å; D31-R33 IonicContact OD1-CZ 3.5Å; D31-R33 PolarHBondContact OD1-N 2.65Å; D31-R33 IonicContact OD1-NE 2.75Å; D31-R33 PolarHBondContact OD1-NE 3.35Å; D31-R33 IonicContact OD1-NH2 3.37Å; D31-R33 IonicContact OD2-CZ 3.04Å; D31-R33 IonicContact OD2-NE 2.73Å; D31-R33 PolarHBondContact OD2-NE 3.36Å; D31-R33 IonicContact OD2-NH2 3.65Å; D31-R33 PolarHBondContact OD2-NH2 2.81Å; D31-R35 IonicContact OD2-CZ 3.59Å; D31-R35 IonicContact OD2-NE 3.78Å; D31-R35 IonicContact OD2-NH2 2.86Å; D31-R35 PolarHBondContact OD2-NH2 2.99Å
32	P	67.3	Low	75.5	Confident	108 Å²	108	116.8 Å²	116.8	70%	0.701	62%	0.616	S	S	*	*			trans	-77.3	-1.3	-165.8	30.9	-34.4	0	0	0	112	V29 R30	V29-P32 HydrophobicContact CG1-CB 4.11Å; V29-P32 HydrophobicContact CG1-CG 4.09Å; R30-P32 WeakPolarHBondContact O-CD 3.38Å
33	R	83.3	Confident	77.4	Confident	172 Å²	172	112.5 Å²	112.5	65%	0.649	59%	0.592	S	S	*	*	S	Bend	trans	-65.6	127.9	177.1	-68.6	179.7	-69.2	-177.4	1.8	109	D31 R35	D31-R33 PolarHBondContact O-N 3.29Å; D31-R33 VanDerWaalsContact O-N 3.13Å; D31-R33 WeakPolarHBondContact OD1-CB 3.49Å; D31-R33 WeakPolarHBondContact OD1-CG 3.39Å; D31-R33 IonicContact OD1-CZ 3.5Å; D31-R33 PolarHBondContact OD1-N 2.65Å; D31-R33 IonicContact OD1-NE 2.75Å; D31-R33 PolarHBondContact OD1-NE 3.35Å; D31-R33 IonicContact OD1-NH2 3.37Å; D31-R33 IonicContact OD2-CZ 3.04Å; D31-R33 IonicContact OD2-NE 2.73Å; D31-R33 PolarHBondContact OD2-NE 3.36Å; D31-R33 IonicContact OD2-NH2 3.65Å; D31-R33 PolarHBondContact OD2-NH2 2.81Å; R33-R35 PolarHBondContact O-N 3.17Å
34	P	86.6	Confident	79.1	Confident	101 Å²	101	112.1 Å²	112.1	66%	0.656	59%	0.589	S	S	*	*			trans	-59.8	127	174.3	26.2	-33	0	0	0	108.6	F36	P34-F36 HydrophobicContact CB-CE2 3.82Å; P34-F36 HydrophobicContact CB-CZ 3.78Å; P34-F36 HydrophobicContact CG-CE2 4.29Å
35	R	89.6	Confident	80.9	Confident	179 Å²	179	110 Å²	110	68%	0.675	57%	0.57	S	S	*	*			trans	-111.5	131.7	174.2	-65.3	-175	-176	-176.4	0.1	107.8	D31 R33	D31-R35 IonicContact OD2-CZ 3.59Å; D31-R35 IonicContact OD2-NE 3.78Å; D31-R35 IonicContact OD2-NH2 2.86Å; D31-R35 PolarHBondContact OD2-NH2 2.99Å; R33-R35 PolarHBondContact O-N 3.17Å
36	F	93.2	Very high	82.4	Confident	141 Å²	141	108.1 Å²	108.1	62%	0.618	55%	0.549	S	S	*	.			trans	-120.1	129.4	176.4	-54.1	-73	0	0	0	107.1	P34 Y61 N62	P34-F36 HydrophobicContact CB-CE2 3.82Å; P34-F36 HydrophobicContact CB-CZ 3.78Å; P34-F36 HydrophobicContact CG-CE2 4.29Å; F36-Y61 HydrophobicContact CD1-CE1 4.42Å; F36-Y61 AromaticContact CD1-CZ 3.92Å; F36-Y61 WeakPolarHBondContact CD1-OH 3.45Å; F36-N62 WeakPolarHBondContact CA-OD1 3.48Å
37	L	95.6	Very high	83.9	Confident	87 Å²	87	105.6 Å²	105.6	46%	0.455	53%	0.534	S	S	.	.			trans	-127.1	121.3	177.9	177.9	66	0	0	0	108.2	Q39 N62	L37-Q39 HydrophobicContact CD1-CG 4.1Å; L37-Q39 HydrophobicContact CD2-CG 3.84Å; L37-Q39 HydrophobicContact CG-CG 3.65Å; L37-N62 PolarHBondContact N-OD1 3.31Å; L37-N62 PolarHBondContact O-N 2.85Å
38	E	95.7	Very high	85.4	Confident	148 Å²	148	109.7 Å²	109.7	69%	0.692	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	129.7	168.5	-172.8	174	-160.4	0	0	108.2
39	Q	97.9	Very high	86.8	Confident	73 Å²	73	102.6 Å²	102.6	34%	0.341	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	141.8	178.3	-44.8	-175.4	-85	0	0	110.1	L37 I60	L37-Q39 HydrophobicContact CD1-CG 4.1Å; L37-Q39 HydrophobicContact CD2-CG 3.84Å; L37-Q39 HydrophobicContact CG-CG 3.65Å; Q39-I60 HydrophobicContact CB-CB 4.25Å; Q39-I60 PolarHBondContact N-O 3.31Å; Q39-I60 PolarHBondContact O-N 2.78Å
40	L	97.1	Very high	88.3	Confident	97 Å²	97	104.8 Å²	104.8	51%	0.508	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.6	168.9	-174.9	151.1	0	0	0	108.1	A42 T57 R58 F59	L40-A42 HydrophobicContact CD2-CB 4.2Å; L40-T57 HydrophobicContact CD1-CG2 4.06Å; L40-T57 HydrophobicContact CD2-CG2 3.72Å; L40-T57 HydrophobicContact CG-CG2 3.77Å; L40-R58 WeakPolarHBondContact CA-O 3.48Å; L40-F59 HydrophobicContact CD1-CD1 4.11Å; L40-F59 HydrophobicContact CD1-CE1 3.62Å; L40-F59 HydrophobicContact CD1-CZ 4.27Å; L40-F59 HydrophobicContact CG-CE1 4.48Å
41	K	98	Very high	89.3	Confident	101 Å²	101	100.1 Å²	100.1	44%	0.439	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	111.8	173.6	-65	-173.7	179	-178	0	109.1	T57 R58 I60	K41-T57 CarbonylContact O-C 3.47Å; K41-T57 VanDerWaalsContact O-CA 3.26Å; K41-T57 WeakPolarHBondContact O-CA 3.38Å; K41-R58 HydrophobicContact CB-CB 4.35Å; K41-R58 PolarHBondContact N-O 2.94Å; K41-R58 PolarHBondContact O-N 3.29Å; K41-I60 HydrophobicContact CD-CD1 3.9Å; K41-I60 HydrophobicContact CG-CD1 4.16Å
42	A	96.6	Very high	90.4	Very high	77 Å²	77	102.4 Å²	102.4	64%	0.636	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	107.1	172	0	0	0	0	0	108.6	L40	L40-A42 HydrophobicContact CD2-CB 4.2Å
43	E	97.1	Very high	91.6	Very high	43 Å²	43	98 Å²	98	20%	0.201	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	131.4	-174.8	-62.3	169.5	-160.8	0	0	109.9	H45 S55 V56 R58	E43-H45 WeakPolarHBondContact CB-NE2 3.34Å; E43-H45 IonicContact OE2-CE1 3.08Å; E43-H45 IonicContact OE2-NE2 2.78Å; E43-H45 PolarHBondContact OE2-NE2 2.97Å; E43-S55 VanDerWaalsContact O-CA 3.24Å; E43-S55 WeakPolarHBondContact O-CA 3.49Å; E43-V56 PolarHBondContact N-O 2.99Å; E43-V56 PolarHBondContact O-N 3.04Å; E43-R58 WeakPolarHBondContact OE1-CD 3.39Å; E43-R58 IonicContact OE1-CZ 2.96Å; E43-R58 IonicContact OE1-NE 2.8Å; E43-R58 PolarHBondContact OE1-NE 3.4Å; E43-R58 IonicContact OE1-NH2 3.99Å; E43-R58 IonicContact OE2-CZ 3.78Å; E43-R58 IonicContact OE2-NE 3.28Å; E43-R58 PolarHBondContact OE2-NE 3.2Å; E43-R58 IonicContact OE2-NH2 3.78Å; E43-R58 PolarHBondContact OE2-NH2 2.73Å; E43-R58 VanDerWaalsContact OE2-NH2 3.07Å
44	C	95.4	Very high	92.1	Very high	52 Å²	52	93.8 Å²	93.8	35%	0.351	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	119.7	168	-63	0	0	0	0	108.1	Y46 C107	C44-Y46 HydrophobicContact CB-CE1 4.47Å; C44-Y46 HydrophobicContact CB-CE2 3.7Å; C44-Y46 WeakPolarHBondContact CB-OH 3.2Å; C44-C107 HydrophobicContact CB-CB 3.61Å; C44-C107 WeakPolarHBondContact CB-SG 3.24Å; C44-C107 WeakPolarHBondContact SG-CB 3.43Å; C44-C107 CovalentContact SG-SG 2.02Å; C44-C107 PolarHBondContact SG-SG 3.47Å
45	H	94.5	Very high	92.6	Very high	59 Å²	59	89.1 Å²	89.1	27%	0.273	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	119.7	-179.5	-65.2	-96.4	0	0	0	110.2	E43 V53 W54	E43-H45 WeakPolarHBondContact CB-NE2 3.34Å; E43-H45 IonicContact OE2-CE1 3.08Å; E43-H45 IonicContact OE2-NE2 2.78Å; E43-H45 PolarHBondContact OE2-NE2 2.97Å; H45-V53 WeakPolarHBondContact O-CA 3.28Å; H45-W54 HydrophobicContact CB-CD2 3.47Å; H45-W54 VanDerWaalsContact CB-CD2 3.47Å; H45-W54 HydrophobicContact CB-CE3 3.71Å; H45-W54 HydrophobicContact CB-CG 4.19Å; H45-W54 HydrophobicContact CB-CH2 3.44Å; H45-W54 VanDerWaalsContact CB-CH2 3.44Å; H45-W54 HydrophobicContact CB-CZ2 3.17Å; H45-W54 HydrophobicContact CB-CZ3 3.68Å; H45-W54 AromaticContact CD2-CD1 3.95Å; H45-W54 AromaticContact CD2-CE2 3.83Å; H45-W54 AromaticContact CD2-NE1 3.38Å; H45-W54 PolarHBondContact CD2-NE1 3.13Å; H45-W54 AromaticContact CG-CE2 3.4Å; H45-W54 VanDerWaalsContact CG-CE2 3.4Å; H45-W54 AromaticContact CG-CZ2 3.42Å; H45-W54 VanDerWaalsContact CG-CZ2 3.42Å; H45-W54 AromaticContact CG-NE1 3.47Å; H45-W54 PolarHBondContact N-O 2.93Å; H45-W54 AromaticContact ND1-CZ2 3.65Å; H45-W54 PolarHBondContact O-N 2.85Å
46	Y	92.1	Very high	93	Very high	65 Å²	65	81 Å²	81	26%	0.255	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	99	-177.9	-52	-82	0	0	0	109.7	C44 V53 C107 Y111	C44-Y46 HydrophobicContact CB-CE1 4.47Å; C44-Y46 HydrophobicContact CB-CE2 3.7Å; C44-Y46 WeakPolarHBondContact CB-OH 3.2Å; Y46-V53 HydrophobicContact CD1-CB 4.46Å; Y46-V53 HydrophobicContact CD1-CG1 4.13Å; Y46-V53 HydrophobicContact CD1-CG2 3.57Å; Y46-V53 HydrophobicContact CE1-CG1 3.99Å; Y46-V53 HydrophobicContact CE1-CG2 3.89Å; Y46-C107 HydrophobicContact CE1-CB 4.26Å; Y46-C107 PolarHBondContact OH-O 3.25Å; Y46-Y111 AromaticContact CD1-CD2 3.33Å; Y46-Y111 HydrophobicContact CD1-CD2 3.33Å; Y46-Y111 AromaticContact CD1-CE2 3.96Å; Y46-Y111 HydrophobicContact CD1-CE2 3.96Å; Y46-Y111 HydrophobicContact CD1-CG 4.32Å; Y46-Y111 HydrophobicContact CD2-CD2 4.42Å; Y46-Y111 AromaticContact CE1-CD2 3.63Å; Y46-Y111 HydrophobicContact CE1-CD2 3.63Å; Y46-Y111 HydrophobicContact CE1-CG 4.31Å; Y46-Y111 AromaticContact CG-CD2 3.78Å; Y46-Y111 HydrophobicContact CG-CD2 3.78Å; Y46-Y111 HydrophobicContact CG-CE2 4.03Å
47	V	85.1	Confident	93.2	Very high	95 Å²	95	74.7 Å²	74.7	58%	0.576	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	-33.6	-177	154.9	0	0	0	0	113.5	H52 W54	V47-H52 PolarHBondContact N-O 3.08Å; V47-W54 HydrophobicContact CB-CH2 4.24Å; V47-W54 HydrophobicContact CB-CZ3 3.71Å; V47-W54 HydrophobicContact CG2-CH2 3.19Å; V47-W54 HydrophobicContact CG2-CZ3 3.17Å
48	K	85	Confident	93.3	Very high	153 Å²	153	73.8 Å²	73.8	67%	0.665	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141	62.6	178.7	-71.9	176.2	-172.7	-179.4	0	109.3	H52	K48-H52 HydrophobicContact CB-CB 4.2Å
49	G	83.6	Confident	93.4	Very high	22 Å²	22	67.9 Å²	67.9	23%	0.227	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	-149.6	-177.2	0	0	0	0	0	113.5	E51 Y111	G49-E51 PolarHBondContact O-N 2.86Å; G49-Y111 WeakPolarHBondContact CA-OH 3.2Å
50	R	88.3	Confident	93.5	Very high	139 Å²	139	65.1 Å²	65.1	53%	0.525	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-18.6	-171.6	77.1	-177.1	-161.1	169.8	6	116.1	V53 R108 Y111	R50-V53 VanDerWaalsContact O-CG2 3.31Å; R50-V53 WeakPolarHBondContact O-CG2 3.48Å; R50-R108 WeakPolarHBondContact O-CG 3.39Å; R50-Y111 HydrophobicContact CB-CD1 3.56Å; R50-Y111 HydrophobicContact CB-CD2 4.35Å; R50-Y111 HydrophobicContact CB-CE1 4.18Å; R50-Y111 HydrophobicContact CB-CG 3.66Å
51	E	86.2	Confident	93.4	Very high	134 Å²	134	64.7 Å²	64.7	63%	0.626	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-40.7	-173.4	-65.3	-174.6	166.9	0	0	111.5	G49 V53 R108	G49-E51 PolarHBondContact O-N 2.86Å; E51-V53 PolarHBondContact O-N 3.47Å; E51-R108 PolarHBondContact O-NH2 2.87Å
52	H	89.4	Confident	93.3	Very high	105 Å²	105	62.8 Å²	62.8	49%	0.486	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	83.1	-175.6	-61.9	85.4	0	0	0	110	V47 K48	V47-H52 PolarHBondContact N-O 3.08Å; K48-H52 HydrophobicContact CB-CB 4.2Å
53	V	92.8	Very high	93.2	Very high	15 Å²	15	68.4 Å²	68.4	9%	0.091	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	131.5	-178.6	-173.1	0	0	0	0	109.2	H45 Y46 R50 E51 V104 C107 R108	H45-V53 WeakPolarHBondContact O-CA 3.28Å; Y46-V53 HydrophobicContact CD1-CB 4.46Å; Y46-V53 HydrophobicContact CD1-CG1 4.13Å; Y46-V53 HydrophobicContact CD1-CG2 3.57Å; Y46-V53 HydrophobicContact CE1-CG1 3.99Å; Y46-V53 HydrophobicContact CE1-CG2 3.89Å; R50-V53 VanDerWaalsContact O-CG2 3.31Å; R50-V53 WeakPolarHBondContact O-CG2 3.48Å; E51-V53 PolarHBondContact O-N 3.47Å; V53-V104 HydrophobicContact CB-CG1 4.34Å; V53-C107 HydrophobicContact CG1-CB 3.57Å; V53-R108 HydrophobicContact CB-CG 4.3Å; V53-R108 HydrophobicContact CG2-CG 3.93Å
54	W	94.4	Very high	93.2	Very high	84 Å²	84	71.3 Å²	71.3	32%	0.318	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	146.5	162.4	74.5	98.3	0	0	0	108.9	H45 V47 S71 V72	H45-W54 HydrophobicContact CB-CD2 3.47Å; H45-W54 VanDerWaalsContact CB-CD2 3.47Å; H45-W54 HydrophobicContact CB-CE3 3.71Å; H45-W54 HydrophobicContact CB-CG 4.19Å; H45-W54 HydrophobicContact CB-CH2 3.44Å; H45-W54 VanDerWaalsContact CB-CH2 3.44Å; H45-W54 HydrophobicContact CB-CZ2 3.17Å; H45-W54 HydrophobicContact CB-CZ3 3.68Å; H45-W54 AromaticContact CD2-CD1 3.95Å; H45-W54 AromaticContact CD2-CE2 3.83Å; H45-W54 AromaticContact CD2-NE1 3.38Å; H45-W54 PolarHBondContact CD2-NE1 3.13Å; H45-W54 AromaticContact CG-CE2 3.4Å; H45-W54 VanDerWaalsContact CG-CE2 3.4Å; H45-W54 AromaticContact CG-CZ2 3.42Å; H45-W54 VanDerWaalsContact CG-CZ2 3.42Å; H45-W54 AromaticContact CG-NE1 3.47Å; H45-W54 PolarHBondContact N-O 2.93Å; H45-W54 AromaticContact ND1-CZ2 3.65Å; H45-W54 PolarHBondContact O-N 2.85Å; V47-W54 HydrophobicContact CB-CH2 4.24Å; V47-W54 HydrophobicContact CB-CZ3 3.71Å; V47-W54 HydrophobicContact CG2-CH2 3.19Å; V47-W54 HydrophobicContact CG2-CZ3 3.17Å; W54-S71 WeakPolarHBondContact CA-OG 3.39Å; W54-V72 HydrophobicContact CB-CG2 4.4Å
55	S	96.3	Very high	93.3	Very high	2 Å²	2	70.2 Å²	70.2	1%	0.014	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	142	180	55.8	0	0	0	0	110.2	E43 S71 S103 V104	E43-S55 VanDerWaalsContact O-CA 3.24Å; E43-S55 WeakPolarHBondContact O-CA 3.49Å; S55-S71 PolarHBondContact N-OG 2.78Å; S55-S71 WeakPolarHBondContact O-CB 3.2Å; S55-S71 PolarHBondContact O-N 3.21Å; S55-S71 PolarHBondContact O-OG 2.82Å; S55-S71 WeakPolarHBondContact OG-CB 3Å; S55-S103 WeakPolarHBondContact CB-OG 3.44Å; S55-S103 PolarHBondContact OG-OG 2.86Å; S55-V104 WeakPolarHBondContact OG-CG2 3.44Å
56	V	98	Very high	93.5	Very high	8 Å²	8	68.1 Å²	68.1	5%	0.048	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	127	177.1	-176.7	0	0	0	0	107.8	E43 R58 F69	E43-V56 PolarHBondContact N-O 2.99Å; E43-V56 PolarHBondContact O-N 3.04Å; V56-R58 HydrophobicContact CG1-CG 3.93Å; V56-F69 CarbonylContact C-O 3.51Å; V56-F69 WeakPolarHBondContact CA-O 3.49Å
57	T	98.2	Very high	93.8	Very high	10 Å²	10	65 Å²	65	6%	0.061	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	116.5	168.9	-54.7	0	0	0	0	109.3	L40 K41 F59 R68 F69 Y100	L40-T57 HydrophobicContact CD1-CG2 4.06Å; L40-T57 HydrophobicContact CD2-CG2 3.72Å; L40-T57 HydrophobicContact CG-CG2 3.77Å; K41-T57 CarbonylContact O-C 3.47Å; K41-T57 VanDerWaalsContact O-CA 3.26Å; K41-T57 WeakPolarHBondContact O-CA 3.38Å; T57-F59 HydrophobicContact CG2-CE2 4.24Å; T57-F59 HydrophobicContact CG2-CZ 4.21Å; T57-R68 CarbonylContact O-C 3.59Å; T57-R68 WeakPolarHBondContact O-CA 3.35Å; T57-R68 WeakPolarHBondContact O-CB 3.48Å; T57-F69 PolarHBondContact N-O 3.16Å; T57-F69 PolarHBondContact O-N 3.06Å; T57-Y100 HydrophobicContact CG2-CE1 3.73Å
58	R	98.4	Very high	94.4	Very high	67 Å²	67	63.5 Å²	63.5	25%	0.253	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	137.1	-179.6	-52.6	-178.6	-168.6	-132.7	6.3	110.8	L40 K41 E43 V56 I60 E65	L40-R58 WeakPolarHBondContact CA-O 3.48Å; K41-R58 HydrophobicContact CB-CB 4.35Å; K41-R58 PolarHBondContact N-O 2.94Å; K41-R58 PolarHBondContact O-N 3.29Å; E43-R58 WeakPolarHBondContact OE1-CD 3.39Å; E43-R58 IonicContact OE1-CZ 2.96Å; E43-R58 IonicContact OE1-NE 2.8Å; E43-R58 PolarHBondContact OE1-NE 3.4Å; E43-R58 IonicContact OE1-NH2 3.99Å; E43-R58 IonicContact OE2-CZ 3.78Å; E43-R58 IonicContact OE2-NE 3.28Å; E43-R58 PolarHBondContact OE2-NE 3.2Å; E43-R58 IonicContact OE2-NH2 3.78Å; E43-R58 PolarHBondContact OE2-NH2 2.73Å; E43-R58 VanDerWaalsContact OE2-NH2 3.07Å; V56-R58 HydrophobicContact CG1-CG 3.93Å; R58-I60 HydrophobicContact CB-CD1 4.33Å; R58-I60 HydrophobicContact CB-CG1 4.28Å; R58-E65 HydrophobicContact CB-CG 4.22Å; R58-E65 IonicContact NH1-OE2 2.92Å; R58-E65 PolarHBondContact NH1-OE2 3.01Å
59	F	97.9	Very high	95.1	Very high	24 Å²	24	56.2 Å²	56.2	11%	0.105	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	119	172.3	-57.7	-93.9	0	0	0	108.8	L40 T57 E65 F66 A67 F76 Y100	L40-F59 HydrophobicContact CD1-CD1 4.11Å; L40-F59 HydrophobicContact CD1-CE1 3.62Å; L40-F59 HydrophobicContact CD1-CZ 4.27Å; L40-F59 HydrophobicContact CG-CE1 4.48Å; T57-F59 HydrophobicContact CG2-CE2 4.24Å; T57-F59 HydrophobicContact CG2-CZ 4.21Å; F59-E65 WeakPolarHBondContact O-CA 3.31Å; F59-F66 HydrophobicContact CB-CD1 4.39Å; F59-F66 HydrophobicContact CB-CE1 3.73Å; F59-F66 HydrophobicContact CB-CE2 3.9Å; F59-F66 HydrophobicContact CB-CZ 3.47Å; F59-F66 VanDerWaalsContact CB-CZ 3.47Å; F59-F66 HydrophobicContact CG-CZ 4.41Å; F59-F66 WeakPolarHBondContact O-CD1 2.98Å; F59-F66 PolarHBondContact O-N 3.23Å; F59-A67 HydrophobicContact CD2-CB 4.36Å; F59-A67 WeakPolarHBondContact CD2-O 3.29Å; F59-A67 PolarHBondContact N-O 2.92Å; F59-F76 AromaticContact CE2-CD1 3.92Å; F59-F76 HydrophobicContact CE2-CD1 3.92Å; F59-F76 AromaticContact CE2-CE1 3.65Å; F59-F76 HydrophobicContact CE2-CE1 3.65Å; F59-F76 HydrophobicContact CZ-CD1 4.5Å; F59-F76 AromaticContact CZ-CE1 3.83Å; F59-F76 HydrophobicContact CZ-CE1 3.83Å; F59-Y100 HydrophobicContact CE2-CE1 4.39Å; F59-Y100 AromaticContact CZ-CE1 3.88Å; F59-Y100 HydrophobicContact CZ-CE1 3.88Å; F59-Y100 AromaticContact CZ-CZ 3.89Å; F59-Y100 WeakPolarHBondContact CZ-OH 3.36Å
60	I	98.3	Very high	95.8	Very high	15 Å²	15	56.3 Å²	56.3	8%	0.077	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	125.9	-169.6	-54.9	166.8	0	0	0	108.3	Q39 K41 R58 E64 E65	Q39-I60 HydrophobicContact CB-CB 4.25Å; Q39-I60 PolarHBondContact N-O 3.31Å; Q39-I60 PolarHBondContact O-N 2.78Å; K41-I60 HydrophobicContact CD-CD1 3.9Å; K41-I60 HydrophobicContact CG-CD1 4.16Å; R58-I60 HydrophobicContact CB-CD1 4.33Å; R58-I60 HydrophobicContact CB-CG1 4.28Å; I60-E64 WeakPolarHBondContact CA-O 3.13Å; I60-E65 HydrophobicContact CG1-CB 4.09Å; I60-E65 HydrophobicContact CG1-CG 4.14Å
61	Y	96.5	Very high	96.2	Very high	89 Å²	89	51 Å²	51	35%	0.349	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	120.4	171.9	-168.3	-103.3	0	0	0	109.2	F36 Q63 E64	F36-Y61 HydrophobicContact CD1-CE1 4.42Å; F36-Y61 AromaticContact CD1-CZ 3.92Å; F36-Y61 WeakPolarHBondContact CD1-OH 3.45Å; Y61-Q63 PolarHBondContact O-N 2.72Å; Y61-E64 PolarHBondContact N-O 3.48Å; Y61-E64 PolarHBondContact O-N 2.71Å
62	N	94.7	Very high	96.6	Very high	60 Å²	60	49.6 Å²	49.6	32%	0.321	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	-93.1	-167	-61.3	-40.4	0	0	0	112.3	F36 L37	F36-N62 WeakPolarHBondContact CA-OD1 3.48Å; L37-N62 PolarHBondContact N-OD1 3.31Å; L37-N62 PolarHBondContact O-N 2.85Å
63	Q	95.1	Very high	97	Very high	195 Å²	195	50.5 Å²	50.5	91%	0.911	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-127.7	3.5	177.9	-60.8	179.5	16.5	0	0	111.6	Y61	Y61-Q63 PolarHBondContact O-N 2.72Å
64	E	97.3	Very high	97.2	Very high	104 Å²	104	50.4 Å²	50.4	49%	0.486	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	115	-178	-171.1	-177.9	154.1	0	0	109.4	I60 Y61 F66 T80	I60-E64 WeakPolarHBondContact CA-O 3.13Å; Y61-E64 PolarHBondContact N-O 3.48Å; Y61-E64 PolarHBondContact O-N 2.71Å; E64-F66 PolarHBondContact O-N 3.19Å; E64-T80 HydrophobicContact CG-CG2 4.05Å; E64-T80 VanDerWaalsContact OE1-CB 3.31Å; E64-T80 WeakPolarHBondContact OE1-CB 3.38Å; E64-T80 WeakPolarHBondContact OE1-CG2 3.19Å; E64-T80 PolarHBondContact OE1-OG1 2.96Å
65	E	98.4	Very high	97.4	Very high	29 Å²	29	51.2 Å²	51.2	14%	0.136	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	115.6	168.3	-171.6	-175.1	159.2	0	0	108.9	R58 F59 I60 R68 V79	R58-E65 HydrophobicContact CB-CG 4.22Å; R58-E65 IonicContact NH1-OE2 2.92Å; R58-E65 PolarHBondContact NH1-OE2 3.01Å; F59-E65 WeakPolarHBondContact O-CA 3.31Å; I60-E65 HydrophobicContact CG1-CB 4.09Å; I60-E65 HydrophobicContact CG1-CG 4.14Å; E65-R68 WeakPolarHBondContact OE1-CB 3.44Å; E65-R68 IonicContact OE1-CZ 3.8Å; E65-R68 IonicContact OE1-NE 3.95Å; E65-R68 PolarHBondContact OE1-NE 2.96Å; E65-R68 IonicContact OE1-NH2 3.09Å; E65-R68 PolarHBondContact OE1-NH2 2.91Å; E65-R68 IonicContact OE2-CZ 2.72Å; E65-R68 IonicContact OE2-NH2 2.71Å; E65-R68 PolarHBondContact OE2-NH2 2.87Å; E65-V79 HydrophobicContact CG-CG2 4.2Å; E65-V79 WeakPolarHBondContact O-CB 3.39Å; E65-V79 VanDerWaalsContact O-CG1 3.29Å; E65-V79 WeakPolarHBondContact O-CG1 3.31Å
66	F	98.1	Very high	97.5	Very high	16 Å²	16	51.2 Å²	51.2	7%	0.07	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-30.5	-175.5	65.4	-94.3	0	0	0	112.6	F59 E64 V79 T80 L82 G83 I86	F59-F66 HydrophobicContact CB-CD1 4.39Å; F59-F66 HydrophobicContact CB-CE1 3.73Å; F59-F66 HydrophobicContact CB-CE2 3.9Å; F59-F66 HydrophobicContact CB-CZ 3.47Å; F59-F66 VanDerWaalsContact CB-CZ 3.47Å; F59-F66 HydrophobicContact CG-CZ 4.41Å; F59-F66 WeakPolarHBondContact O-CD1 2.98Å; F59-F66 PolarHBondContact O-N 3.23Å; E64-F66 PolarHBondContact O-N 3.19Å; F66-V79 PolarHBondContact O-N 2.9Å; F66-T80 PolarHBondContact O-N 2.86Å; F66-L82 HydrophobicContact CB-CB 4.43Å; F66-L82 HydrophobicContact CB-CD2 4.25Å; F66-L82 HydrophobicContact CB-CG 4.46Å; F66-G83 WeakPolarHBondContact O-CA 3.43Å; F66-I86 HydrophobicContact CD2-CD1 3.87Å; F66-I86 HydrophobicContact CE2-CD1 3.52Å; F66-I86 HydrophobicContact CE2-CG2 4.27Å; F66-I86 HydrophobicContact CZ-CD1 4.39Å
67	A	98.3	Very high	97.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	158.6	177.6	0	0	0	0	0	111.3	F59 L77	F59-A67 HydrophobicContact CD2-CB 4.36Å; F59-A67 WeakPolarHBondContact CD2-O 3.29Å; F59-A67 PolarHBondContact N-O 2.92Å; A67-L77 CarbonylContact C-O 3.57Å; A67-L77 WeakPolarHBondContact CA-O 3.48Å
68	R	98.4	Very high	97.5	Very high	63 Å²	63	55 Å²	55	24%	0.238	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	147.8	172.1	62.4	177.1	62.3	173.3	1.4	112.6	T57 E65 F76 L77 V79	T57-R68 CarbonylContact O-C 3.59Å; T57-R68 WeakPolarHBondContact O-CA 3.35Å; T57-R68 WeakPolarHBondContact O-CB 3.48Å; E65-R68 WeakPolarHBondContact OE1-CB 3.44Å; E65-R68 IonicContact OE1-CZ 3.8Å; E65-R68 IonicContact OE1-NE 3.95Å; E65-R68 PolarHBondContact OE1-NE 2.96Å; E65-R68 IonicContact OE1-NH2 3.09Å; E65-R68 PolarHBondContact OE1-NH2 2.91Å; E65-R68 IonicContact OE2-CZ 2.72Å; E65-R68 IonicContact OE2-NH2 2.71Å; E65-R68 PolarHBondContact OE2-NH2 2.87Å; R68-F76 CarbonylContact O-C 3.58Å; R68-F76 VanDerWaalsContact O-CA 3.28Å; R68-F76 WeakPolarHBondContact O-CA 3.16Å; R68-L77 HydrophobicContact CG-CB 4.19Å; R68-L77 PolarHBondContact N-O 3.07Å; R68-L77 PolarHBondContact O-N 2.75Å; R68-V79 HydrophobicContact CB-CG2 4.49Å; R68-V79 HydrophobicContact CG-CG2 3.99Å
69	F	98.5	Very high	97.5	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	132.9	156.5	178.1	-92.5	0	0	0	108.7	V56 T57 F76 L97 Y100 R101	V56-F69 CarbonylContact C-O 3.51Å; V56-F69 WeakPolarHBondContact CA-O 3.49Å; T57-F69 PolarHBondContact N-O 3.16Å; T57-F69 PolarHBondContact O-N 3.06Å; F69-F76 HydrophobicContact CB-CD1 3.82Å; F69-F76 HydrophobicContact CB-CE1 3.77Å; F69-F76 HydrophobicContact CB-CG 4.46Å; F69-F76 HydrophobicContact CB-CZ 4.36Å; F69-F76 HydrophobicContact CD2-CD2 4.31Å; F69-F76 HydrophobicContact CD2-CE1 4.48Å; F69-F76 HydrophobicContact CD2-CE2 4.25Å; F69-F76 HydrophobicContact CD2-CG 4.46Å; F69-F76 HydrophobicContact CD2-CZ 4.34Å; F69-L97 HydrophobicContact CD2-CD1 4.37Å; F69-L97 HydrophobicContact CE2-CD1 3.94Å; F69-Y100 HydrophobicContact CB-CD1 3.68Å; F69-Y100 HydrophobicContact CB-CE1 4.36Å; F69-Y100 HydrophobicContact CB-CG 4.44Å; F69-Y100 HydrophobicContact CD1-CD1 4.16Å; F69-Y100 HydrophobicContact CD2-CD1 4.37Å; F69-Y100 HydrophobicContact CD2-CG 4.33Å; F69-Y100 WeakPolarHBondContact CE1-O 3.36Å; F69-Y100 AromaticContact CG-CD1 3.81Å; F69-Y100 HydrophobicContact CG-CD1 3.81Å; F69-Y100 HydrophobicContact CG-CG 4.2Å; F69-Y100 VanDerWaalsContact CZ-C 3.49Å; F69-Y100 WeakPolarHBondContact CZ-O 3.45Å; F69-R101 HydrophobicContact CE2-CG 4.18Å; F69-R101 HydrophobicContact CZ-CB 4.45Å; F69-R101 HydrophobicContact CZ-CG 3.92Å
70	D	97.9	Very high	97.5	Very high	23 Å²	23	55.5 Å²	55.5	12%	0.123	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	120.5	175.3	-175.1	-31.3	0	0	0	108.9	V72 F73 G74 K75 L77	D70-V72 PolarHBondContact O-N 3.31Å; D70-V72 VanDerWaalsContact OD1-CB 3.27Å; D70-V72 WeakPolarHBondContact OD1-CB 3.43Å; D70-V72 WeakPolarHBondContact OD1-CG2 3.37Å; D70-V72 PolarHBondContact OD1-N 2.99Å; D70-F73 HydrophobicContact CB-CD2 3.88Å; D70-F73 PolarHBondContact O-N 2.73Å; D70-F73 VanDerWaalsContact O-N 3.07Å; D70-G74 PolarHBondContact O-N 2.8Å; D70-K75 PolarHBondContact N-O 2.66Å; D70-L77 HydrophobicContact CB-CD1 4.38Å
71	S	96.8	Very high	97.4	Very high	27 Å²	27	61.1 Å²	61.1	19%	0.189	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-23.6	-176.4	67.1	0	0	0	0	113.4	W54 S55 F73 G74 V104	W54-S71 WeakPolarHBondContact CA-OG 3.39Å; S55-S71 PolarHBondContact N-OG 2.78Å; S55-S71 WeakPolarHBondContact O-CB 3.2Å; S55-S71 PolarHBondContact O-N 3.21Å; S55-S71 PolarHBondContact O-OG 2.82Å; S55-S71 WeakPolarHBondContact OG-CB 3Å; S71-F73 VanDerWaalsContact C-N 3.26Å; S71-F73 PolarHBondContact O-N 3.26Å; S71-G74 PolarHBondContact O-N 3.4Å; S71-V104 VanDerWaalsContact CB-CG2 3.43Å
72	V	95.9	Very high	97.3	Very high	106 Å²	106	61.6 Å²	61.6	64%	0.642	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-38.1	175.4	178.3	0	0	0	0	110.4	W54 D70	W54-V72 HydrophobicContact CB-CG2 4.4Å; D70-V72 PolarHBondContact O-N 3.31Å; D70-V72 VanDerWaalsContact OD1-CB 3.27Å; D70-V72 WeakPolarHBondContact OD1-CB 3.43Å; D70-V72 WeakPolarHBondContact OD1-CG2 3.37Å; D70-V72 PolarHBondContact OD1-N 2.99Å
73	F	97.1	Very high	97.4	Very high	124 Å²	124	58.7 Å²	58.7	54%	0.544	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-18.2	177.6	-59.7	-80.1	0	0	0	112.9	D70 S71 K75 L77	D70-F73 HydrophobicContact CB-CD2 3.88Å; D70-F73 PolarHBondContact O-N 2.73Å; D70-F73 VanDerWaalsContact O-N 3.07Å; S71-F73 VanDerWaalsContact C-N 3.26Å; S71-F73 PolarHBondContact O-N 3.26Å; F73-K75 HydrophobicContact CB-CG 4.19Å; F73-K75 PolarHBondContact O-N 3.19Å; F73-L77 HydrophobicContact CD2-CD1 3.63Å; F73-L77 HydrophobicContact CE2-CD1 3.97Å; F73-L77 HydrophobicContact CG-CD1 4.12Å
74	G	97.3	Very high	97.6	Very high	13 Å²	13	55.1 Å²	55.1	13%	0.134	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	28	-179.7	0	0	0	0	0	113.3	D70 S71 R101	D70-G74 PolarHBondContact O-N 2.8Å; S71-G74 PolarHBondContact O-N 3.4Å; G74-R101 PolarHBondContact O-NE 3.01Å; G74-R101 PolarHBondContact O-NH2 3.33Å
75	K	98.1	Very high	97.6	Very high	101 Å²	101	53.9 Å²	53.9	44%	0.439	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	166.2	-178.8	70.3	177.8	180	178.1	0	112.9	D70 F73 L77 N91 L97	D70-K75 PolarHBondContact N-O 2.66Å; F73-K75 HydrophobicContact CB-CG 4.19Å; F73-K75 PolarHBondContact O-N 3.19Å; K75-L77 HydrophobicContact CG-CD2 4.24Å; K75-N91 WeakPolarHBondContact CB-OD1 3.03Å; K75-L97 HydrophobicContact CB-CD1 4.33Å
76	F	98.4	Very high	97.5	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.009	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	137.5	172.4	-62.5	-90.9	0	0	0	110.6	F59 R68 F69 A87 L90 N91 M96 L97 Y100	F59-F76 AromaticContact CE2-CD1 3.92Å; F59-F76 HydrophobicContact CE2-CD1 3.92Å; F59-F76 AromaticContact CE2-CE1 3.65Å; F59-F76 HydrophobicContact CE2-CE1 3.65Å; F59-F76 HydrophobicContact CZ-CD1 4.5Å; F59-F76 AromaticContact CZ-CE1 3.83Å; F59-F76 HydrophobicContact CZ-CE1 3.83Å; R68-F76 CarbonylContact O-C 3.58Å; R68-F76 VanDerWaalsContact O-CA 3.28Å; R68-F76 WeakPolarHBondContact O-CA 3.16Å; F69-F76 HydrophobicContact CB-CD1 3.82Å; F69-F76 HydrophobicContact CB-CE1 3.77Å; F69-F76 HydrophobicContact CB-CG 4.46Å; F69-F76 HydrophobicContact CB-CZ 4.36Å; F69-F76 HydrophobicContact CD2-CD2 4.31Å; F69-F76 HydrophobicContact CD2-CE1 4.48Å; F69-F76 HydrophobicContact CD2-CE2 4.25Å; F69-F76 HydrophobicContact CD2-CG 4.46Å; F69-F76 HydrophobicContact CD2-CZ 4.34Å; F76-A87 HydrophobicContact CB-CB 4.05Å; F76-L90 HydrophobicContact CB-CB 4.34Å; F76-L90 HydrophobicContact CD1-CB 4.3Å; F76-L90 HydrophobicContact CD1-CD1 3.69Å; F76-L90 HydrophobicContact CD2-CB 3.55Å; F76-L90 HydrophobicContact CD2-CD1 4.45Å; F76-L90 HydrophobicContact CE1-CD1 3.83Å; F76-L90 HydrophobicContact CE2-CB 3.82Å; F76-L90 HydrophobicContact CG-CB 3.81Å; F76-L90 HydrophobicContact CG-CD1 4.02Å; F76-L90 HydrophobicContact CZ-CB 4.3Å; F76-L90 HydrophobicContact CZ-CD1 4.27Å; F76-N91 WeakPolarHBondContact CD2-OD1 3.12Å; F76-N91 PolarHBondContact N-OD1 3.26Å; F76-N91 PolarHBondContact O-ND2 3.37Å; F76-M96 HydrophobicContact CZ-CG 4.49Å; F76-L97 HydrophobicContact CD2-CD1 4.09Å; F76-L97 HydrophobicContact CE2-CD1 4.09Å; F76-Y100 AromaticContact CE1-CD1 3.94Å; F76-Y100 HydrophobicContact CE1-CD1 3.94Å; F76-Y100 HydrophobicContact CE1-CD2 4.44Å; F76-Y100 AromaticContact CE1-CE1 3.88Å; F76-Y100 HydrophobicContact CE1-CE1 3.88Å; F76-Y100 HydrophobicContact CE1-CE2 4.4Å; F76-Y100 HydrophobicContact CE1-CG 4.22Å; F76-Y100 HydrophobicContact CE2-CD2 4.44Å; F76-Y100 HydrophobicContact CE2-CG 4.41Å; F76-Y100 AromaticContact CZ-CD1 3.81Å; F76-Y100 HydrophobicContact CZ-CD1 3.81Å; F76-Y100 AromaticContact CZ-CD2 3.61Å; F76-Y100 HydrophobicContact CZ-CD2 3.61Å; F76-Y100 AromaticContact CZ-CE1 3.99Å; F76-Y100 HydrophobicContact CZ-CE1 3.99Å; F76-Y100 AromaticContact CZ-CE2 3.8Å; F76-Y100 HydrophobicContact CZ-CE2 3.8Å; F76-Y100 AromaticContact CZ-CG 3.6Å; F76-Y100 HydrophobicContact CZ-CG 3.6Å; F76-Y100 AromaticContact CZ-CZ 4Å
77	L	98.4	Very high	97.5	Very high	49 Å²	49	55 Å²	55	26%	0.257	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	135.3	177.5	-57.8	176.9	0	0	0	108.3	A67 R68 D70 F73 K75	A67-L77 CarbonylContact C-O 3.57Å; A67-L77 WeakPolarHBondContact CA-O 3.48Å; R68-L77 HydrophobicContact CG-CB 4.19Å; R68-L77 PolarHBondContact N-O 3.07Å; R68-L77 PolarHBondContact O-N 2.75Å; D70-L77 HydrophobicContact CB-CD1 4.38Å; F73-L77 HydrophobicContact CD2-CD1 3.63Å; F73-L77 HydrophobicContact CE2-CD1 3.97Å; F73-L77 HydrophobicContact CG-CD1 4.12Å; K75-L77 HydrophobicContact CG-CD2 4.24Å
78	A	98.1	Very high	97.5	Very high	47 Å²	47	60.6 Å²	60.6	39%	0.388	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	131.1	168.2	0	0	0	0	0	109.2	R84 A87	A78-R84 HydrophobicContact CB-CB 4.17Å; A78-A87 HydrophobicContact CB-CB 4.23Å
79	V	98.2	Very high	97.4	Very high	66 Å²	66	64.3 Å²	64.3	40%	0.4	33%	0.329	S	S	.	.	S	Bend	trans	-94.5	-34.4	173.5	-179.6	0	0	0	0	109.7	E65 F66 R68	E65-V79 HydrophobicContact CG-CG2 4.2Å; E65-V79 WeakPolarHBondContact O-CB 3.39Å; E65-V79 VanDerWaalsContact O-CG1 3.29Å; E65-V79 WeakPolarHBondContact O-CG1 3.31Å; F66-V79 PolarHBondContact O-N 2.9Å; R68-V79 HydrophobicContact CB-CG2 4.49Å; R68-V79 HydrophobicContact CG-CG2 3.99Å
80	T	97.8	Very high	97.4	Very high	36 Å²	36	65.1 Å²	65.1	22%	0.221	33%	0.333	C	S	.	.	S	Bend	trans	-131.6	169	175.5	73.7	0	0	0	0	111	E64 F66 L82 G83 R84	E64-T80 HydrophobicContact CG-CG2 4.05Å; E64-T80 VanDerWaalsContact OE1-CB 3.31Å; E64-T80 WeakPolarHBondContact OE1-CB 3.38Å; E64-T80 WeakPolarHBondContact OE1-CG2 3.19Å; E64-T80 PolarHBondContact OE1-OG1 2.96Å; F66-T80 PolarHBondContact O-N 2.86Å; T80-L82 PolarHBondContact O-N 2.97Å; T80-G83 PolarHBondContact O-N 2.75Å; T80-R84 PolarHBondContact O-N 2.99Å
81	E	96.6	Very high	97.4	Very high	133 Å²	133	66.4 Å²	66.4	62%	0.621	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-33.4	-178.3	-68.5	-56.9	143.9	0	0	112.8	G83 R84 P85	E81-G83 PolarHBondContact O-N 2.85Å; E81-R84 VanDerWaalsContact CD-NH2 3.26Å; E81-R84 WeakPolarHBondContact O-CB 3.17Å; E81-R84 PolarHBondContact O-N 3.31Å; E81-R84 IonicContact OE1-CZ 3.02Å; E81-R84 IonicContact OE1-NE 3.61Å; E81-R84 IonicContact OE1-NH2 3.1Å; E81-R84 PolarHBondContact OE1-NH2 3.32Å; E81-R84 IonicContact OE2-CZ 2.97Å; E81-R84 VanDerWaalsContact OE2-CZ 3.28Å; E81-R84 IonicContact OE2-NE 2.75Å; E81-R84 PolarHBondContact OE2-NE 3.21Å; E81-R84 IonicContact OE2-NH2 3.79Å; E81-R84 PolarHBondContact OE2-NH2 2.8Å; E81-P85 WeakPolarHBondContact O-CD 3.33Å
82	L	93.9	Very high	97.5	Very high	99 Å²	99	69.8 Å²	69.8	52%	0.518	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-38.4	174.2	178.4	64.4	0	0	0	111.7	F66 T80	F66-L82 HydrophobicContact CB-CB 4.43Å; F66-L82 HydrophobicContact CB-CD2 4.25Å; F66-L82 HydrophobicContact CB-CG 4.46Å; T80-L82 PolarHBondContact O-N 2.97Å
83	G	97.4	Very high	97.6	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-80.8	-11.3	-178.9	0	0	0	0	0	115	F66 T80 E81 I86 A87	F66-G83 WeakPolarHBondContact O-CA 3.43Å; T80-G83 PolarHBondContact O-N 2.75Å; E81-G83 PolarHBondContact O-N 2.85Å; G83-I86 PolarHBondContact O-N 2.88Å; G83-A87 VanDerWaalsContact O-CB 3.31Å; G83-A87 WeakPolarHBondContact O-CB 3.49Å; G83-A87 PolarHBondContact O-N 3.38Å
84	R	98.3	Very high	97.6	Very high	119 Å²	119	69.5 Å²	69.5	45%	0.449	35%	0.351	S	S	.	.	H	α-helix	trans	-56.3	-59.6	179.5	-174.4	-169.9	-61.6	-99.1	0.4	113	A78 T80 E81 I86 A87 E88	A78-R84 HydrophobicContact CB-CB 4.17Å; T80-R84 PolarHBondContact O-N 2.99Å; E81-R84 VanDerWaalsContact CD-NH2 3.26Å; E81-R84 WeakPolarHBondContact O-CB 3.17Å; E81-R84 PolarHBondContact O-N 3.31Å; E81-R84 IonicContact OE1-CZ 3.02Å; E81-R84 IonicContact OE1-NE 3.61Å; E81-R84 IonicContact OE1-NH2 3.1Å; E81-R84 PolarHBondContact OE1-NH2 3.32Å; E81-R84 IonicContact OE2-CZ 2.97Å; E81-R84 VanDerWaalsContact OE2-CZ 3.28Å; E81-R84 IonicContact OE2-NE 2.75Å; E81-R84 PolarHBondContact OE2-NE 3.21Å; E81-R84 IonicContact OE2-NH2 3.79Å; E81-R84 PolarHBondContact OE2-NH2 2.8Å; R84-I86 PolarHBondContact O-N 2.88Å; R84-A87 PolarHBondContact O-N 3.24Å; R84-E88 WeakPolarHBondContact CG-OE1 3.49Å; R84-E88 WeakPolarHBondContact O-CG 3.36Å; R84-E88 PolarHBondContact O-N 2.79Å
85	P	97.8	Very high	97.6	Very high	79 Å²	79	75.6 Å²	75.6	51%	0.513	38%	0.38	S	S	.	.	H	α-helix	trans	-62.8	-31.1	179.7	25.3	-35.3	0	0	0	112.3	E81 Y89	E81-P85 WeakPolarHBondContact O-CD 3.33Å; P85-Y89 VanDerWaalsContact O-CB 3.32Å; P85-Y89 WeakPolarHBondContact O-CB 3.36Å; P85-Y89 PolarHBondContact O-N 3.27Å
86	I	96.4	Very high	97.4	Very high	63 Å²	63	74 Å²	74	32%	0.323	38%	0.376	S	S	.	.	H	α-helix	trans	-69.5	-50.8	179.5	-59.3	171.7	0	0	0	110.2	F66 G83 R84 E88 Y89 L90	F66-I86 HydrophobicContact CD2-CD1 3.87Å; F66-I86 HydrophobicContact CE2-CD1 3.52Å; F66-I86 HydrophobicContact CE2-CG2 4.27Å; F66-I86 HydrophobicContact CZ-CD1 4.39Å; G83-I86 PolarHBondContact O-N 2.88Å; R84-I86 PolarHBondContact O-N 2.88Å; I86-E88 VanDerWaalsContact C-N 3.33Å; I86-E88 PolarHBondContact O-N 2.84Å; I86-Y89 PolarHBondContact O-N 3.13Å; I86-L90 HydrophobicContact CG2-CD1 3.74Å; I86-L90 HydrophobicContact CG2-CG 4.17Å; I86-L90 WeakPolarHBondContact O-CB 3.26Å; I86-L90 WeakPolarHBondContact O-CG 3.3Å; I86-L90 PolarHBondContact O-N 2.76Å
87	A	98.1	Very high	97.4	Very high	4 Å²	4	74.6 Å²	74.6	3%	0.033	38%	0.378	C	S	.	.	H	α-helix	trans	-62.3	-41.3	179.3	0	0	0	0	0	111.6	F76 A78 G83 R84 L90 N91	F76-A87 HydrophobicContact CB-CB 4.05Å; A78-A87 HydrophobicContact CB-CB 4.23Å; G83-A87 VanDerWaalsContact O-CB 3.31Å; G83-A87 WeakPolarHBondContact O-CB 3.49Å; G83-A87 PolarHBondContact O-N 3.38Å; R84-A87 PolarHBondContact O-N 3.24Å; A87-L90 PolarHBondContact O-N 3.02Å; A87-N91 WeakPolarHBondContact O-CB 3.5Å; A87-N91 PolarHBondContact O-N 3Å; A87-N91 PolarHBondContact O-ND2 2.83Å
88	E	98	Very high	97.4	Very high	119 Å²	119	75.1 Å²	75.1	56%	0.556	38%	0.381	S	S	*	.	H	α-helix	trans	-58.9	-51.1	174.2	-74.2	172.1	-173.8	0	0	111.2	R84 I86 N91 T92	R84-E88 WeakPolarHBondContact CG-OE1 3.49Å; R84-E88 WeakPolarHBondContact O-CG 3.36Å; R84-E88 PolarHBondContact O-N 2.79Å; I86-E88 VanDerWaalsContact C-N 3.33Å; I86-E88 PolarHBondContact O-N 2.84Å; E88-N91 PolarHBondContact O-N 3.36Å; E88-T92 WeakPolarHBondContact O-CG2 3.45Å; E88-T92 PolarHBondContact O-N 2.85Å
89	Y	97.6	Very high	97.3	Very high	141 Å²	141	77 Å²	77	55%	0.553	39%	0.385	S	S	*	.	H	α-helix	trans	-58.8	-50.7	176.8	175.4	-104	0	0	0	111.9	P85 I86 N91 T92 Q93	P85-Y89 VanDerWaalsContact O-CB 3.32Å; P85-Y89 WeakPolarHBondContact O-CB 3.36Å; P85-Y89 PolarHBondContact O-N 3.27Å; I86-Y89 PolarHBondContact O-N 3.13Å; Y89-N91 PolarHBondContact O-N 3.43Å; Y89-T92 WeakPolarHBondContact O-CB 3.12Å; Y89-T92 PolarHBondContact O-N 3.42Å; Y89-T92 PolarHBondContact O-OG1 2.86Å; Y89-Q93 HydrophobicContact CD1-CG 4.38Å; Y89-Q93 HydrophobicContact CE1-CG 3.94Å; Y89-Q93 HydrophobicContact CE2-CG 4.42Å; Y89-Q93 VanDerWaalsContact CE2-NE2 3.25Å; Y89-Q93 PolarHBondContact O-N 3.49Å; Y89-Q93 PolarHBondContact OH-NE2 2.86Å
90	L	97.6	Very high	97.3	Very high	17 Å²	17	75.3 Å²	75.3	9%	0.089	37%	0.372	C	S	.	.	H	α-helix	trans	-59.2	-34.9	-179.9	-69.9	175.7	0	0	0	112.6	F76 I86 A87 T92 Q93 M96	F76-L90 HydrophobicContact CB-CB 4.34Å; F76-L90 HydrophobicContact CD1-CB 4.3Å; F76-L90 HydrophobicContact CD1-CD1 3.69Å; F76-L90 HydrophobicContact CD2-CB 3.55Å; F76-L90 HydrophobicContact CD2-CD1 4.45Å; F76-L90 HydrophobicContact CE1-CD1 3.83Å; F76-L90 HydrophobicContact CE2-CB 3.82Å; F76-L90 HydrophobicContact CG-CB 3.81Å; F76-L90 HydrophobicContact CG-CD1 4.02Å; F76-L90 HydrophobicContact CZ-CB 4.3Å; F76-L90 HydrophobicContact CZ-CD1 4.27Å; I86-L90 HydrophobicContact CG2-CD1 3.74Å; I86-L90 HydrophobicContact CG2-CG 4.17Å; I86-L90 WeakPolarHBondContact O-CB 3.26Å; I86-L90 WeakPolarHBondContact O-CG 3.3Å; I86-L90 PolarHBondContact O-N 2.76Å; A87-L90 PolarHBondContact O-N 3.02Å; L90-T92 VanDerWaalsContact C-N 3.26Å; L90-T92 PolarHBondContact O-N 3.34Å; L90-Q93 PolarHBondContact O-N 2.9Å; L90-M96 HydrophobicContact CD2-CE 3.49Å; L90-M96 VanDerWaalsContact CD2-CE 3.49Å; L90-M96 HydrophobicContact CD2-SD 3.3Å; L90-M96 WeakPolarHBondContact CD2-SD 3.05Å
91	N	98.4	Very high	97.2	Very high	49 Å²	49	79.2 Å²	79.2	26%	0.262	38%	0.382	S	S	.	.	H	α-helix	trans	-70.4	-19.5	176	-74.9	-34.3	0	0	0	113.7	K75 F76 A87 E88 Y89	K75-N91 WeakPolarHBondContact CB-OD1 3.03Å; F76-N91 WeakPolarHBondContact CD2-OD1 3.12Å; F76-N91 PolarHBondContact N-OD1 3.26Å; F76-N91 PolarHBondContact O-ND2 3.37Å; A87-N91 WeakPolarHBondContact O-CB 3.5Å; A87-N91 PolarHBondContact O-N 3Å; A87-N91 PolarHBondContact O-ND2 2.83Å; E88-N91 PolarHBondContact O-N 3.36Å; Y89-N91 PolarHBondContact O-N 3.43Å
92	T	97.9	Very high	97.2	Very high	99 Å²	99	74.8 Å²	74.8	61%	0.607	37%	0.369	S	S	*	.	H	α-helix	trans	-82.7	-21.6	171.5	68	0	0	0	0	113.2	E88 Y89 L90 K94	E88-T92 WeakPolarHBondContact O-CG2 3.45Å; E88-T92 PolarHBondContact O-N 2.85Å; Y89-T92 WeakPolarHBondContact O-CB 3.12Å; Y89-T92 PolarHBondContact O-N 3.42Å; Y89-T92 PolarHBondContact O-OG1 2.86Å; L90-T92 VanDerWaalsContact C-N 3.26Å; L90-T92 PolarHBondContact O-N 3.34Å; T92-K94 PolarHBondContact O-N 2.85Å; T92-K94 VanDerWaalsContact O-N 3.12Å
93	Q	97.9	Very high	97.3	Very high	75 Å²	75	70.5 Å²	70.5	35%	0.35	35%	0.347	S	S	.	.			trans	-82	90	-179.6	-60.1	-55.2	-46.2	0	0	110.3	Y89 L90 D95 M96 L97	Y89-Q93 HydrophobicContact CD1-CG 4.38Å; Y89-Q93 HydrophobicContact CE1-CG 3.94Å; Y89-Q93 HydrophobicContact CE2-CG 4.42Å; Y89-Q93 VanDerWaalsContact CE2-NE2 3.25Å; Y89-Q93 PolarHBondContact O-N 3.49Å; Y89-Q93 PolarHBondContact OH-NE2 2.86Å; L90-Q93 PolarHBondContact O-N 2.9Å; Q93-D95 PolarHBondContact O-N 3.35Å; Q93-M96 HydrophobicContact CB-CB 3.96Å; Q93-M96 PolarHBondContact O-N 3.22Å; Q93-L97 WeakPolarHBondContact O-CB 3.42Å; Q93-L97 PolarHBondContact O-N 3.44Å
94	K	96.8	Very high	97.2	Very high	148 Å²	148	71.5 Å²	71.5	64%	0.643	35%	0.353	S	S	*	.	H	α-helix	trans	-53.6	-50.9	-172.7	-173.1	178.8	179.2	-175.1	0	113.4	T92 M96 L97 D98	T92-K94 PolarHBondContact O-N 2.85Å; T92-K94 VanDerWaalsContact O-N 3.12Å; K94-M96 VanDerWaalsContact C-N 3.27Å; K94-M96 PolarHBondContact O-N 3.07Å; K94-L97 PolarHBondContact O-N 3.34Å; K94-D98 WeakPolarHBondContact CG-OD2 3.44Å; K94-D98 WeakPolarHBondContact O-CB 3.27Å; K94-D98 PolarHBondContact O-N 3.48Å
95	D	97.1	Very high	97.1	Very high	141 Å²	141	69.7 Å²	69.7	75%	0.754	35%	0.352	S	S	*	.	H	α-helix	trans	-62	-38	-176.8	-61.1	-22	0	0	0	111.8	Q93 N99	Q93-D95 PolarHBondContact O-N 3.35Å; D95-N99 WeakPolarHBondContact O-CB 3.32Å; D95-N99 PolarHBondContact O-N 2.73Å
96	M	95.7	Very high	96.9	Very high	69 Å²	69	71.3 Å²	71.3	34%	0.34	35%	0.348	S	S	.	.	H	α-helix	trans	-68.2	-50	176	-171.7	164.8	-173.2	0	0	110.7	F76 L90 Q93 K94 D98 N99 Y100	F76-M96 HydrophobicContact CZ-CG 4.49Å; L90-M96 HydrophobicContact CD2-CE 3.49Å; L90-M96 VanDerWaalsContact CD2-CE 3.49Å; L90-M96 HydrophobicContact CD2-SD 3.3Å; L90-M96 WeakPolarHBondContact CD2-SD 3.05Å; Q93-M96 HydrophobicContact CB-CB 3.96Å; Q93-M96 PolarHBondContact O-N 3.22Å; K94-M96 VanDerWaalsContact C-N 3.27Å; K94-M96 PolarHBondContact O-N 3.07Å; M96-D98 VanDerWaalsContact C-N 3.31Å; M96-D98 PolarHBondContact O-N 3.01Å; M96-N99 WeakPolarHBondContact O-CB 3.37Å; M96-N99 PolarHBondContact O-N 3.29Å; M96-Y100 HydrophobicContact CE-CE2 3.74Å; M96-Y100 HydrophobicContact CG-CD2 4.07Å; M96-Y100 HydrophobicContact CG-CE2 3.88Å; M96-Y100 VanDerWaalsContact O-CD2 3.25Å; M96-Y100 WeakPolarHBondContact O-CD2 3.28Å; M96-Y100 PolarHBondContact O-N 3.03Å
97	L	97.6	Very high	96.9	Very high	13 Å²	13	68.5 Å²	68.5	7%	0.068	33%	0.334	C	S	.	.	H	α-helix	trans	-58.7	-43.1	179.9	-179.6	57.9	0	0	0	112.2	F69 K75 F76 Q93 K94 Y100 R101	F69-L97 HydrophobicContact CD2-CD1 4.37Å; F69-L97 HydrophobicContact CE2-CD1 3.94Å; K75-L97 HydrophobicContact CB-CD1 4.33Å; F76-L97 HydrophobicContact CD2-CD1 4.09Å; F76-L97 HydrophobicContact CE2-CD1 4.09Å; Q93-L97 WeakPolarHBondContact O-CB 3.42Å; Q93-L97 PolarHBondContact O-N 3.44Å; K94-L97 PolarHBondContact O-N 3.34Å; L97-Y100 PolarHBondContact O-N 2.98Å; L97-R101 WeakPolarHBondContact O-CG 3.49Å; L97-R101 PolarHBondContact O-N 2.97Å
98	D	97.8	Very high	96.7	Very high	60 Å²	60	72.8 Å²	72.8	32%	0.321	35%	0.35	S	S	.	.	H	α-helix	trans	-67.9	-37.5	178.4	-71.1	-17	0	0	0	111.8	K94 M96 Y100 R101 A102	K94-D98 WeakPolarHBondContact CG-OD2 3.44Å; K94-D98 WeakPolarHBondContact O-CB 3.27Å; K94-D98 PolarHBondContact O-N 3.48Å; M96-D98 VanDerWaalsContact C-N 3.31Å; M96-D98 PolarHBondContact O-N 3.01Å; D98-Y100 PolarHBondContact O-N 2.81Å; D98-R101 PolarHBondContact O-N 2.95Å; D98-R101 IonicContact OD1-CZ 2.82Å; D98-R101 IonicContact OD1-NH1 2.66Å; D98-R101 PolarHBondContact OD1-NH1 2.94Å; D98-A102 PolarHBondContact O-N 3.31Å
99	N	96.8	Very high	96.4	Very high	88 Å²	88	73.3 Å²	73.3	47%	0.471	36%	0.356	S	S	.	.	H	α-helix	trans	-58.1	-47.5	170.4	179.4	42.9	0	0	0	111.1	D95 M96 R101 A102 R106	D95-N99 WeakPolarHBondContact O-CB 3.32Å; D95-N99 PolarHBondContact O-N 2.73Å; M96-N99 WeakPolarHBondContact O-CB 3.37Å; M96-N99 PolarHBondContact O-N 3.29Å; N99-R101 PolarHBondContact O-N 2.99Å; N99-A102 WeakPolarHBondContact O-CB 3.33Å; N99-A102 PolarHBondContact O-N 2.84Å; N99-R106 PolarHBondContact O-NH2 3.41Å; N99-R106 PolarHBondContact OD1-NH2 3.27Å
100	Y	97.3	Very high	96.1	Very high	30 Å²	30	70.6 Å²	70.6	12%	0.118	35%	0.351	C	S	.	.	H	α-helix	trans	-66.2	-35.3	178.9	-82.5	-105.9	0	0	0	112.7	T57 F59 F69 F76 M96 L97 D98 A102 S103	T57-Y100 HydrophobicContact CG2-CE1 3.73Å; F59-Y100 HydrophobicContact CE2-CE1 4.39Å; F59-Y100 AromaticContact CZ-CE1 3.88Å; F59-Y100 HydrophobicContact CZ-CE1 3.88Å; F59-Y100 AromaticContact CZ-CZ 3.89Å; F59-Y100 WeakPolarHBondContact CZ-OH 3.36Å; F69-Y100 HydrophobicContact CB-CD1 3.68Å; F69-Y100 HydrophobicContact CB-CE1 4.36Å; F69-Y100 HydrophobicContact CB-CG 4.44Å; F69-Y100 HydrophobicContact CD1-CD1 4.16Å; F69-Y100 HydrophobicContact CD2-CD1 4.37Å; F69-Y100 HydrophobicContact CD2-CG 4.33Å; F69-Y100 WeakPolarHBondContact CE1-O 3.36Å; F69-Y100 AromaticContact CG-CD1 3.81Å; F69-Y100 HydrophobicContact CG-CD1 3.81Å; F69-Y100 HydrophobicContact CG-CG 4.2Å; F69-Y100 VanDerWaalsContact CZ-C 3.49Å; F69-Y100 WeakPolarHBondContact CZ-O 3.45Å; F76-Y100 AromaticContact CE1-CD1 3.94Å; F76-Y100 HydrophobicContact CE1-CD1 3.94Å; F76-Y100 HydrophobicContact CE1-CD2 4.44Å; F76-Y100 AromaticContact CE1-CE1 3.88Å; F76-Y100 HydrophobicContact CE1-CE1 3.88Å; F76-Y100 HydrophobicContact CE1-CE2 4.4Å; F76-Y100 HydrophobicContact CE1-CG 4.22Å; F76-Y100 HydrophobicContact CE2-CD2 4.44Å; F76-Y100 HydrophobicContact CE2-CG 4.41Å; F76-Y100 AromaticContact CZ-CD1 3.81Å; F76-Y100 HydrophobicContact CZ-CD1 3.81Å; F76-Y100 AromaticContact CZ-CD2 3.61Å; F76-Y100 HydrophobicContact CZ-CD2 3.61Å; F76-Y100 AromaticContact CZ-CE1 3.99Å; F76-Y100 HydrophobicContact CZ-CE1 3.99Å; F76-Y100 AromaticContact CZ-CE2 3.8Å; F76-Y100 HydrophobicContact CZ-CE2 3.8Å; F76-Y100 AromaticContact CZ-CG 3.6Å; F76-Y100 HydrophobicContact CZ-CG 3.6Å; F76-Y100 AromaticContact CZ-CZ 4Å; M96-Y100 HydrophobicContact CE-CE2 3.74Å; M96-Y100 HydrophobicContact CG-CD2 4.07Å; M96-Y100 HydrophobicContact CG-CE2 3.88Å; M96-Y100 VanDerWaalsContact O-CD2 3.25Å; M96-Y100 WeakPolarHBondContact O-CD2 3.28Å; M96-Y100 PolarHBondContact O-N 3.03Å; L97-Y100 PolarHBondContact O-N 2.98Å; D98-Y100 PolarHBondContact O-N 2.81Å; Y100-A102 VanDerWaalsContact C-N 3.27Å; Y100-A102 PolarHBondContact O-N 3Å; Y100-S103 WeakPolarHBondContact O-CB 3.48Å; Y100-S103 PolarHBondContact O-N 2.9Å; Y100-S103 PolarHBondContact O-OG 3.23Å
101	R	97.1	Very high	95.9	Very high	117 Å²	117	71.9 Å²	71.9	44%	0.442	36%	0.355	S	S	.	.	H	α-helix	trans	-60.5	-36.3	171.8	-72.9	168.4	175.4	162.9	-5.7	112.7	F69 G74 L97 D98 N99 S103	F69-R101 HydrophobicContact CE2-CG 4.18Å; F69-R101 HydrophobicContact CZ-CB 4.45Å; F69-R101 HydrophobicContact CZ-CG 3.92Å; G74-R101 PolarHBondContact O-NE 3.01Å; G74-R101 PolarHBondContact O-NH2 3.33Å; L97-R101 WeakPolarHBondContact O-CG 3.49Å; L97-R101 PolarHBondContact O-N 2.97Å; D98-R101 PolarHBondContact O-N 2.95Å; D98-R101 IonicContact OD1-CZ 2.82Å; D98-R101 IonicContact OD1-NH1 2.66Å; D98-R101 PolarHBondContact OD1-NH1 2.94Å; N99-R101 PolarHBondContact O-N 2.99Å; R101-S103 PolarHBondContact O-N 2.62Å; R101-S103 VanDerWaalsContact O-N 3.13Å
102	A	96.9	Very high	95.4	Very high	40 Å²	40	73.5 Å²	73.5	33%	0.331	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	1	174.3	0	0	0	0	0	114.1	D98 N99 Y100 V104 D105 R106	D98-A102 PolarHBondContact O-N 3.31Å; N99-A102 WeakPolarHBondContact O-CB 3.33Å; N99-A102 PolarHBondContact O-N 2.84Å; Y100-A102 VanDerWaalsContact C-N 3.27Å; Y100-A102 PolarHBondContact O-N 3Å; A102-V104 VanDerWaalsContact C-N 3.32Å; A102-V104 PolarHBondContact O-N 2.75Å; A102-D105 PolarHBondContact O-N 3.42Å; A102-R106 WeakPolarHBondContact O-CG 3.43Å; A102-R106 PolarHBondContact O-N 2.81Å; A102-R106 VanDerWaalsContact O-N 3.17Å; A102-R106 PolarHBondContact O-NE 2.85Å
103	S	96.1	Very high	95	Very high	9 Å²	9	74.9 Å²	74.9	6%	0.063	37%	0.367	C	S	.	.	H	α-helix	trans	-65.7	-31.8	177.6	60.3	0	0	0	0	113.2	S55 Y100 R101 D105 R106 C107	S55-S103 WeakPolarHBondContact CB-OG 3.44Å; S55-S103 PolarHBondContact OG-OG 2.86Å; Y100-S103 WeakPolarHBondContact O-CB 3.48Å; Y100-S103 PolarHBondContact O-N 2.9Å; Y100-S103 PolarHBondContact O-OG 3.23Å; R101-S103 PolarHBondContact O-N 2.62Å; R101-S103 VanDerWaalsContact O-N 3.13Å; S103-D105 PolarHBondContact O-N 2.02Å; S103-R106 PolarHBondContact O-N 3.21Å; S103-C107 PolarHBondContact O-N 2.9Å; S103-C107 PolarHBondContact O-SG 3.32Å
104	V	95.1	Very high	94.6	Very high	21 Å²	21	74.3 Å²	74.3	13%	0.127	37%	0.368	C	S	.	.	H	α-helix	trans	-61.3	-46.7	176.5	176.5	0	0	0	0	110.6	V53 S55 S71 A102 R106 C107 R108	V53-V104 HydrophobicContact CB-CG1 4.34Å; S55-V104 WeakPolarHBondContact OG-CG2 3.44Å; S71-V104 VanDerWaalsContact CB-CG2 3.43Å; A102-V104 VanDerWaalsContact C-N 3.32Å; A102-V104 PolarHBondContact O-N 2.75Å; V104-R106 VanDerWaalsContact C-N 3.32Å; V104-R106 PolarHBondContact O-N 3.38Å; V104-C107 WeakPolarHBondContact O-CB 3.45Å; V104-C107 PolarHBondContact O-N 3.05Å; V104-R108 WeakPolarHBondContact O-CG 3.44Å; V104-R108 PolarHBondContact O-N 3.29Å
105	D	95	Very high	94.2	Very high	82 Å²	82	70.1 Å²	70.1	44%	0.439	35%	0.353	S	S	.	.	H	α-helix	trans	-68	-35.3	179.1	-64.2	-30.6	0	0	0	111.5	A102 S103 C107 R108 N109	A102-D105 PolarHBondContact O-N 3.42Å; S103-D105 PolarHBondContact O-N 2.02Å; D105-C107 PolarHBondContact O-N 3.29Å; D105-R108 PolarHBondContact O-N 3.39Å; D105-R108 IonicContact OD1-NH1 3.26Å; D105-R108 PolarHBondContact OD1-NH1 3.24Å; D105-R108 VanDerWaalsContact OD1-NH1 3.08Å; D105-N109 WeakPolarHBondContact O-CB 3.36Å; D105-N109 PolarHBondContact O-N 3.07Å; D105-N109 PolarHBondContact O-ND2 3.26Å; D105-N109 PolarHBondContact O-OD1 3.15Å
106	R	94.4	Very high	93.8	Very high	112 Å²	112	68.4 Å²	68.4	42%	0.423	34%	0.343	S	S	.	.	H	α-helix	trans	-60.7	-43.3	170.2	-72.6	-177.6	-83.8	145.6	-10.4	112.1	N99 A102 S103 V104 N109 N110	N99-R106 PolarHBondContact O-NH2 3.41Å; N99-R106 PolarHBondContact OD1-NH2 3.27Å; A102-R106 WeakPolarHBondContact O-CG 3.43Å; A102-R106 PolarHBondContact O-N 2.81Å; A102-R106 VanDerWaalsContact O-N 3.17Å; A102-R106 PolarHBondContact O-NE 2.85Å; S103-R106 PolarHBondContact O-N 3.21Å; V104-R106 VanDerWaalsContact C-N 3.32Å; V104-R106 PolarHBondContact O-N 3.38Å; R106-N109 PolarHBondContact O-N 3.18Å; R106-N110 PolarHBondContact O-N 3.08Å; R106-N110 PolarHBondContact O-ND2 2.63Å; R106-N110 VanDerWaalsContact O-ND2 3.15Å
107	C	95	Very high	93.4	Very high	4 Å²	4	71.9 Å²	71.9	3%	0.027	36%	0.356	C	S	.	.	H	α-helix	trans	-61.4	-47.5	174	-65.3	0	0	0	0	111.2	C44 Y46 V53 S103 V104 D105 N109 N110 Y111	C44-C107 HydrophobicContact CB-CB 3.61Å; C44-C107 WeakPolarHBondContact CB-SG 3.24Å; C44-C107 WeakPolarHBondContact SG-CB 3.43Å; C44-C107 CovalentContact SG-SG 2.02Å; C44-C107 PolarHBondContact SG-SG 3.47Å; Y46-C107 HydrophobicContact CE1-CB 4.26Å; Y46-C107 PolarHBondContact OH-O 3.25Å; V53-C107 HydrophobicContact CG1-CB 3.57Å; S103-C107 PolarHBondContact O-N 2.9Å; S103-C107 PolarHBondContact O-SG 3.32Å; V104-C107 WeakPolarHBondContact O-CB 3.45Å; V104-C107 PolarHBondContact O-N 3.05Å; D105-C107 PolarHBondContact O-N 3.29Å; C107-N109 VanDerWaalsContact C-N 3.35Å; C107-N109 PolarHBondContact O-N 3.38Å; C107-N110 PolarHBondContact O-N 3.46Å; C107-N110 VanDerWaalsContact O-N 3.12Å; C107-Y111 PolarHBondContact O-N 3.25Å; C107-Y111 VanDerWaalsContact O-N 3.09Å
108	R	94.1	Very high	92.9	Very high	95 Å²	95	75 Å²	75	36%	0.358	37%	0.372	S	S	.	.	H	α-helix	trans	-57.8	-45.5	177.4	-70.6	178.1	172.3	147.8	-5	112.6	R50 E51 V53 V104 D105 N110 Y111	R50-R108 WeakPolarHBondContact O-CG 3.39Å; E51-R108 PolarHBondContact O-NH2 2.87Å; V53-R108 HydrophobicContact CB-CG 4.3Å; V53-R108 HydrophobicContact CG2-CG 3.93Å; V104-R108 WeakPolarHBondContact O-CG 3.44Å; V104-R108 PolarHBondContact O-N 3.29Å; D105-R108 PolarHBondContact O-N 3.39Å; D105-R108 IonicContact OD1-NH1 3.26Å; D105-R108 PolarHBondContact OD1-NH1 3.24Å; D105-R108 VanDerWaalsContact OD1-NH1 3.08Å; R108-N110 PolarHBondContact O-N 2.94Å; R108-Y111 VanDerWaalsContact O-CB 3.25Å; R108-Y111 WeakPolarHBondContact O-CB 3.3Å; R108-Y111 PolarHBondContact O-N 3.36Å
109	N	92.4	Very high	92.4	Very high	129 Å²	129	74.8 Å²	74.8	69%	0.69	37%	0.374	S	S	*	.	H	α-helix	trans	-64.3	-26.9	179.8	-68.7	-12.9	0	0	0	112.5	D105 R106 C107	D105-N109 WeakPolarHBondContact O-CB 3.36Å; D105-N109 PolarHBondContact O-N 3.07Å; D105-N109 PolarHBondContact O-ND2 3.26Å; D105-N109 PolarHBondContact O-OD1 3.15Å; R106-N109 PolarHBondContact O-N 3.18Å; C107-N109 VanDerWaalsContact C-N 3.35Å; C107-N109 PolarHBondContact O-N 3.38Å
110	N	91.8	Very high	92	Very high	85 Å²	85	76.6 Å²	76.6	46%	0.455	38%	0.384	S	S	.	.	H	α-helix	trans	-86.3	-13.6	175.3	-70.2	-30.7	0	0	0	113.3	R106 C107 R108 D112 L113 V114	R106-N110 PolarHBondContact O-N 3.08Å; R106-N110 PolarHBondContact O-ND2 2.63Å; R106-N110 VanDerWaalsContact O-ND2 3.15Å; C107-N110 PolarHBondContact O-N 3.46Å; C107-N110 VanDerWaalsContact O-N 3.12Å; R108-N110 PolarHBondContact O-N 2.94Å; N110-D112 PolarHBondContact O-N 2.84Å; N110-L113 PolarHBondContact O-N 3.13Å; N110-V114 WeakPolarHBondContact O-CG2 3.03Å; N110-V114 PolarHBondContact O-N 3.5Å; N110-V114 VanDerWaalsContact O-N 3.08Å
111	Y	92.5	Very high	91.7	Very high	44 Å²	44	78.9 Å²	78.9	17%	0.173	40%	0.398	C	S	.	.	H	α-helix	trans	-56.9	-49.5	-173.1	179.7	-93	0	0	0	112	Y46 G49 R50 C107 R108 L113 V114 D115	Y46-Y111 AromaticContact CD1-CD2 3.33Å; Y46-Y111 HydrophobicContact CD1-CD2 3.33Å; Y46-Y111 AromaticContact CD1-CE2 3.96Å; Y46-Y111 HydrophobicContact CD1-CE2 3.96Å; Y46-Y111 HydrophobicContact CD1-CG 4.32Å; Y46-Y111 HydrophobicContact CD2-CD2 4.42Å; Y46-Y111 AromaticContact CE1-CD2 3.63Å; Y46-Y111 HydrophobicContact CE1-CD2 3.63Å; Y46-Y111 HydrophobicContact CE1-CG 4.31Å; Y46-Y111 AromaticContact CG-CD2 3.78Å; Y46-Y111 HydrophobicContact CG-CD2 3.78Å; Y46-Y111 HydrophobicContact CG-CE2 4.03Å; G49-Y111 WeakPolarHBondContact CA-OH 3.2Å; R50-Y111 HydrophobicContact CB-CD1 3.56Å; R50-Y111 HydrophobicContact CB-CD2 4.35Å; R50-Y111 HydrophobicContact CB-CE1 4.18Å; R50-Y111 HydrophobicContact CB-CG 3.66Å; C107-Y111 PolarHBondContact O-N 3.25Å; C107-Y111 VanDerWaalsContact O-N 3.09Å; R108-Y111 VanDerWaalsContact O-CB 3.25Å; R108-Y111 WeakPolarHBondContact O-CB 3.3Å; R108-Y111 PolarHBondContact O-N 3.36Å; Y111-L113 VanDerWaalsContact C-N 3.26Å; Y111-L113 PolarHBondContact O-N 3.22Å; Y111-V114 CarbonylContact O-C 3.45Å; Y111-V114 PolarHBondContact O-N 2.93Å; Y111-V114 VanDerWaalsContact O-N 3.07Å; Y111-D115 HydrophobicContact CD1-CB 4.14Å; Y111-D115 HydrophobicContact CE1-CB 3.68Å; Y111-D115 VanDerWaalsContact O-CB 3.3Å; Y111-D115 WeakPolarHBondContact O-CB 3.39Å; Y111-D115 PolarHBondContact O-N 3.25Å; Y111-D115 PolarHBondContact OH-OD1 3.21Å
112	D	89.1	Confident	91.5	Very high	83 Å²	83	80.8 Å²	80.8	44%	0.444	41%	0.409	S	S	.	.	H	α-helix	trans	-61.6	-36.8	-174.7	-63.7	-18.5	0	0	0	111.6	N110 I116	N110-D112 PolarHBondContact O-N 2.84Å; D112-I116 WeakPolarHBondContact O-CB 3.39Å; D112-I116 WeakPolarHBondContact O-CD1 3.03Å; D112-I116 WeakPolarHBondContact O-CG1 3.37Å; D112-I116 PolarHBondContact O-N 2.91Å
113	L	89.4	Confident	91.5	Very high	128 Å²	128	81 Å²	81	67%	0.67	41%	0.411	S	S	*	.	H	α-helix	trans	-66.6	-45.2	175	-179.2	65.2	0	0	0	111.6	N110 Y111 F117	N110-L113 PolarHBondContact O-N 3.13Å; Y111-L113 VanDerWaalsContact C-N 3.26Å; Y111-L113 PolarHBondContact O-N 3.22Å; L113-F117 WeakPolarHBondContact O-CB 3.44Å; L113-F117 PolarHBondContact O-N 3.36Å; L113-F117 VanDerWaalsContact O-N 3.13Å
114	V	88	Confident	91.5	Very high	62 Å²	62	89.8 Å²	89.8	38%	0.376	45%	0.448	S	S	.	.	H	α-helix	trans	-63.9	-45.6	177.4	173.8	0	0	0	0	110.5	N110 Y111 F117 M118	N110-V114 WeakPolarHBondContact O-CG2 3.03Å; N110-V114 PolarHBondContact O-N 3.5Å; N110-V114 VanDerWaalsContact O-N 3.08Å; Y111-V114 CarbonylContact O-C 3.45Å; Y111-V114 PolarHBondContact O-N 2.93Å; Y111-V114 VanDerWaalsContact O-N 3.07Å; V114-F117 PolarHBondContact O-N 3.2Å; V114-M118 HydrophobicContact CG1-CG 3.88Å; V114-M118 VanDerWaalsContact O-CB 3.3Å; V114-M118 WeakPolarHBondContact O-CB 3.3Å; V114-M118 WeakPolarHBondContact O-CG 3.42Å; V114-M118 PolarHBondContact O-N 3.47Å
115	D	89.6	Confident	91.6	Very high	61 Å²	61	92 Å²	92	33%	0.326	46%	0.463	S	S	.	.	H	α-helix	trans	-62.4	-45.8	-178	-171.5	82.8	0	0	0	111.6	Y111 F117 S119	Y111-D115 HydrophobicContact CD1-CB 4.14Å; Y111-D115 HydrophobicContact CE1-CB 3.68Å; Y111-D115 VanDerWaalsContact O-CB 3.3Å; Y111-D115 WeakPolarHBondContact O-CB 3.39Å; Y111-D115 PolarHBondContact O-N 3.25Å; Y111-D115 PolarHBondContact OH-OD1 3.21Å; D115-F117 PolarHBondContact O-N 3.03Å; D115-S119 WeakPolarHBondContact O-CB 3.4Å; D115-S119 PolarHBondContact O-N 3.3Å; D115-S119 PolarHBondContact O-OG 3.38Å
116	I	88.9	Confident	91.7	Very high	105 Å²	105	94 Å²	94	54%	0.538	47%	0.467	S	S	.	.	H	α-helix	trans	-60.6	-47.4	175.1	-69.8	166.4	0	0	0	110.6	D112 N120	D112-I116 WeakPolarHBondContact O-CB 3.39Å; D112-I116 WeakPolarHBondContact O-CD1 3.03Å; D112-I116 WeakPolarHBondContact O-CG1 3.37Å; D112-I116 PolarHBondContact O-N 2.91Å; I116-N120 WeakPolarHBondContact O-CB 3.19Å; I116-N120 VanDerWaalsContact O-CG 3.32Å; I116-N120 PolarHBondContact O-N 2.59Å; I116-N120 PolarHBondContact O-ND2 3.17Å
117	F	86.9	Confident	91.9	Very high	141 Å²	141	92.6 Å²	92.6	62%	0.618	47%	0.471	S	S	*	.	H	α-helix	trans	-63.3	-50.8	-178.8	-177.3	-97.1	0	0	0	111.5	L113 V114 D115 N120 L121	L113-F117 WeakPolarHBondContact O-CB 3.44Å; L113-F117 PolarHBondContact O-N 3.36Å; L113-F117 VanDerWaalsContact O-N 3.13Å; V114-F117 PolarHBondContact O-N 3.2Å; D115-F117 PolarHBondContact O-N 3.03Å; F117-N120 PolarHBondContact O-N 3Å; F117-L121 PolarHBondContact O-N 2.65Å
118	M	87.6	Confident	92	Very high	80 Å²	80	95.6 Å²	95.6	39%	0.394	49%	0.49	S	S	.	.	H	α-helix	trans	-71.4	-35.5	-174.9	-61.9	-63	-74.4	0	0	112.5	V114 N120 L121 Y151	V114-M118 HydrophobicContact CG1-CG 3.88Å; V114-M118 VanDerWaalsContact O-CB 3.3Å; V114-M118 WeakPolarHBondContact O-CB 3.3Å; V114-M118 WeakPolarHBondContact O-CG 3.42Å; V114-M118 PolarHBondContact O-N 3.47Å; M118-N120 VanDerWaalsContact C-N 3.29Å; M118-N120 PolarHBondContact O-N 3.45Å; M118-L121 PolarHBondContact O-N 3.46Å; M118-Y151 WeakPolarHBondContact CE-OH 3.45Å
119	S	87.1	Confident	92.1	Very high	54 Å²	54	94.9 Å²	94.9	38%	0.378	50%	0.496	S	S	.	.	H	α-helix	trans	-69.3	-27.5	178.3	-68.2	0	0	0	0	113.5	D115 K122	D115-S119 WeakPolarHBondContact O-CB 3.4Å; D115-S119 PolarHBondContact O-N 3.3Å; D115-S119 PolarHBondContact O-OG 3.38Å; S119-K122 WeakPolarHBondContact O-CE 3.44Å; S119-K122 PolarHBondContact O-NZ 3.28Å
120	N	88.4	Confident	92	Very high	126 Å²	126	93.7 Å²	93.7	67%	0.674	48%	0.482	S	S	*	.	H	α-helix	trans	-84.5	-21.8	176.4	-73.1	-44.4	0	0	0	112.6	I116 F117 M118 K122	I116-N120 WeakPolarHBondContact O-CB 3.19Å; I116-N120 VanDerWaalsContact O-CG 3.32Å; I116-N120 PolarHBondContact O-N 2.59Å; I116-N120 PolarHBondContact O-ND2 3.17Å; F117-N120 PolarHBondContact O-N 3Å; M118-N120 VanDerWaalsContact C-N 3.29Å; M118-N120 PolarHBondContact O-N 3.45Å; N120-K122 PolarHBondContact O-N 2.86Å
121	L	90.9	Very high	92	Very high	78 Å²	78	93.5 Å²	93.5	41%	0.408	49%	0.486	S	S	.	.			trans	-74.8	92.7	173.4	-167.7	65.2	0	0	0	108.8	F117 M118 Y151	F117-L121 PolarHBondContact O-N 2.65Å; M118-L121 PolarHBondContact O-N 3.46Å; L121-Y151 HydrophobicContact CB-CD1 4.23Å; L121-Y151 HydrophobicContact CB-CE1 4.18Å; L121-Y151 HydrophobicContact CD2-CD1 3.98Å; L121-Y151 HydrophobicContact CD2-CE1 3.69Å; L121-Y151 HydrophobicContact CD2-CE2 4.25Å; L121-Y151 HydrophobicContact CD2-CG 4.37Å; L121-Y151 HydrophobicContact CG-CD1 3.81Å; L121-Y151 HydrophobicContact CG-CE1 3.95Å; L121-Y151 HydrophobicContact CG-CG 4.3Å; L121-Y151 WeakPolarHBondContact O-CD1 3.48Å
122	K	93.3	Very high	91.5	Very high	157 Å²	157	94.1 Å²	94.1	68%	0.683	50%	0.496	S	S	*	.			trans	-136.1	127.4	176.4	-71.2	176.7	178.6	159.8	0	109.5	S119 N120 Y151	S119-K122 WeakPolarHBondContact O-CE 3.44Å; S119-K122 PolarHBondContact O-NZ 3.28Å; N120-K122 PolarHBondContact O-N 2.86Å; K122-Y151 WeakPolarHBondContact CA-O 3.25Å
123	A	95.1	Very high	90.8	Very high	44 Å²	44	95.5 Å²	95.5	36%	0.364	50%	0.499	S	S	.	.	B	Isolated β-bridge	trans	-123	130	173.6	0	0	0	0	0	108.9	D149 F150 Y151	A123-D149 WeakPolarHBondContact CB-O 3.37Å; A123-F150 WeakPolarHBondContact O-CA 3.41Å; A123-Y151 PolarHBondContact N-O 3.04Å; A123-Y151 PolarHBondContact O-N 2.87Å; A123-Y151 VanDerWaalsContact O-N 3.16Å
124	K	96.3	Very high	89.3	Confident	195 Å²	195	96.1 Å²	96.1	85%	0.848	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-76.2	137.9	178.4	-70.1	-176.6	179.1	179.2	0	109.3	K126 D149	K124-K126 PolarHBondContact O-N 3.5Å; K124-D149 VanDerWaalsContact O-O 3.13Å
125	P	97.8	Very high	87.8	Confident	66 Å²	66	100.5 Å²	100.5	43%	0.429	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-63.5	137.3	178.8	24.8	-32.6	0	0	0	112.1	V127 V147 S148 F150 I155	P125-V127 HydrophobicContact CB-CG2 4.46Å; P125-V147 HydrophobicContact CB-CG1 3.53Å; P125-S148 WeakPolarHBondContact CA-O 3.21Å; P125-F150 HydrophobicContact CB-CB 3.84Å; P125-F150 HydrophobicContact CB-CD1 4.42Å; P125-F150 HydrophobicContact CB-CG 4.34Å; P125-I155 HydrophobicContact CB-CD1 4.31Å
126	K	97.9	Very high	86.2	Confident	124 Å²	124	103.4 Å²	103.4	54%	0.539	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	123.1	163.5	-176.9	-179.4	177.3	-175.4	0	108.4	K124 V147 S148 D149	K124-K126 PolarHBondContact O-N 3.5Å; K126-V147 WeakPolarHBondContact O-CA 3.5Å; K126-S148 PolarHBondContact N-O 3.41Å; K126-S148 PolarHBondContact O-N 3.46Å; K126-D149 HydrophobicContact CB-CB 4.49Å
127	V	98	Very high	84.7	Confident	83 Å²	83	105.8 Å²	105.8	50%	0.503	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.5	130.6	-176.6	-176.4	0	0	0	0	109.6	P125 V129 S146 V147	P125-V127 HydrophobicContact CB-CG2 4.46Å; V127-V129 HydrophobicContact CG1-CG2 4.49Å; V127-S146 WeakPolarHBondContact CA-O 3.48Å; V127-V147 HydrophobicContact CG1-CG2 4.45Å; V127-V147 HydrophobicContact CG2-CG1 4.27Å; V127-V147 HydrophobicContact CG2-CG2 4.27Å
128	T	96.7	Very high	83.2	Confident	68 Å²	68	104.6 Å²	104.6	42%	0.417	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-135.7	128.4	174.1	-55.4	0	0	0	0	109.6	Y130 S146	T128-Y130 HydrophobicContact CG2-CD1 4.09Å; T128-S146 PolarHBondContact N-O 3.44Å; T128-S146 PolarHBondContact O-N 3.17Å
129	V	95.8	Very high	81.6	Confident	80 Å²	80	111.4 Å²	111.4	49%	0.485	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.2	126.6	-180	-178.7	0	0	0	0	109.4	V127 L143 V144 C145 W159	V127-V129 HydrophobicContact CG1-CG2 4.49Å; V129-L143 HydrophobicContact CG1-CD1 3.82Å; V129-L143 HydrophobicContact CG1-CD2 3.84Å; V129-L143 HydrophobicContact CG1-CG 3.72Å; V129-V144 VanDerWaalsContact CA-O 3.28Å; V129-V144 WeakPolarHBondContact CA-O 3.49Å; V129-C145 HydrophobicContact CG2-CB 4.38Å; V129-W159 HydrophobicContact CG1-CH2 4.16Å; V129-W159 HydrophobicContact CG1-CZ3 4.27Å
130	Y	91.8	Very high	80.4	Confident	103 Å²	103	116.2 Å²	116.2	40%	0.404	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-154.4	152.4	-177.4	60.7	-85.8	0	0	0	111.8	T128 V144	T128-Y130 HydrophobicContact CG2-CD1 4.09Å; Y130-V144 HydrophobicContact CD2-CB 4.32Å; Y130-V144 HydrophobicContact CE1-CB 4.16Å; Y130-V144 HydrophobicContact CE1-CG1 4Å; Y130-V144 HydrophobicContact CE2-CB 3.93Å; Y130-V144 HydrophobicContact CE2-CG1 4.23Å; Y130-V144 HydrophobicContact CE2-CG2 4.24Å; Y130-V144 PolarHBondContact N-O 3.17Å; Y130-V144 PolarHBondContact O-N 3.5Å
131	P	90.8	Very high	79.6	Confident	81 Å²	81	118 Å²	118	53%	0.526	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.5	137	173.5	28.8	-33.9	0	0	0	110.4	K133	P131-K133 PolarHBondContact O-N 3.45Å
132	S	82.6	Confident	79.3	Confident	57 Å²	57	118.7 Å²	118.7	40%	0.399	61%	0.608	S	S	.	*	S	Bend	trans	-62.2	-30.4	-179	179.2	0	0	0	0	113.3	L142	S132-L142 WeakPolarHBondContact CB-O 3.37Å; S132-L142 PolarHBondContact N-O 3.4Å
133	K	74.1	Confident	79.3	Confident	113 Å²	113	115.4 Å²	115.4	49%	0.491	60%	0.598	S	S	.	*			trans	-135.7	147.2	-178.5	-65.2	-175.5	177.9	-179.1	0	110.6	P131 E138	P131-K133 PolarHBondContact O-N 3.45Å; K133-E138 IonicContact NZ-OE2 3.69Å; K133-E138 PolarHBondContact NZ-OE2 2.89Å
134	T	58.3	Low	79.2	Confident	141 Å²	141	115 Å²	115	87%	0.865	59%	0.591	S	S	*	*	S	Bend	trans	-98.6	-6	176.9	46.7	0	0	0	0	113.5
135	Q	56.4	Low	79.2	Confident	153 Å²	153	107.4 Å²	107.4	72%	0.715	56%	0.561	S	S	*	*			trans	-100.5	132	-176.1	-74	-174.7	10.7	0	0	112.9	L137	Q135-L137 VanDerWaalsContact C-N 3.32Å; Q135-L137 PolarHBondContact O-N 3.3Å
136	P	55.9	Low	79.1	Confident	123 Å²	123	106.6 Å²	106.6	80%	0.799	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-7.5	-171.5	-19.8	31.7	0	0	0	117.8
137	L	56.9	Low	79.1	Confident	154 Å²	154	102.1 Å²	102.1	81%	0.806	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	5.1	-159.6	-84.3	158.6	0	0	0	115.9	Q135	Q135-L137 VanDerWaalsContact C-N 3.32Å; Q135-L137 PolarHBondContact O-N 3.3Å
138	E	56.7	Low	79.1	Confident	117 Å²	117	100 Å²	100	55%	0.547	53%	0.529	S	S	.	.	S	Bend	trans	-120.4	128.9	178.2	-70.7	-174.1	167.6	0	0	111.4	K133 H140	K133-E138 IonicContact NZ-OE2 3.69Å; K133-E138 PolarHBondContact NZ-OE2 2.89Å; E138-H140 PolarHBondContact O-N 3.12Å
139	Y	53.3	Low	79	Confident	222 Å²	222	101 Å²	101	87%	0.871	53%	0.532	S	S	*	.	S	Bend	trans	-62.7	14.1	-157	-69.6	-88.1	0	0	0	118.5
140	H	60.8	Low	79.1	Confident	156 Å²	156	99.4 Å²	99.4	72%	0.722	52%	0.518	S	S	*	.			trans	-133.6	98.6	177.8	-57.6	-55	0	0	0	111.8	E138 L142	E138-H140 PolarHBondContact O-N 3.12Å; H140-L142 PolarHBondContact O-N 3.09Å
141	N	72.1	Confident	79.3	Confident	163 Å²	163	98.9 Å²	98.9	87%	0.872	52%	0.516	S	S	*	.			trans	-74.6	76.2	167.2	-71.1	-22.3	0	0	0	109.4
142	L	85.9	Confident	79.5	Confident	92 Å²	92	98.1 Å²	98.1	48%	0.482	51%	0.512	S	S	.	.			trans	-79.6	132.6	178	-176.4	72.4	0	0	0	110.3	S132 H140 V144	S132-L142 WeakPolarHBondContact CB-O 3.37Å; S132-L142 PolarHBondContact N-O 3.4Å; H140-L142 PolarHBondContact O-N 3.09Å; L142-V144 HydrophobicContact CD2-CG2 4.23Å; L142-V144 HydrophobicContact CG-CG2 4.44Å
143	L	91.3	Very high	80	Confident	89 Å²	89	96.9 Å²	96.9	47%	0.466	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.2	168.3	-164.9	64.1	0	0	0	108.6	V129 W159	V129-L143 HydrophobicContact CG1-CD1 3.82Å; V129-L143 HydrophobicContact CG1-CD2 3.84Å; V129-L143 HydrophobicContact CG1-CG 3.72Å; L143-W159 HydrophobicContact CB-CH2 4.04Å; L143-W159 HydrophobicContact CB-CZ3 4.35Å; L143-W159 HydrophobicContact CD2-CE3 4.37Å; L143-W159 HydrophobicContact CD2-CH2 3.79Å; L143-W159 HydrophobicContact CD2-CZ3 3.37Å; L143-W159 HydrophobicContact CG-CH2 3.68Å; L143-W159 HydrophobicContact CG-CZ3 3.85Å
144	V	94	Very high	81	Confident	36 Å²	36	98 Å²	98	22%	0.218	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126.2	-179.2	-176.9	0	0	0	0	108.5	V129 Y130 L142	V129-V144 VanDerWaalsContact CA-O 3.28Å; V129-V144 WeakPolarHBondContact CA-O 3.49Å; Y130-V144 HydrophobicContact CD2-CB 4.32Å; Y130-V144 HydrophobicContact CE1-CB 4.16Å; Y130-V144 HydrophobicContact CE1-CG1 4Å; Y130-V144 HydrophobicContact CE2-CB 3.93Å; Y130-V144 HydrophobicContact CE2-CG1 4.23Å; Y130-V144 HydrophobicContact CE2-CG2 4.24Å; Y130-V144 PolarHBondContact N-O 3.17Å; Y130-V144 PolarHBondContact O-N 3.5Å; L142-V144 HydrophobicContact CD2-CG2 4.23Å; L142-V144 HydrophobicContact CG-CG2 4.44Å
145	C	95.9	Very high	82.8	Confident	35 Å²	35	94.6 Å²	94.6	24%	0.236	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	102.3	165.1	-179.6	0	0	0	0	107.3	V129 W159	V129-C145 HydrophobicContact CG2-CB 4.38Å; C145-W159 HydrophobicContact CB-CH2 3.58Å; C145-W159 HydrophobicContact CB-CZ2 3.26Å
146	S	96.3	Very high	84.6	Confident	49 Å²	49	93.8 Å²	93.8	34%	0.343	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	116.9	175.3	-175.5	0	0	0	0	108.8	V127 T128	V127-S146 WeakPolarHBondContact CA-O 3.48Å; T128-S146 PolarHBondContact N-O 3.44Å; T128-S146 PolarHBondContact O-N 3.17Å
147	V	97.9	Very high	86.5	Confident	29 Å²	29	92 Å²	92	18%	0.176	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	113.8	177.4	-171.6	0	0	0	0	108.9	P125 K126 V127 F150 I155 I157	P125-V147 HydrophobicContact CB-CG1 3.53Å; K126-V147 WeakPolarHBondContact O-CA 3.5Å; V127-V147 HydrophobicContact CG1-CG2 4.45Å; V127-V147 HydrophobicContact CG2-CG1 4.27Å; V127-V147 HydrophobicContact CG2-CG2 4.27Å; V147-F150 HydrophobicContact CG1-CD1 4.13Å; V147-F150 HydrophobicContact CG1-CE1 4.21Å; V147-I155 HydrophobicContact CG1-CD1 3.53Å; V147-I157 HydrophobicContact CB-CD1 4.06Å; V147-I157 HydrophobicContact CG2-CD1 3.61Å; V147-I157 HydrophobicContact CG2-CG1 4.21Å
148	S	97.2	Very high	88.4	Confident	38 Å²	38	91 Å²	91	27%	0.266	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	172.6	-174.8	67.2	0	0	0	0	112.3	P125 K126 F150	P125-S148 WeakPolarHBondContact CA-O 3.21Å; K126-S148 PolarHBondContact N-O 3.41Å; K126-S148 PolarHBondContact O-N 3.46Å; S148-F150 PolarHBondContact O-N 3.36Å
149	D	96	Very high	90.3	Very high	90 Å²	90	88.4 Å²	88.4	48%	0.481	45%	0.45	S	S	.	.	S	Bend	trans	59.8	38.4	167.3	-44.5	-41	0	0	0	114.3	A123 K124 K126	A123-D149 WeakPolarHBondContact CB-O 3.37Å; K124-D149 VanDerWaalsContact O-O 3.13Å; K126-D149 HydrophobicContact CB-CB 4.49Å
150	F	96.6	Very high	92.4	Very high	46 Å²	46	83.5 Å²	83.5	20%	0.202	43%	0.433	C	S	.	.			trans	-119.1	151.3	-179.9	67.8	-82.5	0	0	0	112.9	A123 P125 V147 S148 P152 I155 L175	A123-F150 WeakPolarHBondContact O-CA 3.41Å; P125-F150 HydrophobicContact CB-CB 3.84Å; P125-F150 HydrophobicContact CB-CD1 4.42Å; P125-F150 HydrophobicContact CB-CG 4.34Å; V147-F150 HydrophobicContact CG1-CD1 4.13Å; V147-F150 HydrophobicContact CG1-CE1 4.21Å; S148-F150 PolarHBondContact O-N 3.36Å; F150-P152 WeakPolarHBondContact CD2-O 3.31Å; F150-I155 HydrophobicContact CD1-CD1 4.29Å; F150-I155 HydrophobicContact CD2-CB 4.37Å; F150-I155 HydrophobicContact CD2-CD1 4.08Å; F150-I155 HydrophobicContact CE1-CD1 4.21Å; F150-I155 HydrophobicContact CE2-CB 3.8Å; F150-I155 HydrophobicContact CE2-CD1 3.97Å; F150-I155 HydrophobicContact CE2-CG2 3.76Å; F150-I155 HydrophobicContact CG-CD1 4.24Å; F150-I155 HydrophobicContact CZ-CB 4.27Å; F150-I155 HydrophobicContact CZ-CD1 4.05Å; F150-I155 HydrophobicContact CZ-CG2 3.8Å; F150-L175 HydrophobicContact CE2-CD1 4Å; F150-L175 HydrophobicContact CZ-CD1 3.53Å
151	Y	95.6	Very high	94	Very high	92 Å²	92	84 Å²	84	36%	0.361	43%	0.429	S	S	.	.	B	Isolated β-bridge	trans	-153.6	139.7	172.9	-168.8	-81	0	0	0	109.2	M118 L121 K122 A123	M118-Y151 WeakPolarHBondContact CE-OH 3.45Å; L121-Y151 HydrophobicContact CB-CD1 4.23Å; L121-Y151 HydrophobicContact CB-CE1 4.18Å; L121-Y151 HydrophobicContact CD2-CD1 3.98Å; L121-Y151 HydrophobicContact CD2-CE1 3.69Å; L121-Y151 HydrophobicContact CD2-CE2 4.25Å; L121-Y151 HydrophobicContact CD2-CG 4.37Å; L121-Y151 HydrophobicContact CG-CD1 3.81Å; L121-Y151 HydrophobicContact CG-CE1 3.95Å; L121-Y151 HydrophobicContact CG-CG 4.3Å; L121-Y151 WeakPolarHBondContact O-CD1 3.48Å; K122-Y151 WeakPolarHBondContact CA-O 3.25Å; A123-Y151 PolarHBondContact N-O 3.04Å; A123-Y151 PolarHBondContact O-N 2.87Å; A123-Y151 VanDerWaalsContact O-N 3.16Å
152	P	94.9	Very high	95.2	Very high	66 Å²	66	84 Å²	84	43%	0.429	43%	0.428	S	S	.	.	S	Bend	cis	-73	173	-0.4	32.1	-37.1	0	0	0	113.2	F150 T154	F150-P152 WeakPolarHBondContact CD2-O 3.31Å; P152-T154 PolarHBondContact O-N 3.48Å
153	G	94.4	Very high	95.6	Very high	31 Å²	31	82.7 Å²	82.7	32%	0.32	44%	0.437	S	S	.	.	S	Bend	trans	-68	-11.1	-175.7	0	0	0	0	0	116.1	I155	G153-I155 PolarHBondContact O-N 3.27Å
154	T	94	Very high	95.9	Very high	135 Å²	135	85.5 Å²	85.5	83%	0.828	45%	0.448	S	S	*	.			trans	-70.9	113.7	176.4	-53.5	0	0	0	0	109.9	P152	P152-T154 PolarHBondContact O-N 3.48Å
155	I	95.8	Very high	96	Very high	71 Å²	71	87.6 Å²	87.6	36%	0.364	46%	0.456	S	S	.	.			trans	-143.7	152.5	-179.4	-166.8	163.5	0	0	0	110.9	P125 V147 F150 G153 I157	P125-I155 HydrophobicContact CB-CD1 4.31Å; V147-I155 HydrophobicContact CG1-CD1 3.53Å; F150-I155 HydrophobicContact CD1-CD1 4.29Å; F150-I155 HydrophobicContact CD2-CB 4.37Å; F150-I155 HydrophobicContact CD2-CD1 4.08Å; F150-I155 HydrophobicContact CE1-CD1 4.21Å; F150-I155 HydrophobicContact CE2-CB 3.8Å; F150-I155 HydrophobicContact CE2-CD1 3.97Å; F150-I155 HydrophobicContact CE2-CG2 3.76Å; F150-I155 HydrophobicContact CG-CD1 4.24Å; F150-I155 HydrophobicContact CZ-CB 4.27Å; F150-I155 HydrophobicContact CZ-CD1 4.05Å; F150-I155 HydrophobicContact CZ-CG2 3.8Å; G153-I155 PolarHBondContact O-N 3.27Å; I155-I157 HydrophobicContact CD1-CG1 4.48Å; I155-I157 HydrophobicContact CG1-CG1 4.32Å
156	E	95.7	Very high	96	Very high	135 Å²	135	89.2 Å²	89.2	63%	0.631	46%	0.46	S	S	*	.			trans	-125.3	127	172.7	-172.3	178.8	-171.8	0	0	109.3	R158	E156-R158 VanDerWaalsContact CD-NE 3.33Å; E156-R158 HydrophobicContact CG-CG 4.36Å; E156-R158 IonicContact OE1-CZ 3.55Å; E156-R158 IonicContact OE1-NE 3.76Å; E156-R158 PolarHBondContact OE1-NE 3.2Å; E156-R158 IonicContact OE1-NH2 3.07Å; E156-R158 PolarHBondContact OE1-NH2 3.33Å; E156-R158 IonicContact OE2-CZ 2.78Å; E156-R158 IonicContact OE2-NE 3.47Å; E156-R158 IonicContact OE2-NH2 3.31Å; E156-R158 PolarHBondContact OE2-NH2 2.92Å
157	I	96.1	Very high	95.9	Very high	86 Å²	86	93.8 Å²	93.8	44%	0.441	47%	0.474	S	S	.	.			trans	-121.9	125.1	-179.7	-56.8	170.8	0	0	0	107.9	V147 I155	V147-I157 HydrophobicContact CB-CD1 4.06Å; V147-I157 HydrophobicContact CG2-CD1 3.61Å; V147-I157 HydrophobicContact CG2-CG1 4.21Å; I155-I157 HydrophobicContact CD1-CG1 4.48Å; I155-I157 HydrophobicContact CG1-CG1 4.32Å
158	R	96.8	Very high	95.6	Very high	133 Å²	133	98.5 Å²	98.5	50%	0.502	50%	0.503	S	S	.	.			trans	-125.6	143.2	179	-59.5	-175.4	-164.6	170.1	8.9	110.2	E156 F160 E165	E156-R158 VanDerWaalsContact CD-NE 3.33Å; E156-R158 HydrophobicContact CG-CG 4.36Å; E156-R158 IonicContact OE1-CZ 3.55Å; E156-R158 IonicContact OE1-NE 3.76Å; E156-R158 PolarHBondContact OE1-NE 3.2Å; E156-R158 IonicContact OE1-NH2 3.07Å; E156-R158 PolarHBondContact OE1-NH2 3.33Å; E156-R158 IonicContact OE2-CZ 2.78Å; E156-R158 IonicContact OE2-NE 3.47Å; E156-R158 IonicContact OE2-NH2 3.31Å; E156-R158 PolarHBondContact OE2-NH2 2.92Å; R158-F160 HydrophobicContact CB-CD2 4.41Å; R158-F160 HydrophobicContact CB-CE2 3.69Å; R158-F160 HydrophobicContact CB-CZ 4.39Å; R158-E165 WeakPolarHBondContact CD-OE1 3.48Å
159	W	96.6	Very high	95.2	Very high	62 Å²	62	100 Å²	100	24%	0.235	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	142.3	175.1	-76.3	95.4	0	0	0	110.6	V129 L143 C145 E165 E166 V170	V129-W159 HydrophobicContact CG1-CH2 4.16Å; V129-W159 HydrophobicContact CG1-CZ3 4.27Å; L143-W159 HydrophobicContact CB-CH2 4.04Å; L143-W159 HydrophobicContact CB-CZ3 4.35Å; L143-W159 HydrophobicContact CD2-CE3 4.37Å; L143-W159 HydrophobicContact CD2-CH2 3.79Å; L143-W159 HydrophobicContact CD2-CZ3 3.37Å; L143-W159 HydrophobicContact CG-CH2 3.68Å; L143-W159 HydrophobicContact CG-CZ3 3.85Å; C145-W159 HydrophobicContact CB-CH2 3.58Å; C145-W159 HydrophobicContact CB-CZ2 3.26Å; W159-E165 WeakPolarHBondContact O-CA 3.44Å; W159-E166 HydrophobicContact CB-CB 4.21Å; W159-E166 PolarHBondContact O-N 3.19Å; W159-V170 HydrophobicContact CB-CG2 4.24Å; W159-V170 HydrophobicContact CG-CG2 4.22Å
160	F	96.6	Very high	95	Very high	119 Å²	119	98.7 Å²	98.7	52%	0.522	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	139.6	176.4	-68.6	-97.2	0	0	0	110.4	R158 E164 E165	R158-F160 HydrophobicContact CB-CD2 4.41Å; R158-F160 HydrophobicContact CB-CE2 3.69Å; R158-F160 HydrophobicContact CB-CZ 4.39Å; F160-E164 CarbonylContact C-O 3.51Å; F160-E164 WeakPolarHBondContact CA-O 3.14Å; F160-E165 HydrophobicContact CD1-CB 4.15Å; F160-E165 HydrophobicContact CE1-CB 3.81Å; F160-E165 HydrophobicContact CE1-CG 4.34Å; F160-E165 HydrophobicContact CZ-CB 4.3Å; F160-E165 HydrophobicContact CZ-CG 4.34Å
161	R	94.7	Very high	94.7	Very high	168 Å²	168	102.8 Å²	102.8	63%	0.634	55%	0.548	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124	120.1	171.2	-176	179.6	-177.8	179	-0.6	108.4	G163 E164 E166	R161-G163 PolarHBondContact O-N 3.08Å; R161-G163 VanDerWaalsContact O-N 3.08Å; R161-E164 PolarHBondContact N-O 3.35Å; R161-E164 PolarHBondContact O-N 3.12Å; R161-E166 HydrophobicContact CB-CG 3.63Å; R161-E166 WeakPolarHBondContact CB-OE1 3.37Å; R161-E166 WeakPolarHBondContact CD-OE1 3.25Å
162	N	96.2	Very high	94.6	Very high	161 Å²	161	103.7 Å²	103.7	86%	0.861	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	52.8	30.4	-178.3	-56.4	-28.3	0	0	0	114.1
163	G	94.9	Very high	94.5	Very high	65 Å²	65	106.1 Å²	106.1	67%	0.67	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	90.2	-6.9	-179.3	0	0	0	0	0	115.3	R161	R161-G163 PolarHBondContact O-N 3.08Å; R161-G163 VanDerWaalsContact O-N 3.08Å
164	E	97.1	Very high	94.5	Very high	148 Å²	148	111.7 Å²	111.7	69%	0.692	60%	0.603	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97	138.1	176.2	-63.2	-176.1	171.8	0	0	110.8	F160 R161 E166	F160-E164 CarbonylContact C-O 3.51Å; F160-E164 WeakPolarHBondContact CA-O 3.14Å; R161-E164 PolarHBondContact N-O 3.35Å; R161-E164 PolarHBondContact O-N 3.12Å; E164-E166 PolarHBondContact O-N 2.87Å
165	E	97.2	Very high	94.5	Very high	81 Å²	81	110.6 Å²	110.6	38%	0.379	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.3	124.5	-179.1	-171.9	-175.9	-169.4	0	0	110.7	R158 W159 F160 K167	R158-E165 WeakPolarHBondContact CD-OE1 3.48Å; W159-E165 WeakPolarHBondContact O-CA 3.44Å; F160-E165 HydrophobicContact CD1-CB 4.15Å; F160-E165 HydrophobicContact CE1-CB 3.81Å; F160-E165 HydrophobicContact CE1-CG 4.34Å; F160-E165 HydrophobicContact CZ-CB 4.3Å; F160-E165 HydrophobicContact CZ-CG 4.34Å; E165-K167 HydrophobicContact CG-CG 4.41Å; E165-K167 WeakPolarHBondContact OE1-CE 3.41Å; E165-K167 IonicContact OE1-NZ 2.63Å; E165-K167 WeakPolarHBondContact OE2-CE 3.36Å; E165-K167 IonicContact OE2-NZ 3.65Å; E165-K167 PolarHBondContact OE2-NZ 3.32Å
166	E	95.1	Very high	94.5	Very high	69 Å²	69	113.1 Å²	113.1	32%	0.322	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.3	118.8	178.6	-69.4	-73.7	-170.9	0	0	109.9	W159 R161 E164 V170	W159-E166 HydrophobicContact CB-CB 4.21Å; W159-E166 PolarHBondContact O-N 3.19Å; R161-E166 HydrophobicContact CB-CG 3.63Å; R161-E166 WeakPolarHBondContact CB-OE1 3.37Å; R161-E166 WeakPolarHBondContact CD-OE1 3.25Å; E164-E166 PolarHBondContact O-N 2.87Å; E166-V170 WeakPolarHBondContact O-CG2 3.43Å
167	K	94.8	Very high	94.5	Very high	145 Å²	145	112 Å²	112	63%	0.63	61%	0.612	S	S	*	*			trans	-111.2	-26.4	176.3	-62.4	-177.7	-176.8	174.4	0	112.5	E165	E165-K167 HydrophobicContact CG-CG 4.41Å; E165-K167 WeakPolarHBondContact OE1-CE 3.41Å; E165-K167 IonicContact OE1-NZ 2.63Å; E165-K167 WeakPolarHBondContact OE2-CE 3.36Å; E165-K167 IonicContact OE2-NZ 3.65Å; E165-K167 PolarHBondContact OE2-NZ 3.32Å
168	T	92.2	Very high	94.4	Very high	128 Å²	128	113.2 Å²	113.2	79%	0.785	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	129.3	-177.8	-54	0	0	0	0	110.2	V170	T168-V170 PolarHBondContact O-N 3.06Å
169	G	87.3	Confident	94.2	Very high	69 Å²	69	110.4 Å²	110.4	71%	0.711	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.8	7.1	178.7	0	0	0	0	0	114.9
170	V	91.9	Very high	93.8	Very high	63 Å²	63	117 Å²	117	38%	0.382	67%	0.671	S	S	.	*			trans	-79	126.8	170.8	178.6	0	0	0	0	109.3	W159 E166 T168	W159-V170 HydrophobicContact CB-CG2 4.24Å; W159-V170 HydrophobicContact CG-CG2 4.22Å; E166-V170 WeakPolarHBondContact O-CG2 3.43Å; T168-V170 PolarHBondContact O-N 3.06Å
171	V	91.2	Very high	93.6	Very high	132 Å²	132	116.9 Å²	116.9	80%	0.8	68%	0.679	S	S	*	*			trans	-127.3	132.6	175.1	-176.9	0	0	0	0	108.2
172	S	92.6	Very high	93.6	Very high	110 Å²	110	114.2 Å²	114.2	77%	0.769	68%	0.681	S	S	*	*			trans	-117.9	150.5	176.4	58.3	0	0	0	0	110.7
173	T	92.9	Very high	93.4	Very high	117 Å²	117	111.6 Å²	111.6	72%	0.718	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-77.9	163	165.3	61.9	0	0	0	0	110
174	D	94.3	Very high	93.4	Very high	148 Å²	148	114.3 Å²	114.3	79%	0.791	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-61.1	158.5	162.7	-65.8	-40.5	0	0	0	110.4	I176	D174-I176 PolarHBondContact O-N 3.05Å
175	L	95.4	Very high	93.1	Very high	112 Å²	112	112.2 Å²	112.2	59%	0.586	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-63.2	124.4	172.8	-179.7	69.8	0	0	0	109.5	F150	F150-L175 HydrophobicContact CE2-CD1 4Å; F150-L175 HydrophobicContact CZ-CD1 3.53Å
176	I	95.6	Very high	92.8	Very high	125 Å²	125	114.3 Å²	114.3	64%	0.641	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-96.4	123.9	179	-56.5	174.9	0	0	0	108.6	D174	D174-I176 PolarHBondContact O-N 3.05Å
177	S	94.9	Very high	92.7	Very high	111 Å²	111	117.5 Å²	117.5	78%	0.776	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-93.1	118.3	171.8	-173.9	0	0	0	0	109.5
178	N	94.5	Very high	92.5	Very high	112 Å²	112	115.4 Å²	115.4	60%	0.599	72%	0.722	S	S	*	*			trans	-78.5	-26.8	-178.1	-69.3	-21.9	0	0	0	113.1	D180	N178-D180 WeakPolarHBondContact CB-OD1 3.49Å
179	G	92.3	Very high	92.6	Very high	74 Å²	74	114.3 Å²	114.3	76%	0.763	72%	0.717	S	S	*	*			trans	81.6	14.9	178.3	0	0	0	0	0	115.3
180	D	87.8	Confident	93	Very high	199 Å²	199	118.5 Å²	118.5	100%	1.064	72%	0.717	S	S	*	*			trans	-97	0	175.9	58.8	-26.8	0	0	0	114.1	N178	N178-D180 WeakPolarHBondContact CB-OD1 3.49Å

Retrieved 180 of 180 residues in 231.1 ms (Link to these results)

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