A0A087WW49_HUMAN Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A087WW49, Species HUMAN (Homo sapiens, Human), Gene LOC102724971, Length 117 aa.

						>A0A087WW49_HUMAN|A0A087WW49|LOC102724971
MKHLWFFLLLVAAPRWVLSQVQLQESGPGLVKPSETLSLTCVVSGGSISSSNWWSWVRQPPGKGLEWIGEIYHSGSPNYNPSLKSRVTISVDKSKNQFSLKLSSVTAADTAVYYCAR
					

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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	56.9	Low	61.1	Low	220 Å²	220	154.7 Å²	154.7	100%	1.084	74%	0.741	S	S	*	*				0	-5.8	0	-103	170.6	-96.9	0	0	115.6
2	K	61.8	Low	61.5	Low	181 Å²	181	147.6 Å²	147.6	79%	0.787	73%	0.727	S	S	*	*			trans	-80.9	-22.7	178.1	-92.8	176.5	151.9	-178.6	0	115.6
3	H	63.2	Low	61.8	Low	148 Å²	148	141.8 Å²	141.8	69%	0.685	72%	0.717	S	S	*	*	S	Bend	trans	-80.1	-18.3	-179.4	-62.1	-69	0	0	0	113.7	W5 F6 F7	H3-W5 VanDerWaalsContact C-N 3.28Å; H3-W5 PolarHBondContact O-N 3.4Å; H3-F6 PolarHBondContact O-N 3.38Å; H3-F7 VanDerWaalsContact O-CD2 3.28Å; H3-F7 WeakPolarHBondContact O-CD2 3.28Å
4	L	61.3	Low	61.9	Low	123 Å²	123	138.4 Å²	138.4	64%	0.644	71%	0.71	S	S	*	*	H	α-helix	trans	-67	-30.6	-179.6	-126.4	84.2	0	0	0	112.2	F7 L8	L4-F7 PolarHBondContact O-N 3.48Å; L4-L8 PolarHBondContact O-N 3.5Å
5	W	63	Low	62	Low	196 Å²	196	144.6 Å²	144.6	74%	0.742	72%	0.721	S	S	*	*	H	α-helix	trans	-70.4	-30.8	179.3	-81.6	-9.8	0	0	0	113.9	H3 F7 L8 L9	H3-W5 VanDerWaalsContact C-N 3.28Å; H3-W5 PolarHBondContact O-N 3.4Å; W5-F7 VanDerWaalsContact C-N 3.35Å; W5-L8 PolarHBondContact O-N 3.32Å; W5-L9 PolarHBondContact O-N 3.46Å
6	F	60.2	Low	62.3	Low	156 Å²	156	149.2 Å²	149.2	68%	0.684	73%	0.727	S	S	*	*	H	α-helix	trans	-67.7	-35.7	175.9	-83.8	-82.6	0	0	0	112.2	H3 L8 L9	H3-F6 PolarHBondContact O-N 3.38Å; F6-L8 VanDerWaalsContact C-N 3.33Å; F6-L8 PolarHBondContact O-N 3.39Å; F6-L9 PolarHBondContact O-N 3.44Å
7	F	60	Low	62.8	Low	150 Å²	150	147.5 Å²	147.5	66%	0.658	73%	0.728	S	S	*	*	H	α-helix	trans	-68.2	-32.1	175.2	-72.4	-75.6	0	0	0	112.6	H3 L4 W5 L9 L10	H3-F7 VanDerWaalsContact O-CD2 3.28Å; H3-F7 WeakPolarHBondContact O-CD2 3.28Å; L4-F7 PolarHBondContact O-N 3.48Å; W5-F7 VanDerWaalsContact C-N 3.35Å; F7-L9 VanDerWaalsContact C-N 3.34Å; F7-L9 PolarHBondContact O-N 3.47Å; F7-L10 PolarHBondContact O-N 3.47Å
8	L	60.6	Low	63.3	Low	120 Å²	120	147.6 Å²	147.6	63%	0.628	73%	0.731	S	S	*	*	H	α-helix	trans	-68.1	-30.1	178.6	-109.1	145.6	0	0	0	113.3	L4 W5 F6	L4-L8 PolarHBondContact O-N 3.5Å; W5-L8 PolarHBondContact O-N 3.32Å; F6-L8 VanDerWaalsContact C-N 3.33Å; F6-L8 PolarHBondContact O-N 3.39Å
9	L	60.2	Low	63.9	Low	133 Å²	133	144.4 Å²	144.4	70%	0.696	72%	0.724	S	S	*	*	H	α-helix	trans	-74.3	-30.4	178.2	-87.4	156.1	0	0	0	113.5	W5 F6 F7 V11 A12	W5-L9 PolarHBondContact O-N 3.46Å; F6-L9 PolarHBondContact O-N 3.44Å; F7-L9 VanDerWaalsContact C-N 3.34Å; F7-L9 PolarHBondContact O-N 3.47Å; L9-V11 VanDerWaalsContact C-N 3.34Å; L9-V11 PolarHBondContact O-N 3.44Å; L9-A12 PolarHBondContact O-N 3.29Å
10	L	60.3	Low	65.1	Low	145 Å²	145	145.2 Å²	145.2	76%	0.759	73%	0.725	S	S	*	*	H	α-helix	trans	-73.8	-23.1	-179.6	-86.3	159.5	0	0	0	113.5	F7 A12	F7-L10 PolarHBondContact O-N 3.47Å; L10-A12 VanDerWaalsContact C-N 3.29Å
11	V	64.9	Low	66.4	Low	130 Å²	130	139.6 Å²	139.6	79%	0.788	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-12.3	178.8	-171.2	0	0	0	0	111.9	L9 A13	L9-V11 VanDerWaalsContact C-N 3.34Å; L9-V11 PolarHBondContact O-N 3.44Å; V11-A13 PolarHBondContact O-N 2.83Å
12	A	65.5	Low	68.3	Low	69 Å²	69	135.1 Å²	135.1	57%	0.57	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	23.4	-177.1	0	0	0	0	0	114	L9 L10 P14	L9-A12 PolarHBondContact O-N 3.29Å; L10-A12 VanDerWaalsContact C-N 3.29Å; A12-P14 WeakPolarHBondContact O-CD 3.32Å; A12-P14 VanDerWaalsContact O-N 3.15Å
13	A	65.2	Low	70	Confident	72 Å²	72	128.8 Å²	128.8	60%	0.595	65%	0.65	S	S	*	*			trans	-71	103.9	165	0	0	0	0	0	107.4	V11 R15	V11-A13 PolarHBondContact O-N 2.83Å; A13-R15 PolarHBondContact O-N 3.03Å
14	P	63.9	Low	71.7	Confident	95 Å²	95	128.1 Å²	128.1	62%	0.617	65%	0.647	S	S	*	*			trans	-65.6	116.9	176.9	-2.5	21.1	0	0	0	104.7	A12 W16	A12-P14 WeakPolarHBondContact O-CD 3.32Å; A12-P14 VanDerWaalsContact O-N 3.15Å; P14-W16 PolarHBondContact O-N 3.27Å
15	R	63.8	Low	73.4	Confident	231 Å²	231	125.8 Å²	125.8	87%	0.872	63%	0.633	S	S	*	*			trans	-72	84.3	172.5	-66.3	-177.4	175.2	-169.6	-2	106.1	A13 V17	A13-R15 PolarHBondContact O-N 3.03Å; R15-V17 HydrophobicContact CB-CG2 4.16Å; R15-V17 PolarHBondContact O-N 3.49Å
16	W	65.4	Low	75.1	Confident	218 Å²	218	119.2 Å²	119.2	83%	0.826	62%	0.617	S	S	*	*			trans	-66.3	75	163.9	-64	76.3	0	0	0	106.4	P14 L18	P14-W16 PolarHBondContact O-N 3.27Å; W16-L18 PolarHBondContact O-N 3.46Å
17	V	72.3	Confident	76.9	Confident	121 Å²	121	114.2 Å²	114.2	73%	0.733	61%	0.609	S	S	*	*			trans	-73.6	90.4	166.5	-178.8	0	0	0	0	104.4	R15 S19	R15-V17 HydrophobicContact CB-CG2 4.16Å; R15-V17 PolarHBondContact O-N 3.49Å; V17-S19 PolarHBondContact O-N 3Å
18	L	70.6	Confident	78.7	Confident	149 Å²	149	110 Å²	110	78%	0.78	60%	0.597	S	S	*	*			trans	-53.5	124	159.8	-67	176.1	0	0	0	105.7	W16 Q20	W16-L18 PolarHBondContact O-N 3.46Å; L18-Q20 PolarHBondContact O-N 3.43Å
19	S	74.8	Confident	80.3	Confident	87 Å²	87	108.6 Å²	108.6	61%	0.608	61%	0.611	S	S	*	*			trans	-59.1	105.8	176.9	-177.1	0	0	0	0	107.7	V17 G45	V17-S19 PolarHBondContact O-N 3Å; S19-G45 VanDerWaalsContact OG-CA 3.25Å; S19-G45 WeakPolarHBondContact OG-CA 3.37Å
20	Q	88.5	Confident	82	Confident	159 Å²	159	109.8 Å²	109.8	74%	0.743	62%	0.617	S	S	*	*			trans	-66.6	141.3	175.1	-174.3	177.6	-30.2	0	0	108.5	L18 Q22	L18-Q20 PolarHBondContact O-N 3.43Å; Q20-Q22 PolarHBondContact O-N 2.95Å
21	V	93	Very high	83.8	Confident	29 Å²	29	104.4 Å²	104.4	18%	0.176	59%	0.59	C	S	.	*			trans	-64.5	129.6	172.3	174.7	0	0	0	0	108.9	L23 V43 S44	V21-L23 HydrophobicContact CG1-CD2 4.42Å; V21-V43 HydrophobicContact CG1-CG1 4.13Å; V21-S44 WeakPolarHBondContact CA-O 3.2Å
22	Q	95.6	Very high	85.4	Confident	126 Å²	126	105 Å²	105	59%	0.589	58%	0.583	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118.5	144.8	174.4	-60.9	176.9	-42.1	0	0	109.5	Q20 S44	Q20-Q22 PolarHBondContact O-N 2.95Å; Q22-S44 WeakPolarHBondContact CB-OG 3.14Å; Q22-S44 PolarHBondContact N-O 3.18Å; Q22-S44 PolarHBondContact O-N 2.89Å
23	L	97.8	Very high	86.9	Confident	47 Å²	47	106.9 Å²	106.9	25%	0.246	59%	0.588	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.2	133.2	179.6	-63.9	-175.1	0	0	0	107.9	V21 V42 V43 W54 C115 R117	V21-L23 HydrophobicContact CG1-CD2 4.42Å; L23-V42 WeakPolarHBondContact CA-O 3.5Å; L23-V43 HydrophobicContact CD2-CB 4.33Å; L23-V43 HydrophobicContact CD2-CG1 4.31Å; L23-V43 HydrophobicContact CD2-CG2 3.8Å; L23-W54 HydrophobicContact CD2-CE3 4.34Å; L23-W54 HydrophobicContact CD2-CZ3 3.91Å; L23-C115 HydrophobicContact CD1-CB 4.3Å; L23-R117 HydrophobicContact CD1-CB 4.45Å
24	Q	98.2	Very high	88.4	Confident	134 Å²	134	108.1 Å²	108.1	63%	0.626	59%	0.593	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-130.4	109.6	-179.3	-176.1	176.9	-5.2	0	0	110.6	C41 V42	Q24-C41 WeakPolarHBondContact O-CA 3.49Å; Q24-V42 PolarHBondContact N-O 2.76Å; Q24-V42 PolarHBondContact O-N 2.8Å
25	E	98.6	Very high	90	Very high	74 Å²	74	107.9 Å²	107.9	35%	0.346	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.9	144.2	174.8	-60.4	82.2	171.8	0	0	111.8	T40 W56 Y114 C115	E25-T40 CarbonylContact C-O 3.59Å; E25-T40 WeakPolarHBondContact CA-O 3.12Å; E25-W56 HydrophobicContact CG-CH2 4.42Å; E25-W56 HydrophobicContact CG-CZ3 4.15Å; E25-Y114 WeakPolarHBondContact OE1-CA 3.13Å; E25-C115 HydrophobicContact CG-CB 4.46Å; E25-C115 WeakPolarHBondContact CG-SG 3.37Å; E25-C115 PolarHBondContact OE1-N 3.12Å; E25-C115 PolarHBondContact OE1-SG 3.2Å
26	S	98.5	Very high	91.7	Very high	59 Å²	59	100.1 Å²	100.1	41%	0.413	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-151.3	152.9	172.6	57.2	0	0	0	0	110.7	L39 T40	S26-L39 CarbonylContact O-C 3.6Å; S26-L39 WeakPolarHBondContact O-CA 3.45Å; S26-T40 PolarHBondContact N-O 3.5Å; S26-T40 PolarHBondContact O-N 2.95Å; S26-T40 PolarHBondContact OG-O 3.15Å
27	G	98.1	Very high	93.3	Very high	50 Å²	50	90.5 Å²	90.5	52%	0.515	53%	0.527	S	S	.	.			trans	161.2	-177.7	179.3	0	0	0	0	0	112
28	P	97.1	Very high	94.5	Very high	62 Å²	62	87.3 Å²	87.3	40%	0.403	51%	0.509	S	S	.	.			trans	-70.5	137.2	178.8	30.4	-33.8	0	0	0	110.7	V31 L37 S38	P28-V31 HydrophobicContact CB-CG2 3.97Å; P28-V31 HydrophobicContact CG-CG2 3.53Å; P28-L37 HydrophobicContact CG-CD1 3.8Å; P28-S38 WeakPolarHBondContact CD-O 3.42Å
29	G	94.8	Very high	95.9	Very high	90 Å²	90	81 Å²	81	93%	0.928	48%	0.477	S	S	*	.	S	Bend	trans	-75.5	-22.7	175.9	0	0	0	0	0	114.1
30	L	95.9	Very high	97	Very high	159 Å²	159	78.5 Å²	78.5	83%	0.832	46%	0.458	S	S	*	.			trans	-143.3	140	177.1	-176	65.3	0	0	0	109.6
31	V	97.3	Very high	97.5	Very high	32 Å²	32	70.9 Å²	70.9	19%	0.194	42%	0.422	C	S	.	.			trans	-136.6	141.9	179.7	178.7	0	0	0	0	107.5	P28 E35 L37 V105	P28-V31 HydrophobicContact CB-CG2 3.97Å; P28-V31 HydrophobicContact CG-CG2 3.53Å; V31-E35 HydrophobicContact CG1-CB 3.48Å; V31-E35 VanDerWaalsContact CG1-CB 3.48Å; V31-E35 WeakPolarHBondContact CG1-OE2 3.38Å; V31-L37 HydrophobicContact CG2-CB 4.49Å; V31-L37 HydrophobicContact CG2-CD1 3.95Å; V31-V105 HydrophobicContact CB-CG2 4.43Å; V31-V105 HydrophobicContact CG1-CG2 3.81Å
32	K	97.6	Very high	97.7	Very high	143 Å²	143	71.9 Å²	71.9	62%	0.622	43%	0.428	S	S	*	.			trans	-75	156.7	179.7	-59.9	178.8	-175.2	168.2	0	110.6	S34 E35 V105	K32-S34 PolarHBondContact O-N 3.38Å; K32-E35 HydrophobicContact CB-CG 4.06Å; K32-E35 PolarHBondContact N-OE2 2.81Å; K32-E35 WeakPolarHBondContact O-CB 3.32Å; K32-E35 PolarHBondContact O-N 3.15Å; K32-V105 WeakPolarHBondContact O-CG2 3.41Å
33	P	97.4	Very high	97.8	Very high	107 Å²	107	66.1 Å²	66.1	70%	0.695	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	143.6	171.5	-26.4	35.2	0	0	0	112.2	E35	P33-E35 PolarHBondContact O-N 3.26Å; P33-E35 VanDerWaalsContact O-N 3.12Å
34	S	97.5	Very high	97.7	Very high	98 Å²	98	66.1 Å²	66.1	69%	0.685	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	-4.3	-178.7	-52.3	0	0	0	0	116.4	K32 V105	K32-S34 PolarHBondContact O-N 3.38Å; S34-V105 PolarHBondContact N-O 3.27Å
35	E	98.2	Very high	97.5	Very high	90 Å²	90	61.7 Å²	61.7	42%	0.421	40%	0.395	S	S	.	.	S	Bend	trans	-75.9	-178.9	170.2	-68.7	179.9	169.7	0	0	111.2	V31 K32 P33 S104 V105	V31-E35 HydrophobicContact CG1-CB 3.48Å; V31-E35 VanDerWaalsContact CG1-CB 3.48Å; V31-E35 WeakPolarHBondContact CG1-OE2 3.38Å; K32-E35 HydrophobicContact CB-CG 4.06Å; K32-E35 PolarHBondContact N-OE2 2.81Å; K32-E35 WeakPolarHBondContact O-CB 3.32Å; K32-E35 PolarHBondContact O-N 3.15Å; P33-E35 PolarHBondContact O-N 3.26Å; P33-E35 VanDerWaalsContact O-N 3.12Å; E35-S104 PolarHBondContact O-N 3.28Å; E35-V105 WeakPolarHBondContact O-CG2 3.35Å; E35-V105 PolarHBondContact O-N 2.86Å; E35-V105 VanDerWaalsContact O-N 3.08Å
36	T	98.4	Very high	97.2	Very high	69 Å²	69	59.6 Å²	59.6	42%	0.423	39%	0.394	S	S	.	.			trans	-109	119.2	178.1	-62.1	0	0	0	0	110.1	K101 L102	T36-K101 HydrophobicContact CG2-CB 4.21Å; T36-L102 CarbonylContact C-O 3.51Å; T36-L102 WeakPolarHBondContact CA-O 3.34Å
37	L	98.5	Very high	96.9	Very high	16 Å²	16	59.6 Å²	59.6	8%	0.084	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	126.4	167.8	172.5	64.5	0	0	0	109	P28 V31 L39 K101 L102 V105 Y113	P28-L37 HydrophobicContact CG-CD1 3.8Å; V31-L37 HydrophobicContact CG2-CB 4.49Å; V31-L37 HydrophobicContact CG2-CD1 3.95Å; L37-L39 HydrophobicContact CD1-CD2 3.78Å; L37-L39 HydrophobicContact CD1-CG 4.08Å; L37-L39 HydrophobicContact CD2-CD1 4.17Å; L37-L39 HydrophobicContact CD2-CG 4.29Å; L37-L39 HydrophobicContact CG-CD1 4.43Å; L37-L39 HydrophobicContact CG-CD2 4.27Å; L37-L39 HydrophobicContact CG-CG 4.01Å; L37-K101 CarbonylContact O-C 3.56Å; L37-K101 WeakPolarHBondContact O-CA 3.16Å; L37-L102 HydrophobicContact CB-CB 4.32Å; L37-L102 PolarHBondContact N-O 3.11Å; L37-L102 PolarHBondContact O-N 2.98Å; L37-V105 HydrophobicContact CB-CG1 3.78Å; L37-Y113 HydrophobicContact CD2-CD2 4.33Å; L37-Y113 HydrophobicContact CD2-CE1 4.11Å; L37-Y113 HydrophobicContact CD2-CE2 3.77Å
38	S	98.6	Very high	96.8	Very high	53 Å²	53	57.2 Å²	57.2	37%	0.371	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	114.8	175.9	-63.1	0	0	0	0	109.7	P28 L100	P28-S38 WeakPolarHBondContact CD-O 3.42Å; S38-L100 WeakPolarHBondContact CA-O 3.36Å
39	L	98.8	Very high	96.7	Very high	17 Å²	17	56.7 Å²	56.7	9%	0.089	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	150	178.4	-59.2	178.1	0	0	0	110.5	S26 L37 W56 S99 L100 Y113	S26-L39 CarbonylContact O-C 3.6Å; S26-L39 WeakPolarHBondContact O-CA 3.45Å; L37-L39 HydrophobicContact CD1-CD2 3.78Å; L37-L39 HydrophobicContact CD1-CG 4.08Å; L37-L39 HydrophobicContact CD2-CD1 4.17Å; L37-L39 HydrophobicContact CD2-CG 4.29Å; L37-L39 HydrophobicContact CG-CD1 4.43Å; L37-L39 HydrophobicContact CG-CD2 4.27Å; L37-L39 HydrophobicContact CG-CG 4.01Å; L39-W56 HydrophobicContact CB-CH2 3.66Å; L39-W56 HydrophobicContact CB-CZ2 4.11Å; L39-W56 HydrophobicContact CB-CZ3 4.06Å; L39-W56 HydrophobicContact CD1-CE3 4.4Å; L39-W56 HydrophobicContact CD1-CH2 4.43Å; L39-W56 HydrophobicContact CD1-CZ3 3.97Å; L39-S99 CarbonylContact O-C 3.45Å; L39-S99 WeakPolarHBondContact O-CA 3.48Å; L39-S99 WeakPolarHBondContact O-CB 3.22Å; L39-L100 HydrophobicContact CB-CB 4.34Å; L39-L100 HydrophobicContact CD1-CD2 4.22Å; L39-L100 PolarHBondContact N-O 3.24Å; L39-L100 PolarHBondContact O-N 2.82Å; L39-Y113 HydrophobicContact CD1-CD1 3.57Å; L39-Y113 HydrophobicContact CD1-CD2 4.13Å; L39-Y113 HydrophobicContact CD1-CE1 4.35Å; L39-Y113 HydrophobicContact CD1-CG 3.43Å; L39-Y113 VanDerWaalsContact CD1-CG 3.43Å
40	T	98.8	Very high	96.4	Very high	34 Å²	34	54.2 Å²	54.2	21%	0.209	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	138.6	175.7	-65.6	0	0	0	0	109.4	E25 S26 V42 Q97 S99	E25-T40 CarbonylContact C-O 3.59Å; E25-T40 WeakPolarHBondContact CA-O 3.12Å; S26-T40 PolarHBondContact N-O 3.5Å; S26-T40 PolarHBondContact O-N 2.95Å; S26-T40 PolarHBondContact OG-O 3.15Å; T40-V42 HydrophobicContact CG2-CG2 4.43Å; T40-Q97 HydrophobicContact CG2-CB 4.07Å; T40-Q97 HydrophobicContact CG2-CG 4.15Å; T40-S99 PolarHBondContact OG1-OG 2.8Å; T40-S99 VanDerWaalsContact OG1-OG 3.11Å
41	C	98.6	Very high	96.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	117.9	170.9	-176.6	0	0	0	0	110	Q24 W56 Q97 F98 C115	Q24-C41 WeakPolarHBondContact O-CA 3.49Å; C41-W56 HydrophobicContact CB-CH2 3.83Å; C41-W56 HydrophobicContact CB-CZ2 3.66Å; C41-Q97 WeakPolarHBondContact O-CA 3.04Å; C41-Q97 VanDerWaalsContact O-CB 3.25Å; C41-Q97 WeakPolarHBondContact O-CB 3.33Å; C41-F98 HydrophobicContact CB-CD1 3.95Å; C41-F98 HydrophobicContact CB-CE1 3.54Å; C41-F98 HydrophobicContact CB-CE2 4.36Å; C41-F98 HydrophobicContact CB-CZ 3.79Å; C41-F98 PolarHBondContact N-O 2.78Å; C41-F98 PolarHBondContact O-N 3.01Å; C41-F98 VanDerWaalsContact SG-CE1 3.55Å; C41-C115 HydrophobicContact CB-CB 3.41Å; C41-C115 VanDerWaalsContact CB-CB 3.41Å; C41-C115 WeakPolarHBondContact CB-SG 3.48Å; C41-C115 WeakPolarHBondContact SG-CB 3.4Å; C41-C115 CovalentContact SG-SG 2.02Å; C41-C115 PolarHBondContact SG-SG 3.27Å
42	V	98.4	Very high	95.8	Very high	50 Å²	50	51.7 Å²	51.7	30%	0.303	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	133.1	175.8	179.1	0	0	0	0	109.2	L23 Q24 T40 Q97	L23-V42 WeakPolarHBondContact CA-O 3.5Å; Q24-V42 PolarHBondContact N-O 2.76Å; Q24-V42 PolarHBondContact O-N 2.8Å; T40-V42 HydrophobicContact CG2-CG2 4.43Å; V42-Q97 HydrophobicContact CG2-CB 4.38Å
43	V	97.2	Very high	95.8	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.024	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	129.5	175.1	-175.2	0	0	0	0	108.7	V21 L23 I48 W54 N96 F98	V21-V43 HydrophobicContact CG1-CG1 4.13Å; L23-V43 HydrophobicContact CD2-CB 4.33Å; L23-V43 HydrophobicContact CD2-CG1 4.31Å; L23-V43 HydrophobicContact CD2-CG2 3.8Å; V43-I48 HydrophobicContact CG2-CB 4.46Å; V43-I48 HydrophobicContact CG2-CD1 4.2Å; V43-I48 HydrophobicContact CG2-CG1 4.38Å; V43-W54 HydrophobicContact CG1-CH2 3.72Å; V43-W54 HydrophobicContact CG1-CZ2 4.5Å; V43-W54 HydrophobicContact CG1-CZ3 4.05Å; V43-W54 HydrophobicContact CG2-CE3 4.21Å; V43-W54 HydrophobicContact CG2-CH2 4.13Å; V43-W54 HydrophobicContact CG2-CZ3 3.92Å; V43-N96 WeakPolarHBondContact CB-O 3.44Å; V43-N96 PolarHBondContact N-O 2.95Å; V43-N96 PolarHBondContact O-ND2 2.81Å; V43-F98 HydrophobicContact CG2-CD1 4.35Å; V43-F98 HydrophobicContact CG2-CE1 4.29Å
44	S	95.9	Very high	95.8	Very high	48 Å²	48	44.2 Å²	44.2	34%	0.336	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	160.8	171.2	66.2	0	0	0	0	110.8	V21 Q22 G46	V21-S44 WeakPolarHBondContact CA-O 3.2Å; Q22-S44 WeakPolarHBondContact CB-OG 3.14Å; Q22-S44 PolarHBondContact N-O 3.18Å; Q22-S44 PolarHBondContact O-N 2.89Å; S44-G46 PolarHBondContact O-N 3.08Å; S44-G46 VanDerWaalsContact O-N 3.11Å
45	G	93.4	Very high	95.8	Very high	40 Å²	40	40.2 Å²	40.2	41%	0.412	26%	0.255	S	S	.	.	S	Bend	trans	66.4	8.2	-172.2	0	0	0	0	0	114.6	S19	S19-G45 VanDerWaalsContact OG-CA 3.25Å; S19-G45 WeakPolarHBondContact OG-CA 3.37Å
46	G	91.3	Very high	95.8	Very high	31 Å²	31	36 Å²	36	32%	0.32	24%	0.235	S	C	.	.	S	Bend	trans	-162.4	176.7	-179.9	0	0	0	0	0	111.5	S44 N96	S44-G46 PolarHBondContact O-N 3.08Å; S44-G46 VanDerWaalsContact O-N 3.11Å; G46-N96 PolarHBondContact O-ND2 2.84Å
47	S	94.2	Very high	95.8	Very high	59 Å²	59	33.7 Å²	33.7	41%	0.413	22%	0.221	S	C	.	.			trans	-115.4	131.2	179	-178	0	0	0	0	110.6	S49 S50 N96	S47-S49 PolarHBondContact O-N 3.11Å; S47-S49 PolarHBondContact OG-N 2.92Å; S47-S50 VanDerWaalsContact O-CB 3.23Å; S47-S50 WeakPolarHBondContact O-CB 3.34Å; S47-S50 PolarHBondContact O-N 2.92Å; S47-S50 PolarHBondContact O-OG 2.85Å; S47-N96 WeakPolarHBondContact CA-OD1 3.4Å
48	I	94.6	Very high	95.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.8	173.4	-156.2	163.3	0	0	0	112.5	V43 S50 W54 H73 V91 K93 N96 Q97 F98	V43-I48 HydrophobicContact CG2-CB 4.46Å; V43-I48 HydrophobicContact CG2-CD1 4.2Å; V43-I48 HydrophobicContact CG2-CG1 4.38Å; I48-S50 PolarHBondContact O-N 3.33Å; I48-W54 HydrophobicContact CG1-CD2 4.34Å; I48-W54 HydrophobicContact CG1-CG 4.32Å; I48-W54 HydrophobicContact CG1-CZ2 4.38Å; I48-W54 PolarHBondContact O-NE1 3.04Å; I48-H73 WeakPolarHBondContact O-CB 3.47Å; I48-V91 HydrophobicContact CD1-CG2 3.56Å; I48-V91 HydrophobicContact CG1-CG2 3.77Å; I48-V91 HydrophobicContact CG2-CG2 4.27Å; I48-K93 HydrophobicContact CG2-CB 4.43Å; I48-K93 HydrophobicContact CG2-CG 4.25Å; I48-N96 WeakPolarHBondContact CB-OD1 3.24Å; I48-N96 WeakPolarHBondContact CG2-OD1 3.42Å; I48-N96 PolarHBondContact N-OD1 2.81Å; I48-Q97 WeakPolarHBondContact CD1-O 3.07Å; I48-F98 HydrophobicContact CD1-CB 3.87Å; I48-F98 HydrophobicContact CD1-CD1 3.85Å; I48-F98 HydrophobicContact CD1-CG 4.3Å
49	S	94.4	Very high	95.8	Very high	51 Å²	51	34.7 Å²	34.7	36%	0.357	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-4.2	174.2	-59.6	0	0	0	0	113.4	S47	S47-S49 PolarHBondContact O-N 3.11Å; S47-S49 PolarHBondContact OG-N 2.92Å
50	S	90	Very high	95.8	Very high	37 Å²	37	34.5 Å²	34.5	26%	0.259	22%	0.219	S	C	.	.	S	Bend	trans	-65.5	157.5	171.7	60.2	0	0	0	0	111.4	S47 I48 N52 H73	S47-S50 VanDerWaalsContact O-CB 3.23Å; S47-S50 WeakPolarHBondContact O-CB 3.34Å; S47-S50 PolarHBondContact O-N 2.92Å; S47-S50 PolarHBondContact O-OG 2.85Å; I48-S50 PolarHBondContact O-N 3.33Å; S50-N52 PolarHBondContact O-N 2.86Å; S50-N52 PolarHBondContact OG-ND2 3.39Å; S50-H73 PolarHBondContact O-ND1 2.9Å
51	S	88.9	Confident	95.7	Very high	89 Å²	89	37.7 Å²	37.7	62%	0.622	24%	0.24	S	C	*	.	S	Bend	trans	-70.6	52.7	177.7	-62.1	0	0	0	0	113.2	Y72	S51-Y72 WeakPolarHBondContact CA-OH 3.39Å; S51-Y72 WeakPolarHBondContact CB-OH 3.25Å; S51-Y72 PolarHBondContact OG-OH 3.11Å
52	N	91.5	Very high	95.7	Very high	49 Å²	49	42.2 Å²	42.2	26%	0.262	29%	0.286	S	S	.	.			trans	-119.9	153.4	179.5	-67.1	-52.6	0	0	0	110.7	S50 W54 Y72 R117	S50-N52 PolarHBondContact O-N 2.86Å; S50-N52 PolarHBondContact OG-ND2 3.39Å; N52-W54 HydrophobicContact CB-CZ2 4.08Å; N52-Y72 WeakPolarHBondContact O-CD2 3.4Å; N52-R117 HydrophobicContact CB-CG 4.02Å; N52-R117 PolarHBondContact ND2-NH1 3.27Å
53	W	96.3	Very high	95.6	Very high	93 Å²	93	46.9 Å²	46.9	35%	0.352	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	138.2	167.9	-70.6	94.6	0	0	0	109.5	E70 Y72 S76 N78	W53-E70 HydrophobicContact CD2-CG 4.27Å; W53-E70 HydrophobicContact CE3-CB 4.12Å; W53-E70 HydrophobicContact CE3-CG 3.43Å; W53-E70 VanDerWaalsContact CE3-CG 3.43Å; W53-E70 HydrophobicContact CZ3-CG 3.81Å; W53-Y72 AromaticContact CD2-CD2 3.84Å; W53-Y72 HydrophobicContact CD2-CD2 3.84Å; W53-Y72 HydrophobicContact CD2-CG 4.4Å; W53-Y72 AromaticContact CE2-CD2 3.8Å; W53-Y72 HydrophobicContact CE3-CD2 4.37Å; W53-Y72 HydrophobicContact CG-CD2 4.05Å; W53-Y72 HydrophobicContact CZ2-CD2 4.31Å; W53-Y72 HydrophobicContact CZ2-CG 4.34Å; W53-Y72 AromaticContact NE1-CD2 3.91Å; W53-S76 WeakPolarHBondContact CZ3-O 3.49Å; W53-N78 WeakPolarHBondContact CH2-ND2 3.25Å
54	W	97.5	Very high	95.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	112.1	180	-56.6	101.5	0	0	0	108.7	L23 V43 I48 N52 E70 I71 F98 R117	L23-W54 HydrophobicContact CD2-CE3 4.34Å; L23-W54 HydrophobicContact CD2-CZ3 3.91Å; V43-W54 HydrophobicContact CG1-CH2 3.72Å; V43-W54 HydrophobicContact CG1-CZ2 4.5Å; V43-W54 HydrophobicContact CG1-CZ3 4.05Å; V43-W54 HydrophobicContact CG2-CE3 4.21Å; V43-W54 HydrophobicContact CG2-CH2 4.13Å; V43-W54 HydrophobicContact CG2-CZ3 3.92Å; I48-W54 HydrophobicContact CG1-CD2 4.34Å; I48-W54 HydrophobicContact CG1-CG 4.32Å; I48-W54 HydrophobicContact CG1-CZ2 4.38Å; I48-W54 PolarHBondContact O-NE1 3.04Å; N52-W54 HydrophobicContact CB-CZ2 4.08Å; W54-E70 CarbonylContact O-C 3.55Å; W54-E70 VanDerWaalsContact O-CA 3.24Å; W54-E70 WeakPolarHBondContact O-CA 3.19Å; W54-I71 HydrophobicContact CB-CG2 4.26Å; W54-I71 PolarHBondContact N-O 2.89Å; W54-I71 PolarHBondContact O-N 2.77Å; W54-F98 HydrophobicContact CB-CD1 3.97Å; W54-F98 HydrophobicContact CB-CD2 3.93Å; W54-F98 HydrophobicContact CB-CE1 3.8Å; W54-F98 HydrophobicContact CB-CE2 3.77Å; W54-F98 HydrophobicContact CB-CG 4.03Å; W54-F98 HydrophobicContact CB-CZ 3.68Å; W54-F98 HydrophobicContact CD2-CE1 4.38Å; W54-F98 HydrophobicContact CE3-CE1 4.12Å; W54-F98 HydrophobicContact CG-CD1 4.35Å; W54-F98 HydrophobicContact CG-CE1 4.29Å; W54-R117 HydrophobicContact CD2-CG 4.49Å; W54-R117 HydrophobicContact CE3-CB 3.76Å; W54-R117 HydrophobicContact CE3-CG 3.8Å; W54-R117 HydrophobicContact CH2-CB 4.42Å; W54-R117 HydrophobicContact CH2-CG 3.89Å; W54-R117 HydrophobicContact CZ3-CB 3.56Å; W54-R117 HydrophobicContact CZ3-CG 3.49Å; W54-R117 VanDerWaalsContact CZ3-CG 3.49Å
55	S	98.4	Very high	95.7	Very high	15 Å²	15	52.6 Å²	52.6	11%	0.105	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	149.6	-170	-76.8	0	0	0	0	112.4	G69 E70 C115 A116	S55-G69 WeakPolarHBondContact CA-O 3.49Å; S55-E70 WeakPolarHBondContact OG-CB 3.37Å; S55-C115 CarbonylContact O-C 3.59Å; S55-C115 WeakPolarHBondContact O-CA 3.11Å; S55-A116 PolarHBondContact N-O 3.44Å; S55-A116 PolarHBondContact O-N 2.96Å
56	W	98.7	Very high	96	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133	162.5	-78	99	0	0	0	109.8	E25 L39 C41 I68 G69 F98 L100 C115	E25-W56 HydrophobicContact CG-CH2 4.42Å; E25-W56 HydrophobicContact CG-CZ3 4.15Å; L39-W56 HydrophobicContact CB-CH2 3.66Å; L39-W56 HydrophobicContact CB-CZ2 4.11Å; L39-W56 HydrophobicContact CB-CZ3 4.06Å; L39-W56 HydrophobicContact CD1-CE3 4.4Å; L39-W56 HydrophobicContact CD1-CH2 4.43Å; L39-W56 HydrophobicContact CD1-CZ3 3.97Å; C41-W56 HydrophobicContact CB-CH2 3.83Å; C41-W56 HydrophobicContact CB-CZ2 3.66Å; W56-I68 HydrophobicContact CB-CB 4.2Å; W56-I68 HydrophobicContact CB-CD1 4.26Å; W56-I68 WeakPolarHBondContact O-CB 2.97Å; W56-I68 PolarHBondContact O-N 2.72Å; W56-G69 PolarHBondContact N-O 2.83Å; W56-F98 AromaticContact CD1-CD2 3.8Å; W56-F98 AromaticContact CD1-CE2 3.61Å; W56-F98 HydrophobicContact CD2-CE2 4.4Å; W56-F98 AromaticContact CE2-CE2 3.83Å; W56-F98 HydrophobicContact CG-CE2 4.3Å; W56-F98 HydrophobicContact CZ2-CE2 4.43Å; W56-F98 AromaticContact NE1-CD2 3.23Å; W56-F98 AromaticContact NE1-CE2 3.28Å; W56-F98 VanDerWaalsContact NE1-CE2 3.28Å; W56-L100 HydrophobicContact CB-CD1 4.4Å; W56-L100 HydrophobicContact CB-CD2 4.27Å; W56-L100 HydrophobicContact CD2-CB 3.81Å; W56-L100 HydrophobicContact CD2-CD2 4.22Å; W56-L100 HydrophobicContact CE3-CD2 4.43Å; W56-L100 HydrophobicContact CG-CB 3.88Å; W56-L100 HydrophobicContact CG-CD1 4.28Å; W56-L100 HydrophobicContact CG-CD2 4.16Å; W56-L100 HydrophobicContact CG-CG 4.34Å; W56-L100 HydrophobicContact CZ2-CB 4.22Å; W56-C115 HydrophobicContact CE3-CB 4.45Å; W56-C115 HydrophobicContact CH2-CB 4.41Å; W56-C115 HydrophobicContact CZ3-CB 4.33Å
57	V	98.7	Very high	96.3	Very high	22 Å²	22	56.2 Å²	56.2	13%	0.133	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	145.9	178.6	-176.2	0	0	0	0	107.9	L65 E66 Y113 Y114	V57-L65 HydrophobicContact CG1-CB 3.81Å; V57-L65 HydrophobicContact CG1-CD2 3.9Å; V57-L65 HydrophobicContact CG1-CG 4.29Å; V57-E66 WeakPolarHBondContact CA-O 3.44Å; V57-E66 WeakPolarHBondContact CG1-O 3.43Å; V57-Y113 WeakPolarHBondContact O-CA 3.43Å; V57-Y114 PolarHBondContact N-O 3.01Å; V57-Y114 PolarHBondContact O-N 2.85Å
58	R	98.2	Very high	96.5	Very high	15 Å²	15	53.5 Å²	53.5	6%	0.057	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	153.4	171.1	66.1	178.4	-174	-177.8	1.3	112.3	E66 I68 D109 A111 V112 Y113	R58-E66 HydrophobicContact CG-CB 4.11Å; R58-E66 IonicContact CZ-OE2 3.55Å; R58-E66 PolarHBondContact N-O 2.94Å; R58-E66 IonicContact NE-OE2 3.89Å; R58-E66 PolarHBondContact NE-OE2 2.94Å; R58-E66 IonicContact NH2-OE1 3.59Å; R58-E66 PolarHBondContact NH2-OE1 3.04Å; R58-E66 IonicContact NH2-OE2 2.83Å; R58-E66 PolarHBondContact NH2-OE2 2.82Å; R58-E66 PolarHBondContact O-N 3.41Å; R58-I68 HydrophobicContact CB-CD1 3.8Å; R58-I68 HydrophobicContact CB-CG1 4.43Å; R58-I68 HydrophobicContact CG-CD1 3.89Å; R58-I68 HydrophobicContact CG-CG1 4.02Å; R58-D109 IonicContact CZ-OD1 3.7Å; R58-D109 IonicContact NH1-OD1 3.69Å; R58-D109 PolarHBondContact NH1-OD1 3.09Å; R58-A111 HydrophobicContact CB-CB 3.81Å; R58-A111 HydrophobicContact CG-CB 4.31Å; R58-V112 CarbonylContact C-O 3.5Å; R58-V112 WeakPolarHBondContact CA-O 3.25Å; R58-Y113 HydrophobicContact CB-CD1 3.89Å; R58-Y113 HydrophobicContact CB-CE1 3.91Å; R58-Y113 HydrophobicContact CB-CG 4.23Å
59	Q	98.5	Very high	96.7	Very high	75 Å²	75	53.5 Å²	53.5	35%	0.35	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	98.6	173.9	-165.7	174.2	18.2	0	0	110.1	K63 L65 A111 V112 Y114	Q59-K63 PolarHBondContact NE2-O 2.78Å; Q59-L65 HydrophobicContact CB-CD2 3.94Å; Q59-L65 HydrophobicContact CG-CD2 4.24Å; Q59-A111 WeakPolarHBondContact O-CA 3.23Å; Q59-A111 WeakPolarHBondContact O-CB 3.2Å; Q59-V112 PolarHBondContact N-O 3.38Å; Q59-V112 PolarHBondContact O-N 2.86Å; Q59-Y114 HydrophobicContact CB-CE2 3.97Å
60	P	98	Very high	96.9	Very high	13 Å²	13	53.1 Å²	53.1	8%	0.084	31%	0.309	C	S	.	.			trans	-64.6	150.7	171.8	-19.1	31.7	0	0	0	111.4	G62 K63 A111	P60-G62 PolarHBondContact O-N 2.72Å; P60-K63 HydrophobicContact CB-CB 4.1Å; P60-K63 HydrophobicContact CB-CD 4.02Å; P60-K63 HydrophobicContact CB-CG 4.26Å; P60-K63 HydrophobicContact CG-CB 4.39Å; P60-K63 HydrophobicContact CG-CD 4.33Å; P60-K63 PolarHBondContact O-N 2.76Å; P60-A111 HydrophobicContact CB-CB 4.49Å; P60-A111 HydrophobicContact CG-CB 4.31Å
61	P	97.7	Very high	97.3	Very high	101 Å²	101	51.5 Å²	51.5	66%	0.656	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	128.7	177.7	-25.6	33.5	0	0	0	112.2	K63 T110	P61-K63 PolarHBondContact O-N 3.32Å; P61-T110 WeakPolarHBondContact CD-O 3.41Å
62	G	97.9	Very high	97.6	Very high	94 Å²	94	49.9 Å²	49.9	97%	0.969	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	11.2	180	0	0	0	0	0	115	P60	P60-G62 PolarHBondContact O-N 2.72Å
63	K	97.1	Very high	97.7	Very high	148 Å²	148	49.6 Å²	49.6	64%	0.643	28%	0.275	S	S	*	.	S	Bend	trans	-120.8	166.7	177.8	-59.6	-169.6	-176.3	177.2	0	111.7	Q59 P60 P61	Q59-K63 PolarHBondContact NE2-O 2.78Å; P60-K63 HydrophobicContact CB-CB 4.1Å; P60-K63 HydrophobicContact CB-CD 4.02Å; P60-K63 HydrophobicContact CB-CG 4.26Å; P60-K63 HydrophobicContact CG-CB 4.39Å; P60-K63 HydrophobicContact CG-CD 4.33Å; P60-K63 PolarHBondContact O-N 2.76Å; P61-K63 PolarHBondContact O-N 3.32Å
64	G	97.3	Very high	97.5	Very high	53 Å²	53	48.6 Å²	48.6	55%	0.546	28%	0.282	S	S	.	.			trans	-73.4	-179.7	171.7	0	0	0	0	0	112.9
65	L	98.1	Very high	97.3	Very high	120 Å²	120	50.3 Å²	50.3	63%	0.628	30%	0.3	S	S	*	.			trans	-68.1	136.1	173.2	-64	175.2	0	0	0	110.6	V57 Q59 Y114	V57-L65 HydrophobicContact CG1-CB 3.81Å; V57-L65 HydrophobicContact CG1-CD2 3.9Å; V57-L65 HydrophobicContact CG1-CG 4.29Å; Q59-L65 HydrophobicContact CB-CD2 3.94Å; Q59-L65 HydrophobicContact CG-CD2 4.24Å; L65-Y114 HydrophobicContact CD2-CD2 4.35Å; L65-Y114 HydrophobicContact CD2-CE2 4.37Å
66	E	98.3	Very high	97	Very high	55 Å²	55	52.8 Å²	52.8	26%	0.257	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	118.7	173.2	-176.8	-176.3	-171.2	0	0	108.7	V57 R58	V57-E66 WeakPolarHBondContact CA-O 3.44Å; V57-E66 WeakPolarHBondContact CG1-O 3.43Å; R58-E66 HydrophobicContact CG-CB 4.11Å; R58-E66 IonicContact CZ-OE2 3.55Å; R58-E66 PolarHBondContact N-O 2.94Å; R58-E66 IonicContact NE-OE2 3.89Å; R58-E66 PolarHBondContact NE-OE2 2.94Å; R58-E66 IonicContact NH2-OE1 3.59Å; R58-E66 PolarHBondContact NH2-OE1 3.04Å; R58-E66 IonicContact NH2-OE2 2.83Å; R58-E66 PolarHBondContact NH2-OE2 2.82Å; R58-E66 PolarHBondContact O-N 3.41Å
67	W	98.5	Very high	96.9	Very high	91 Å²	91	54.8 Å²	54.8	35%	0.345	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	132.8	174.3	178.4	81.1	0	0	0	110.3	G69 E70 N78 N80	W67-G69 VanDerWaalsContact CZ2-CA 3.42Å; W67-E70 HydrophobicContact CZ2-CB 4.12Å; W67-E70 HydrophobicContact CZ2-CG 3.82Å; W67-N78 HydrophobicContact CH2-CB 4.16Å; W67-N78 HydrophobicContact CZ2-CB 4.47Å; W67-N80 HydrophobicContact CE3-CB 3.81Å; W67-N80 HydrophobicContact CZ3-CB 3.99Å; W67-N80 VanDerWaalsContact O-CB 3.3Å; W67-N80 WeakPolarHBondContact O-CB 3.4Å; W67-N80 PolarHBondContact O-ND2 2.89Å
68	I	98.6	Very high	96.9	Very high	3 Å²	3	57.3 Å²	57.3	2%	0.015	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-43.9	-178.7	-65.6	162.8	0	0	0	110.9	W56 R58 N80 L83 V87 L100 Y113	W56-I68 HydrophobicContact CB-CB 4.2Å; W56-I68 HydrophobicContact CB-CD1 4.26Å; W56-I68 WeakPolarHBondContact O-CB 2.97Å; W56-I68 PolarHBondContact O-N 2.72Å; R58-I68 HydrophobicContact CB-CD1 3.8Å; R58-I68 HydrophobicContact CB-CG1 4.43Å; R58-I68 HydrophobicContact CG-CD1 3.89Å; R58-I68 HydrophobicContact CG-CG1 4.02Å; I68-N80 WeakPolarHBondContact O-CB 2.89Å; I68-N80 PolarHBondContact O-N 2.91Å; I68-L83 HydrophobicContact CB-CD1 4.35Å; I68-L83 HydrophobicContact CG1-CD1 3.99Å; I68-L83 HydrophobicContact CG2-CD1 4.22Å; I68-V87 HydrophobicContact CG2-CB 4.48Å; I68-V87 HydrophobicContact CG2-CG1 3.88Å; I68-V87 HydrophobicContact CG2-CG2 3.85Å; I68-L100 HydrophobicContact CD1-CD2 3.97Å; I68-L100 HydrophobicContact CG2-CD1 3.85Å; I68-L100 HydrophobicContact CG2-CD2 4.44Å; I68-Y113 HydrophobicContact CD1-CD1 3.65Å; I68-Y113 HydrophobicContact CD1-CE1 3.58Å
69	G	98.5	Very high	96.9	Very high	0 Å²	0	59 Å²	59	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166	171.1	-173.5	0	0	0	0	0	111	S55 W56 W67 N78 I89	S55-G69 WeakPolarHBondContact CA-O 3.49Å; W56-G69 PolarHBondContact N-O 2.83Å; W67-G69 VanDerWaalsContact CZ2-CA 3.42Å; G69-N78 CarbonylContact C-O 3.51Å; G69-N78 WeakPolarHBondContact CA-O 3.34Å; G69-I89 VanDerWaalsContact C-CD1 3.41Å
70	E	98.2	Very high	96.9	Very high	42 Å²	42	56.6 Å²	56.6	20%	0.196	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	159.4	179	68.2	-172.4	178.2	0	0	110.2	W53 W54 S55 W67 P77 N78	W53-E70 HydrophobicContact CD2-CG 4.27Å; W53-E70 HydrophobicContact CE3-CB 4.12Å; W53-E70 HydrophobicContact CE3-CG 3.43Å; W53-E70 VanDerWaalsContact CE3-CG 3.43Å; W53-E70 HydrophobicContact CZ3-CG 3.81Å; W54-E70 CarbonylContact O-C 3.55Å; W54-E70 VanDerWaalsContact O-CA 3.24Å; W54-E70 WeakPolarHBondContact O-CA 3.19Å; S55-E70 WeakPolarHBondContact OG-CB 3.37Å; W67-E70 HydrophobicContact CZ2-CB 4.12Å; W67-E70 HydrophobicContact CZ2-CG 3.82Å; E70-P77 CarbonylContact O-C 3.49Å; E70-P77 WeakPolarHBondContact O-CA 3.49Å; E70-N78 HydrophobicContact CG-CB 3.92Å; E70-N78 PolarHBondContact N-O 3.21Å; E70-N78 PolarHBondContact O-N 3Å; E70-N78 PolarHBondContact OE1-ND2 2.02Å
71	I	98	Very high	96.9	Very high	3 Å²	3	61.3 Å²	61.3	2%	0.015	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	136.6	173.9	-166.4	164.9	0	0	0	110.4	W54 P77 I89 V91 F98	W54-I71 HydrophobicContact CB-CG2 4.26Å; W54-I71 PolarHBondContact N-O 2.89Å; W54-I71 PolarHBondContact O-N 2.77Å; I71-P77 HydrophobicContact CB-CB 4.42Å; I71-P77 HydrophobicContact CD1-CB 4.42Å; I71-P77 HydrophobicContact CG1-CB 4.27Å; I71-I89 HydrophobicContact CB-CB 4.45Å; I71-I89 HydrophobicContact CB-CG2 3.63Å; I71-I89 HydrophobicContact CD1-CG2 4.17Å; I71-I89 HydrophobicContact CG2-CG2 3.5Å; I71-I89 VanDerWaalsContact CG2-CG2 3.5Å; I71-V91 HydrophobicContact CD1-CB 4.33Å; I71-V91 HydrophobicContact CD1-CG1 4.48Å; I71-F98 HydrophobicContact CG2-CB 4.34Å; I71-F98 HydrophobicContact CG2-CD2 4.37Å
72	Y	95.7	Very high	96.8	Very high	56 Å²	56	61.1 Å²	61.1	22%	0.22	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	157.7	170.1	-158.8	-124.1	0	0	0	110.8	S51 N52 W53 S74 G75 S76	S51-Y72 WeakPolarHBondContact CA-OH 3.39Å; S51-Y72 WeakPolarHBondContact CB-OH 3.25Å; S51-Y72 PolarHBondContact OG-OH 3.11Å; N52-Y72 WeakPolarHBondContact O-CD2 3.4Å; W53-Y72 AromaticContact CD2-CD2 3.84Å; W53-Y72 HydrophobicContact CD2-CD2 3.84Å; W53-Y72 HydrophobicContact CD2-CG 4.4Å; W53-Y72 AromaticContact CE2-CD2 3.8Å; W53-Y72 HydrophobicContact CE3-CD2 4.37Å; W53-Y72 HydrophobicContact CG-CD2 4.05Å; W53-Y72 HydrophobicContact CZ2-CD2 4.31Å; W53-Y72 HydrophobicContact CZ2-CG 4.34Å; W53-Y72 AromaticContact NE1-CD2 3.91Å; Y72-S74 WeakPolarHBondContact CD1-OG 3.37Å; Y72-S74 PolarHBondContact O-N 3.38Å; Y72-G75 PolarHBondContact O-N 2.86Å; Y72-S76 PolarHBondContact N-O 2.89Å
73	H	93.4	Very high	96.8	Very high	43 Å²	43	57 Å²	57	20%	0.199	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-19.4	178.9	77.9	-79.9	0	0	0	114.2	I48 S50 G75 K93	I48-H73 WeakPolarHBondContact O-CB 3.47Å; S50-H73 PolarHBondContact O-ND1 2.9Å; H73-G75 PolarHBondContact O-N 2.93Å; H73-K93 WeakPolarHBondContact O-CE 3.2Å; H73-K93 PolarHBondContact O-NZ 2.78Å
74	S	93.3	Very high	96.8	Very high	71 Å²	71	56.4 Å²	56.4	50%	0.497	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-11.5	172.4	61.9	0	0	0	0	113.5	Y72 S76	Y72-S74 WeakPolarHBondContact CD1-OG 3.37Å; Y72-S74 PolarHBondContact O-N 3.38Å; S74-S76 PolarHBondContact OG-OG 3.18Å
75	G	92.2	Very high	96.8	Very high	37 Å²	37	59.2 Å²	59.2	38%	0.381	34%	0.335	S	S	.	.	S	Bend	trans	87.2	18.6	-176.9	0	0	0	0	0	114	Y72 H73 P77	Y72-G75 PolarHBondContact O-N 2.86Å; H73-G75 PolarHBondContact O-N 2.93Å; G75-P77 VanDerWaalsContact O-CD 3.25Å; G75-P77 WeakPolarHBondContact O-CD 3.37Å
76	S	92.3	Very high	96.8	Very high	66 Å²	66	56 Å²	56	46%	0.462	31%	0.314	S	S	.	.			trans	-95.4	107.3	176.4	-53.3	0	0	0	0	110.2	W53 Y72 S74	W53-S76 WeakPolarHBondContact CZ3-O 3.49Å; Y72-S76 PolarHBondContact N-O 2.89Å; S74-S76 PolarHBondContact OG-OG 3.18Å
77	P	96.7	Very high	96.8	Very high	43 Å²	43	53.7 Å²	53.7	28%	0.279	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	146.3	-179.5	35.3	-34.3	0	0	0	112.8	E70 I71 G75 Y79	E70-P77 CarbonylContact O-C 3.49Å; E70-P77 WeakPolarHBondContact O-CA 3.49Å; I71-P77 HydrophobicContact CB-CB 4.42Å; I71-P77 HydrophobicContact CD1-CB 4.42Å; I71-P77 HydrophobicContact CG1-CB 4.27Å; G75-P77 VanDerWaalsContact O-CD 3.25Å; G75-P77 WeakPolarHBondContact O-CD 3.37Å; P77-Y79 HydrophobicContact CB-CE1 4.04Å; P77-Y79 HydrophobicContact CB-CE2 3.89Å; P77-Y79 WeakPolarHBondContact CB-OH 3.23Å; P77-Y79 HydrophobicContact CG-CE2 3.67Å; P77-Y79 VanDerWaalsContact CG-OH 3.25Å; P77-Y79 WeakPolarHBondContact CG-OH 3.5Å
78	N	97.9	Very high	96.8	Very high	75 Å²	75	53.1 Å²	53.1	40%	0.401	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	146.1	162.4	-62.9	-44.8	0	0	0	109	W53 W67 G69 E70	W53-N78 WeakPolarHBondContact CH2-ND2 3.25Å; W67-N78 HydrophobicContact CH2-CB 4.16Å; W67-N78 HydrophobicContact CZ2-CB 4.47Å; G69-N78 CarbonylContact C-O 3.51Å; G69-N78 WeakPolarHBondContact CA-O 3.34Å; E70-N78 HydrophobicContact CG-CB 3.92Å; E70-N78 PolarHBondContact N-O 3.21Å; E70-N78 PolarHBondContact O-N 3Å; E70-N78 PolarHBondContact OE1-ND2 2.02Å
79	Y	98.6	Very high	96.8	Very high	49 Å²	49	53.3 Å²	53.3	19%	0.192	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	150	-175.3	-59.5	-69.6	0	0	0	111.2	P77 P81 K84 V87 I89	P77-Y79 HydrophobicContact CB-CE1 4.04Å; P77-Y79 HydrophobicContact CB-CE2 3.89Å; P77-Y79 WeakPolarHBondContact CB-OH 3.23Å; P77-Y79 HydrophobicContact CG-CE2 3.67Å; P77-Y79 VanDerWaalsContact CG-OH 3.25Å; P77-Y79 WeakPolarHBondContact CG-OH 3.5Å; Y79-P81 WeakPolarHBondContact O-CD 3.21Å; Y79-K84 HydrophobicContact CD2-CG 4.03Å; Y79-K84 HydrophobicContact CG-CG 4.3Å; Y79-V87 HydrophobicContact CD1-CB 4.32Å; Y79-V87 HydrophobicContact CD1-CG1 3.69Å; Y79-V87 HydrophobicContact CE1-CG1 3.7Å; Y79-I89 HydrophobicContact CD1-CD1 4.11Å; Y79-I89 HydrophobicContact CE1-CB 4.17Å; Y79-I89 HydrophobicContact CE1-CD1 3.87Å; Y79-I89 HydrophobicContact CE1-CG1 3.87Å; Y79-I89 PolarHBondContact OH-N 3.03Å
80	N	98.1	Very high	96.8	Very high	26 Å²	26	55.9 Å²	55.9	14%	0.139	33%	0.33	C	S	.	.			trans	-60.7	122.3	162.4	-177.3	-30.7	0	0	0	108.7	W67 I68 S82 L83 K84	W67-N80 HydrophobicContact CE3-CB 3.81Å; W67-N80 HydrophobicContact CZ3-CB 3.99Å; W67-N80 VanDerWaalsContact O-CB 3.3Å; W67-N80 WeakPolarHBondContact O-CB 3.4Å; W67-N80 PolarHBondContact O-ND2 2.89Å; I68-N80 WeakPolarHBondContact O-CB 2.89Å; I68-N80 PolarHBondContact O-N 2.91Å; N80-S82 PolarHBondContact O-N 2.81Å; N80-S82 VanDerWaalsContact O-N 3.09Å; N80-S82 WeakPolarHBondContact OD1-CB 3.35Å; N80-S82 PolarHBondContact OD1-N 2.86Å; N80-L83 PolarHBondContact O-N 3.34Å; N80-K84 PolarHBondContact O-N 3.38Å
81	P	98.1	Very high	96.8	Very high	111 Å²	111	55.7 Å²	55.7	72%	0.721	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-35.1	-178.4	-28.9	35.9	0	0	0	114	Y79 L83	Y79-P81 WeakPolarHBondContact O-CD 3.21Å; P81-L83 VanDerWaalsContact C-N 3.27Å; P81-L83 PolarHBondContact O-N 3.11Å
82	S	96.6	Very high	96.7	Very high	98 Å²	98	57.8 Å²	57.8	69%	0.685	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-19.6	-179.6	-59.3	0	0	0	0	114	N80	N80-S82 PolarHBondContact O-N 2.81Å; N80-S82 VanDerWaalsContact O-N 3.09Å; N80-S82 WeakPolarHBondContact OD1-CB 3.35Å; N80-S82 PolarHBondContact OD1-N 2.86Å
83	L	97.4	Very high	96.7	Very high	6 Å²	6	60 Å²	60	3%	0.031	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115	-11.4	-177.4	-62	175.1	0	0	0	113.3	I68 N80 P81 S85 R86 V87	I68-L83 HydrophobicContact CB-CD1 4.35Å; I68-L83 HydrophobicContact CG1-CD1 3.99Å; I68-L83 HydrophobicContact CG2-CD1 4.22Å; N80-L83 PolarHBondContact O-N 3.34Å; P81-L83 VanDerWaalsContact C-N 3.27Å; P81-L83 PolarHBondContact O-N 3.11Å; L83-S85 PolarHBondContact O-N 3.32Å; L83-R86 PolarHBondContact O-N 3.35Å; L83-V87 HydrophobicContact CB-CG2 3.83Å; L83-V87 WeakPolarHBondContact O-CG2 3.25Å; L83-V87 PolarHBondContact O-N 2.97Å; L83-V87 VanDerWaalsContact O-N 3.14Å
84	K	97.6	Very high	96.9	Very high	137 Å²	137	63 Å²	63	60%	0.596	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-33	-173.2	-175.5	173.7	-178.6	177.6	0	114.4	Y79 N80 R86	Y79-K84 HydrophobicContact CD2-CG 4.03Å; Y79-K84 HydrophobicContact CG-CG 4.3Å; N80-K84 PolarHBondContact O-N 3.38Å; K84-R86 VanDerWaalsContact C-N 3.29Å; K84-R86 PolarHBondContact O-N 2.81Å
85	S	97.8	Very high	97.1	Very high	111 Å²	111	65.8 Å²	65.8	78%	0.776	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-17.2	-179	58.2	0	0	0	0	114.5	L83	L83-S85 PolarHBondContact O-N 3.32Å
86	R	97.9	Very high	97.3	Very high	52 Å²	52	65.8 Å²	65.8	20%	0.196	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.4	-10.9	-175.8	-59.2	-171.5	-61.2	132.2	0.8	113.6	L83 K84 L102 S103 S104 D109	L83-R86 PolarHBondContact O-N 3.35Å; K84-R86 VanDerWaalsContact C-N 3.29Å; K84-R86 PolarHBondContact O-N 2.81Å; R86-L102 HydrophobicContact CB-CD1 3.81Å; R86-L102 WeakPolarHBondContact O-CA 3.36Å; R86-S103 WeakPolarHBondContact CA-OG 3.25Å; R86-S103 PolarHBondContact NH1-O 3.11Å; R86-S103 PolarHBondContact O-N 2.95Å; R86-S103 PolarHBondContact O-OG 3.4Å; R86-S104 PolarHBondContact NH1-O 3.28Å; R86-D109 IonicContact CZ-OD1 3.16Å; R86-D109 IonicContact CZ-OD2 2.72Å; R86-D109 IonicContact NH1-OD1 2.77Å; R86-D109 IonicContact NH1-OD2 3.32Å; R86-D109 PolarHBondContact NH1-OD2 2.61Å; R86-D109 IonicContact NH2-OD1 3.39Å; R86-D109 PolarHBondContact NH2-OD1 2.84Å; R86-D109 IonicContact NH2-OD2 2.76Å; R86-D109 PolarHBondContact NH2-OD2 2.79Å
87	V	98.6	Very high	97.5	Very high	7 Å²	7	64.3 Å²	64.3	4%	0.042	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	136.9	-173	170.1	0	0	0	0	111.5	I68 Y79 L83 I89 L100 K101 L102	I68-V87 HydrophobicContact CG2-CB 4.48Å; I68-V87 HydrophobicContact CG2-CG1 3.88Å; I68-V87 HydrophobicContact CG2-CG2 3.85Å; Y79-V87 HydrophobicContact CD1-CB 4.32Å; Y79-V87 HydrophobicContact CD1-CG1 3.69Å; Y79-V87 HydrophobicContact CE1-CG1 3.7Å; L83-V87 HydrophobicContact CB-CG2 3.83Å; L83-V87 WeakPolarHBondContact O-CG2 3.25Å; L83-V87 PolarHBondContact O-N 2.97Å; L83-V87 VanDerWaalsContact O-N 3.14Å; V87-I89 HydrophobicContact CG1-CD1 4.39Å; V87-I89 HydrophobicContact CG1-CG1 4.07Å; V87-L100 HydrophobicContact CG1-CD1 3.47Å; V87-L100 VanDerWaalsContact CG1-CD1 3.47Å; V87-K101 CarbonylContact C-O 3.52Å; V87-K101 WeakPolarHBondContact CA-O 3.3Å; V87-L102 HydrophobicContact CG2-CD1 3.65Å
88	T	98.4	Very high	97.6	Very high	79 Å²	79	62.2 Å²	62.2	49%	0.485	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	126.9	166.4	-60.1	0	0	0	0	109	K101	T88-K101 PolarHBondContact N-O 3.42Å; T88-K101 PolarHBondContact O-N 3.14Å
89	I	98.5	Very high	97.6	Very high	8 Å²	8	59.6 Å²	59.6	4%	0.041	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	139	172.9	-59.9	165.5	0	0	0	108.3	G69 I71 Y79 V87 S99 L100	G69-I89 VanDerWaalsContact C-CD1 3.41Å; I71-I89 HydrophobicContact CB-CB 4.45Å; I71-I89 HydrophobicContact CB-CG2 3.63Å; I71-I89 HydrophobicContact CD1-CG2 4.17Å; I71-I89 HydrophobicContact CG2-CG2 3.5Å; I71-I89 VanDerWaalsContact CG2-CG2 3.5Å; Y79-I89 HydrophobicContact CD1-CD1 4.11Å; Y79-I89 HydrophobicContact CE1-CB 4.17Å; Y79-I89 HydrophobicContact CE1-CD1 3.87Å; Y79-I89 HydrophobicContact CE1-CG1 3.87Å; Y79-I89 PolarHBondContact OH-N 3.03Å; V87-I89 HydrophobicContact CG1-CD1 4.39Å; V87-I89 HydrophobicContact CG1-CG1 4.07Å; I89-S99 VanDerWaalsContact CA-O 3.31Å; I89-S99 WeakPolarHBondContact CA-O 3.47Å; I89-L100 HydrophobicContact CD1-CD1 4.29Å; I89-L100 HydrophobicContact CG1-CD1 3.65Å
90	S	97.7	Very high	97.6	Very high	53 Å²	53	57.3 Å²	57.3	37%	0.371	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	154	-178.7	56.5	0	0	0	0	111.5	F98 S99	S90-F98 CarbonylContact O-C 3.46Å; S90-F98 WeakPolarHBondContact O-CA 3.35Å; S90-F98 VanDerWaalsContact O-CB 3.25Å; S90-F98 WeakPolarHBondContact O-CB 3.39Å; S90-S99 PolarHBondContact N-O 3.29Å; S90-S99 PolarHBondContact O-N 3.05Å
91	V	97.4	Very high	97.7	Very high	39 Å²	39	61.4 Å²	61.4	24%	0.236	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	132	-179.9	69.9	0	0	0	0	109.9	I48 I71 K93	I48-V91 HydrophobicContact CD1-CG2 3.56Å; I48-V91 HydrophobicContact CG1-CG2 3.77Å; I48-V91 HydrophobicContact CG2-CG2 4.27Å; I71-V91 HydrophobicContact CD1-CB 4.33Å; I71-V91 HydrophobicContact CD1-CG1 4.48Å; V91-K93 HydrophobicContact CG2-CG 4.46Å
92	D	96.7	Very high	97.7	Very high	47 Å²	47	56.3 Å²	56.3	25%	0.251	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	96.2	171.5	-175.6	-15.8	0	0	0	108.7	S94 K95 N96 Q97	D92-S94 VanDerWaalsContact C-N 3.27Å; D92-S94 PolarHBondContact O-N 2.88Å; D92-S94 WeakPolarHBondContact OD1-CB 3.31Å; D92-S94 PolarHBondContact OD1-N 2.96Å; D92-S94 PolarHBondContact OD1-OG 2.85Å; D92-K95 PolarHBondContact O-N 2.89Å; D92-K95 PolarHBondContact OD1-N 3.35Å; D92-K95 VanDerWaalsContact OD2-CD 3.23Å; D92-K95 WeakPolarHBondContact OD2-CD 3.5Å; D92-K95 WeakPolarHBondContact OD2-CE 3.46Å; D92-K95 WeakPolarHBondContact OD2-CG 3.45Å; D92-K95 IonicContact OD2-NZ 2.78Å; D92-N96 PolarHBondContact O-N 2.93Å; D92-N96 VanDerWaalsContact O-N 3.11Å; D92-Q97 HydrophobicContact CB-CG 3.98Å; D92-Q97 PolarHBondContact N-O 2.61Å; D92-Q97 PolarHBondContact O-N 3.43Å; D92-Q97 VanDerWaalsContact O-N 3.11Å
93	K	96	Very high	97.8	Very high	102 Å²	102	53.6 Å²	53.6	44%	0.443	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-65.4	-31	-178.7	-62.9	180	-177.5	178	0	112.5	I48 H73 V91 K95 N96	I48-K93 HydrophobicContact CG2-CB 4.43Å; I48-K93 HydrophobicContact CG2-CG 4.25Å; H73-K93 WeakPolarHBondContact O-CE 3.2Å; H73-K93 PolarHBondContact O-NZ 2.78Å; V91-K93 HydrophobicContact CG2-CG 4.46Å; K93-K95 PolarHBondContact O-N 2.9Å; K93-N96 PolarHBondContact O-N 3.01Å
94	S	96	Very high	97.8	Very high	107 Å²	107	56.4 Å²	56.4	75%	0.748	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-68.1	-28	-178.2	74.3	0	0	0	0	112.1	D92	D92-S94 VanDerWaalsContact C-N 3.27Å; D92-S94 PolarHBondContact O-N 2.88Å; D92-S94 WeakPolarHBondContact OD1-CB 3.31Å; D92-S94 PolarHBondContact OD1-N 2.96Å; D92-S94 PolarHBondContact OD1-OG 2.85Å
95	K	97.5	Very high	97.8	Very high	128 Å²	128	50.5 Å²	50.5	56%	0.557	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-106	2.7	178.6	-61.7	-177.7	-167.3	168.1	0	113.7	D92 K93 Q97	D92-K95 PolarHBondContact O-N 2.89Å; D92-K95 PolarHBondContact OD1-N 3.35Å; D92-K95 VanDerWaalsContact OD2-CD 3.23Å; D92-K95 WeakPolarHBondContact OD2-CD 3.5Å; D92-K95 WeakPolarHBondContact OD2-CE 3.46Å; D92-K95 WeakPolarHBondContact OD2-CG 3.45Å; D92-K95 IonicContact OD2-NZ 2.78Å; K93-K95 PolarHBondContact O-N 2.9Å; K95-Q97 VanDerWaalsContact C-N 3.27Å; K95-Q97 HydrophobicContact CB-CG 3.8Å; K95-Q97 PolarHBondContact O-N 2.88Å
96	N	97	Very high	97.8	Very high	37 Å²	37	48.7 Å²	48.7	20%	0.198	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	43.1	-176.7	-152.3	39.1	0	0	0	113.2	V43 G46 S47 I48 D92 K93	V43-N96 WeakPolarHBondContact CB-O 3.44Å; V43-N96 PolarHBondContact N-O 2.95Å; V43-N96 PolarHBondContact O-ND2 2.81Å; G46-N96 PolarHBondContact O-ND2 2.84Å; S47-N96 WeakPolarHBondContact CA-OD1 3.4Å; I48-N96 WeakPolarHBondContact CB-OD1 3.24Å; I48-N96 WeakPolarHBondContact CG2-OD1 3.42Å; I48-N96 PolarHBondContact N-OD1 2.81Å; D92-N96 PolarHBondContact O-N 2.93Å; D92-N96 VanDerWaalsContact O-N 3.11Å; K93-N96 PolarHBondContact O-N 3.01Å
97	Q	98	Very high	97.7	Very high	35 Å²	35	50.4 Å²	50.4	16%	0.164	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	156.6	-174.7	72.4	-176.4	51	0	0	112	T40 C41 V42 I48 D92 K95	T40-Q97 HydrophobicContact CG2-CB 4.07Å; T40-Q97 HydrophobicContact CG2-CG 4.15Å; C41-Q97 WeakPolarHBondContact O-CA 3.04Å; C41-Q97 VanDerWaalsContact O-CB 3.25Å; C41-Q97 WeakPolarHBondContact O-CB 3.33Å; V42-Q97 HydrophobicContact CG2-CB 4.38Å; I48-Q97 WeakPolarHBondContact CD1-O 3.07Å; D92-Q97 HydrophobicContact CB-CG 3.98Å; D92-Q97 PolarHBondContact N-O 2.61Å; D92-Q97 PolarHBondContact O-N 3.43Å; D92-Q97 VanDerWaalsContact O-N 3.11Å; K95-Q97 VanDerWaalsContact C-N 3.27Å; K95-Q97 HydrophobicContact CB-CG 3.8Å; K95-Q97 PolarHBondContact O-N 2.88Å
98	F	98	Very high	97.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	159.4	167.7	62.3	-67.6	0	0	0	109.7	C41 V43 I48 W54 W56 I71 S90 C115	C41-F98 HydrophobicContact CB-CD1 3.95Å; C41-F98 HydrophobicContact CB-CE1 3.54Å; C41-F98 HydrophobicContact CB-CE2 4.36Å; C41-F98 HydrophobicContact CB-CZ 3.79Å; C41-F98 PolarHBondContact N-O 2.78Å; C41-F98 PolarHBondContact O-N 3.01Å; C41-F98 VanDerWaalsContact SG-CE1 3.55Å; V43-F98 HydrophobicContact CG2-CD1 4.35Å; V43-F98 HydrophobicContact CG2-CE1 4.29Å; I48-F98 HydrophobicContact CD1-CB 3.87Å; I48-F98 HydrophobicContact CD1-CD1 3.85Å; I48-F98 HydrophobicContact CD1-CG 4.3Å; W54-F98 HydrophobicContact CB-CD1 3.97Å; W54-F98 HydrophobicContact CB-CD2 3.93Å; W54-F98 HydrophobicContact CB-CE1 3.8Å; W54-F98 HydrophobicContact CB-CE2 3.77Å; W54-F98 HydrophobicContact CB-CG 4.03Å; W54-F98 HydrophobicContact CB-CZ 3.68Å; W54-F98 HydrophobicContact CD2-CE1 4.38Å; W54-F98 HydrophobicContact CE3-CE1 4.12Å; W54-F98 HydrophobicContact CG-CD1 4.35Å; W54-F98 HydrophobicContact CG-CE1 4.29Å; W56-F98 AromaticContact CD1-CD2 3.8Å; W56-F98 AromaticContact CD1-CE2 3.61Å; W56-F98 HydrophobicContact CD2-CE2 4.4Å; W56-F98 AromaticContact CE2-CE2 3.83Å; W56-F98 HydrophobicContact CG-CE2 4.3Å; W56-F98 HydrophobicContact CZ2-CE2 4.43Å; W56-F98 AromaticContact NE1-CD2 3.23Å; W56-F98 AromaticContact NE1-CE2 3.28Å; W56-F98 VanDerWaalsContact NE1-CE2 3.28Å; I71-F98 HydrophobicContact CG2-CB 4.34Å; I71-F98 HydrophobicContact CG2-CD2 4.37Å; S90-F98 CarbonylContact O-C 3.46Å; S90-F98 WeakPolarHBondContact O-CA 3.35Å; S90-F98 VanDerWaalsContact O-CB 3.25Å; S90-F98 WeakPolarHBondContact O-CB 3.39Å; F98-C115 HydrophobicContact CE1-CB 4.16Å; F98-C115 HydrophobicContact CE2-CB 4.16Å; F98-C115 HydrophobicContact CZ-CB 3.44Å; F98-C115 VanDerWaalsContact CZ-CB 3.44Å
99	S	98.5	Very high	97.6	Very high	20 Å²	20	50.3 Å²	50.3	14%	0.14	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	147.8	-171.5	-62.9	0	0	0	0	111.6	L39 T40 I89 S90	L39-S99 CarbonylContact O-C 3.45Å; L39-S99 WeakPolarHBondContact O-CA 3.48Å; L39-S99 WeakPolarHBondContact O-CB 3.22Å; T40-S99 PolarHBondContact OG1-OG 2.8Å; T40-S99 VanDerWaalsContact OG1-OG 3.11Å; I89-S99 VanDerWaalsContact CA-O 3.31Å; I89-S99 WeakPolarHBondContact CA-O 3.47Å; S90-S99 PolarHBondContact N-O 3.29Å; S90-S99 PolarHBondContact O-N 3.05Å
100	L	98.7	Very high	97.6	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.4	174	178.7	74.2	0	0	0	108.6	S38 L39 W56 I68 V87 I89 Y113	S38-L100 WeakPolarHBondContact CA-O 3.36Å; L39-L100 HydrophobicContact CB-CB 4.34Å; L39-L100 HydrophobicContact CD1-CD2 4.22Å; L39-L100 PolarHBondContact N-O 3.24Å; L39-L100 PolarHBondContact O-N 2.82Å; W56-L100 HydrophobicContact CB-CD1 4.4Å; W56-L100 HydrophobicContact CB-CD2 4.27Å; W56-L100 HydrophobicContact CD2-CB 3.81Å; W56-L100 HydrophobicContact CD2-CD2 4.22Å; W56-L100 HydrophobicContact CE3-CD2 4.43Å; W56-L100 HydrophobicContact CG-CB 3.88Å; W56-L100 HydrophobicContact CG-CD1 4.28Å; W56-L100 HydrophobicContact CG-CD2 4.16Å; W56-L100 HydrophobicContact CG-CG 4.34Å; W56-L100 HydrophobicContact CZ2-CB 4.22Å; I68-L100 HydrophobicContact CD1-CD2 3.97Å; I68-L100 HydrophobicContact CG2-CD1 3.85Å; I68-L100 HydrophobicContact CG2-CD2 4.44Å; V87-L100 HydrophobicContact CG1-CD1 3.47Å; V87-L100 VanDerWaalsContact CG1-CD1 3.47Å; I89-L100 HydrophobicContact CD1-CD1 4.29Å; I89-L100 HydrophobicContact CG1-CD1 3.65Å; L100-Y113 HydrophobicContact CD2-CD1 3.95Å; L100-Y113 HydrophobicContact CD2-CE1 4.03Å
101	K	98.6	Very high	97.6	Very high	112 Å²	112	52.9 Å²	52.9	49%	0.487	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	127.6	163.4	-68.1	-175.7	176.7	-178.5	0	108.9	T36 L37 V87 T88	T36-K101 HydrophobicContact CG2-CB 4.21Å; L37-K101 CarbonylContact O-C 3.56Å; L37-K101 WeakPolarHBondContact O-CA 3.16Å; V87-K101 CarbonylContact C-O 3.52Å; V87-K101 WeakPolarHBondContact CA-O 3.3Å; T88-K101 PolarHBondContact N-O 3.42Å; T88-K101 PolarHBondContact O-N 3.14Å
102	L	98.6	Very high	97.6	Very high	3 Å²	3	54.8 Å²	54.8	2%	0.016	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	108.6	173.7	174.4	64.9	0	0	0	108.2	T36 L37 R86 V87 V105 D109 Y113	T36-L102 CarbonylContact C-O 3.51Å; T36-L102 WeakPolarHBondContact CA-O 3.34Å; L37-L102 HydrophobicContact CB-CB 4.32Å; L37-L102 PolarHBondContact N-O 3.11Å; L37-L102 PolarHBondContact O-N 2.98Å; R86-L102 HydrophobicContact CB-CD1 3.81Å; R86-L102 WeakPolarHBondContact O-CA 3.36Å; V87-L102 HydrophobicContact CG2-CD1 3.65Å; L102-V105 HydrophobicContact CD2-CG1 4.36Å; L102-V105 HydrophobicContact CG-CG1 4.2Å; L102-V105 WeakPolarHBondContact O-CG1 3.48Å; L102-D109 HydrophobicContact CD2-CB 3.9Å; L102-Y113 WeakPolarHBondContact CD2-OH 3.46Å
103	S	98.3	Very high	97.7	Very high	41 Å²	41	53.8 Å²	53.8	29%	0.287	32%	0.322	S	S	.	.			trans	-83.6	161.4	-179.6	63.4	0	0	0	0	112.1	R86 V105	R86-S103 WeakPolarHBondContact CA-OG 3.25Å; R86-S103 PolarHBondContact NH1-O 3.11Å; R86-S103 PolarHBondContact O-N 2.95Å; R86-S103 PolarHBondContact O-OG 3.4Å; S103-V105 VanDerWaalsContact C-N 3.34Å; S103-V105 PolarHBondContact O-N 2.98Å
104	S	97.7	Very high	97.8	Very high	66 Å²	66	53.2 Å²	53.2	46%	0.462	32%	0.318	S	S	.	.	S	Bend	trans	50.9	52.9	175.8	-55.3	0	0	0	0	111.8	E35 R86	E35-S104 PolarHBondContact O-N 3.28Å; R86-S104 PolarHBondContact NH1-O 3.28Å
105	V	98.1	Very high	97.9	Very high	12 Å²	12	48.6 Å²	48.6	7%	0.073	29%	0.285	C	S	.	.			trans	-63	143.6	-176.1	-61.2	0	0	0	0	111.4	V31 K32 S34 E35 L37 L102 S103	V31-V105 HydrophobicContact CB-CG2 4.43Å; V31-V105 HydrophobicContact CG1-CG2 3.81Å; K32-V105 WeakPolarHBondContact O-CG2 3.41Å; S34-V105 PolarHBondContact N-O 3.27Å; E35-V105 WeakPolarHBondContact O-CG2 3.35Å; E35-V105 PolarHBondContact O-N 2.86Å; E35-V105 VanDerWaalsContact O-N 3.08Å; L37-V105 HydrophobicContact CB-CG1 3.78Å; L102-V105 HydrophobicContact CD2-CG1 4.36Å; L102-V105 HydrophobicContact CG-CG1 4.2Å; L102-V105 WeakPolarHBondContact O-CG1 3.48Å; S103-V105 VanDerWaalsContact C-N 3.34Å; S103-V105 PolarHBondContact O-N 2.98Å
106	T	97.4	Very high	97.9	Very high	73 Å²	73	44.3 Å²	44.3	45%	0.448	27%	0.274	S	S	.	.			trans	-126.6	170.1	179.3	67.5	0	0	0	0	110.2	A108 D109	T106-A108 PolarHBondContact O-N 3.22Å; T106-A108 VanDerWaalsContact O-N 3.15Å; T106-A108 PolarHBondContact OG1-N 2.89Å; T106-D109 PolarHBondContact N-OD2 3.47Å; T106-D109 WeakPolarHBondContact O-CB 3.21Å; T106-D109 PolarHBondContact O-N 3.43Å; T106-D109 PolarHBondContact OG1-OD2 2.76Å
107	A	96.8	Very high	97.6	Very high	88 Å²	88	50.2 Å²	50.2	73%	0.727	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-56.9	-29.4	173.8	0	0	0	0	0	112.9	D109 T110	A107-D109 PolarHBondContact O-N 3.19Å; A107-T110 VanDerWaalsContact O-CB 3.32Å; A107-T110 WeakPolarHBondContact O-CB 3.17Å; A107-T110 PolarHBondContact O-N 2.94Å; A107-T110 VanDerWaalsContact O-N 3.15Å; A107-T110 PolarHBondContact O-OG1 3.01Å
108	A	96.3	Very high	97.6	Very high	75 Å²	75	51 Å²	51	62%	0.62	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-68.1	-15.3	176.8	0	0	0	0	0	113.6	T106 T110	T106-A108 PolarHBondContact O-N 3.22Å; T106-A108 VanDerWaalsContact O-N 3.15Å; T106-A108 PolarHBondContact OG1-N 2.89Å; A108-T110 VanDerWaalsContact C-N 3.32Å
109	D	97.8	Very high	97.6	Very high	9 Å²	9	53.7 Å²	53.7	5%	0.048	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-89.4	1	176.1	-56.3	-58.8	0	0	0	112.6	R58 R86 L102 T106 A107 A111 Y113	R58-D109 IonicContact CZ-OD1 3.7Å; R58-D109 IonicContact NH1-OD1 3.69Å; R58-D109 PolarHBondContact NH1-OD1 3.09Å; R86-D109 IonicContact CZ-OD1 3.16Å; R86-D109 IonicContact CZ-OD2 2.72Å; R86-D109 IonicContact NH1-OD1 2.77Å; R86-D109 IonicContact NH1-OD2 3.32Å; R86-D109 PolarHBondContact NH1-OD2 2.61Å; R86-D109 IonicContact NH2-OD1 3.39Å; R86-D109 PolarHBondContact NH2-OD1 2.84Å; R86-D109 IonicContact NH2-OD2 2.76Å; R86-D109 PolarHBondContact NH2-OD2 2.79Å; L102-D109 HydrophobicContact CD2-CB 3.9Å; T106-D109 PolarHBondContact N-OD2 3.47Å; T106-D109 WeakPolarHBondContact O-CB 3.21Å; T106-D109 PolarHBondContact O-N 3.43Å; T106-D109 PolarHBondContact OG1-OD2 2.76Å; A107-D109 PolarHBondContact O-N 3.19Å; D109-A111 PolarHBondContact O-N 2.96Å; D109-A111 VanDerWaalsContact O-N 3.11Å; D109-Y113 PolarHBondContact O-OH 2.86Å
110	T	97.8	Very high	97.6	Very high	91 Å²	91	55.6 Å²	55.6	56%	0.558	33%	0.325	S	S	*	.			trans	-65.3	111.4	173	-52.8	0	0	0	0	109.6	P61 A107 A108	P61-T110 WeakPolarHBondContact CD-O 3.41Å; A107-T110 VanDerWaalsContact O-CB 3.32Å; A107-T110 WeakPolarHBondContact O-CB 3.17Å; A107-T110 PolarHBondContact O-N 2.94Å; A107-T110 VanDerWaalsContact O-N 3.15Å; A107-T110 PolarHBondContact O-OG1 3.01Å; A108-T110 VanDerWaalsContact C-N 3.32Å
111	A	98.2	Very high	97.5	Very high	24 Å²	24	58.8 Å²	58.8	20%	0.198	34%	0.344	C	S	.	.	S	Bend	trans	-161.6	164.4	-177.1	0	0	0	0	0	111	R58 Q59 P60 D109 Y113	R58-A111 HydrophobicContact CB-CB 3.81Å; R58-A111 HydrophobicContact CG-CB 4.31Å; Q59-A111 WeakPolarHBondContact O-CA 3.23Å; Q59-A111 WeakPolarHBondContact O-CB 3.2Å; P60-A111 HydrophobicContact CB-CB 4.49Å; P60-A111 HydrophobicContact CG-CB 4.31Å; D109-A111 PolarHBondContact O-N 2.96Å; D109-A111 VanDerWaalsContact O-N 3.11Å; A111-Y113 HydrophobicContact CB-CD2 4.34Å; A111-Y113 HydrophobicContact CB-CE2 3.92Å; A111-Y113 WeakPolarHBondContact O-CD2 3.21Å
112	V	98.3	Very high	97.4	Very high	79 Å²	79	55.4 Å²	55.4	48%	0.479	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	134.4	159.8	-170.8	0	0	0	0	108	R58 Q59 Y114	R58-V112 CarbonylContact C-O 3.5Å; R58-V112 WeakPolarHBondContact CA-O 3.25Å; Q59-V112 PolarHBondContact N-O 3.38Å; Q59-V112 PolarHBondContact O-N 2.86Å; V112-Y114 HydrophobicContact CB-CE2 3.93Å; V112-Y114 HydrophobicContact CG1-CD1 4.49Å; V112-Y114 HydrophobicContact CG1-CE1 3.75Å; V112-Y114 HydrophobicContact CG1-CE2 3.8Å; V112-Y114 VanDerWaalsContact CG1-OH 3.32Å; V112-Y114 WeakPolarHBondContact CG1-OH 2.85Å
113	Y	98.6	Very high	97.3	Very high	26 Å²	26	58.9 Å²	58.9	10%	0.102	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	134.9	-179.3	-72.6	-104.7	0	0	0	109.7	L37 L39 V57 R58 I68 L100 L102 D109 A111	L37-Y113 HydrophobicContact CD2-CD2 4.33Å; L37-Y113 HydrophobicContact CD2-CE1 4.11Å; L37-Y113 HydrophobicContact CD2-CE2 3.77Å; L39-Y113 HydrophobicContact CD1-CD1 3.57Å; L39-Y113 HydrophobicContact CD1-CD2 4.13Å; L39-Y113 HydrophobicContact CD1-CE1 4.35Å; L39-Y113 HydrophobicContact CD1-CG 3.43Å; L39-Y113 VanDerWaalsContact CD1-CG 3.43Å; V57-Y113 WeakPolarHBondContact O-CA 3.43Å; R58-Y113 HydrophobicContact CB-CD1 3.89Å; R58-Y113 HydrophobicContact CB-CE1 3.91Å; R58-Y113 HydrophobicContact CB-CG 4.23Å; I68-Y113 HydrophobicContact CD1-CD1 3.65Å; I68-Y113 HydrophobicContact CD1-CE1 3.58Å; L100-Y113 HydrophobicContact CD2-CD1 3.95Å; L100-Y113 HydrophobicContact CD2-CE1 4.03Å; L102-Y113 WeakPolarHBondContact CD2-OH 3.46Å; D109-Y113 PolarHBondContact O-OH 2.86Å; A111-Y113 HydrophobicContact CB-CD2 4.34Å; A111-Y113 HydrophobicContact CB-CE2 3.92Å; A111-Y113 WeakPolarHBondContact O-CD2 3.21Å
114	Y	98.5	Very high	97.3	Very high	90 Å²	90	60.2 Å²	60.2	35%	0.353	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	141.5	-177.6	-57.2	-76.7	0	0	0	109.8	E25 V57 Q59 L65 V112	E25-Y114 WeakPolarHBondContact OE1-CA 3.13Å; V57-Y114 PolarHBondContact N-O 3.01Å; V57-Y114 PolarHBondContact O-N 2.85Å; Q59-Y114 HydrophobicContact CB-CE2 3.97Å; L65-Y114 HydrophobicContact CD2-CD2 4.35Å; L65-Y114 HydrophobicContact CD2-CE2 4.37Å; V112-Y114 HydrophobicContact CB-CE2 3.93Å; V112-Y114 HydrophobicContact CG1-CD1 4.49Å; V112-Y114 HydrophobicContact CG1-CE1 3.75Å; V112-Y114 HydrophobicContact CG1-CE2 3.8Å; V112-Y114 VanDerWaalsContact CG1-OH 3.32Å; V112-Y114 WeakPolarHBondContact CG1-OH 2.85Å
115	C	98.1	Very high	97.2	Very high	11 Å²	11	59.8 Å²	59.8	7%	0.074	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	147.1	160.3	39.8	0	0	0	0	111.3	L23 E25 C41 S55 W56 F98	L23-C115 HydrophobicContact CD1-CB 4.3Å; E25-C115 HydrophobicContact CG-CB 4.46Å; E25-C115 WeakPolarHBondContact CG-SG 3.37Å; E25-C115 PolarHBondContact OE1-N 3.12Å; E25-C115 PolarHBondContact OE1-SG 3.2Å; C41-C115 HydrophobicContact CB-CB 3.41Å; C41-C115 VanDerWaalsContact CB-CB 3.41Å; C41-C115 WeakPolarHBondContact CB-SG 3.48Å; C41-C115 WeakPolarHBondContact SG-CB 3.4Å; C41-C115 CovalentContact SG-SG 2.02Å; C41-C115 PolarHBondContact SG-SG 3.27Å; S55-C115 CarbonylContact O-C 3.59Å; S55-C115 WeakPolarHBondContact O-CA 3.11Å; W56-C115 HydrophobicContact CE3-CB 4.45Å; W56-C115 HydrophobicContact CH2-CB 4.41Å; W56-C115 HydrophobicContact CZ3-CB 4.33Å; F98-C115 HydrophobicContact CE1-CB 4.16Å; F98-C115 HydrophobicContact CE2-CB 4.16Å; F98-C115 HydrophobicContact CZ-CB 3.44Å; F98-C115 VanDerWaalsContact CZ-CB 3.44Å
116	A	96.9	Very high	97.2	Very high	37 Å²	37	63.8 Å²	63.8	31%	0.306	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	155.4	179.3	0	0	0	0	0	110.9	S55	S55-A116 PolarHBondContact N-O 3.44Å; S55-A116 PolarHBondContact O-N 2.96Å
117	R	91.3	Very high	97.1	Very high	162 Å²	162	62.9 Å²	62.9	61%	0.611	37%	0.371	S	S	*	.			trans	-123.5	0	170.7	-174.1	-175.2	70.9	152.7	-8.6	108.9	L23 N52 W54	L23-R117 HydrophobicContact CD1-CB 4.45Å; N52-R117 HydrophobicContact CB-CG 4.02Å; N52-R117 PolarHBondContact ND2-NH1 3.27Å; W54-R117 HydrophobicContact CD2-CG 4.49Å; W54-R117 HydrophobicContact CE3-CB 3.76Å; W54-R117 HydrophobicContact CE3-CG 3.8Å; W54-R117 HydrophobicContact CH2-CB 4.42Å; W54-R117 HydrophobicContact CH2-CG 3.89Å; W54-R117 HydrophobicContact CZ3-CB 3.56Å; W54-R117 HydrophobicContact CZ3-CG 3.49Å; W54-R117 VanDerWaalsContact CZ3-CG 3.49Å

Retrieved 117 of 117 residues in 109.8 ms (Link to these results)

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