A0A096MVX7_PAPAN Loading...

Gastrokine-2

AlphaFold DB , UniProt , Accession A0A096MVX7, Species PAPAN (Papio anubis, Olive baboon), Gene GKN2, Length 184 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	43	Very low	49.8	Very low	241 Å²	241	159.9 Å²	159.9	100%	1.187	85%	0.849	S	S	*	*				0	101.7	0	-76.2	158.8	64.9	0	0	108.2
2	K	47	Very low	50	Low	210 Å²	210	158.3 Å²	158.3	91%	0.913	85%	0.85	S	S	*	*			trans	-131.4	30	-162.1	-134.3	177.6	-176.4	-177.4	0	111.3
3	I	51.4	Low	50.4	Low	160 Å²	160	153.5 Å²	153.5	82%	0.821	84%	0.836	S	S	*	*			trans	-134.5	38.9	-167.1	-46	174.4	0	0	0	111.4
4	L	50.5	Low	50.7	Low	160 Å²	160	158.1 Å²	158.1	84%	0.838	85%	0.845	S	S	*	*	S	Bend	trans	-128.5	2.4	175.7	-90.9	159.7	0	0	0	114.7
5	V	51.4	Low	50.3	Low	133 Å²	133	152 Å²	152	81%	0.806	83%	0.834	S	S	*	*	S	Bend	trans	-101.8	-5.6	-176.2	-173	0	0	0	0	112.9
6	A	49.4	Very low	50	Low	85 Å²	85	154.3 Å²	154.3	70%	0.702	84%	0.84	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-5	-172.5	0	0	0	0	0	115.5
7	F	48.5	Very low	49.8	Very low	194 Å²	194	156 Å²	156	85%	0.851	84%	0.841	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	2.2	-173.6	-93.3	-79	0	0	0	115.9
8	L	48.9	Very low	49.9	Very low	164 Å²	164	150.3 Å²	150.3	86%	0.859	82%	0.815	S	S	*	*	S	Bend	trans	-100.8	10.2	-175.2	-85.7	164.5	0	0	0	115.7
9	V	49.9	Very low	50.4	Low	123 Å²	123	154.5 Å²	154.5	75%	0.745	82%	0.818	S	S	*	*	S	Bend	trans	-111.2	2.4	-175.7	-169.8	0	0	0	0	113.9
10	V	53.8	Low	51.6	Low	124 Å²	124	147.3 Å²	147.3	75%	0.752	78%	0.782	S	S	*	*	S	Bend	trans	-103.7	10.2	-173.2	-171.1	0	0	0	0	114.4
11	L	53.6	Low	53.4	Low	165 Å²	165	145.9 Å²	145.9	86%	0.864	77%	0.767	S	S	*	*	S	Bend	trans	-123.4	23.1	-170.9	-102	140.9	0	0	0	117.2
12	T	52.4	Low	55.8	Low	141 Å²	141	137.2 Å²	137.2	87%	0.865	72%	0.723	S	S	*	*	S	Bend	trans	-116.7	12.3	175.8	60.4	0	0	0	0	115.4
13	S	55.2	Low	57.9	Low	96 Å²	96	130.3 Å²	130.3	67%	0.671	70%	0.699	S	S	*	*			trans	-113.8	48.5	178.5	68.2	0	0	0	0	113.5
14	F	54.6	Low	59.8	Low	218 Å²	218	123.4 Å²	123.4	96%	0.956	66%	0.663	S	S	*	*	S	Bend	trans	-134.3	76.3	158.2	-86.6	-81.5	0	0	0	109.1
15	G	45	Very low	61.6	Low	66 Å²	66	119.7 Å²	119.7	68%	0.68	64%	0.644	S	S	*	*			trans	-169.4	27.5	178.8	0	0	0	0	0	113.2	Q17	G15-Q17 PolarHBondContact O-N 2.96Å
16	M	46.1	Very low	63.2	Low	189 Å²	189	113.7 Å²	113.7	93%	0.931	61%	0.607	S	S	*	*			trans	-73	83.2	156.4	-84	178.2	145.6	0	0	106.3	S18	M16-S18 PolarHBondContact O-N 2.9Å
17	Q	46.3	Very low	64.7	Low	183 Å²	183	114.7 Å²	114.7	86%	0.855	60%	0.6	S	S	*	*			trans	-59.6	97.4	148.7	-82.9	-179.5	-20.5	0	0	104.4	G15 R19	G15-Q17 PolarHBondContact O-N 2.96Å; Q17-R19 VanDerWaalsContact C-N 3.3Å; Q17-R19 PolarHBondContact O-N 2.9Å
18	S	51.9	Low	65.8	Low	54 Å²	54	106.1 Å²	106.1	38%	0.378	56%	0.564	S	S	.	*			trans	-59.1	104.1	169.7	54.9	0	0	0	0	105.3	M16 G20 Y21	M16-S18 PolarHBondContact O-N 2.9Å; S18-G20 PolarHBondContact O-N 2.89Å; S18-Y21 PolarHBondContact O-N 2.84Å; S18-Y21 WeakPolarHBondContact OG-CB 3.45Å
19	R	58.8	Low	66.7	Low	230 Å²	230	103.2 Å²	103.2	87%	0.868	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.7	-13.1	167.2	-65.8	-178	176	-174	-1.8	111.5	Q17	Q17-R19 VanDerWaalsContact C-N 3.3Å; Q17-R19 PolarHBondContact O-N 2.9Å
20	G	74.9	Confident	67.4	Low	10 Å²	10	102.8 Å²	102.8	10%	0.103	54%	0.54	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-22.2	171.6	0	0	0	0	0	116.2	S18 D43 N44	S18-G20 PolarHBondContact O-N 2.89Å; G20-D43 CarbonylContact O-C 3.6Å; G20-D43 VanDerWaalsContact O-CA 3.3Å; G20-D43 WeakPolarHBondContact O-CA 3.26Å; G20-N44 PolarHBondContact O-N 3.43Å
21	Y	88.9	Confident	67.7	Low	118 Å²	118	102.3 Å²	102.3	46%	0.463	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	121.7	-172.2	-175.1	-91.7	0	0	0	111.9	S18 V23 T41 I42 D43	S18-Y21 PolarHBondContact O-N 2.84Å; S18-Y21 WeakPolarHBondContact OG-CB 3.45Å; Y21-V23 HydrophobicContact CD1-CG2 4.2Å; Y21-V23 HydrophobicContact CE1-CG2 3.41Å; Y21-V23 VanDerWaalsContact CE1-CG2 3.41Å; Y21-T41 HydrophobicContact CD2-CG2 4.16Å; Y21-T41 HydrophobicContact CE1-CG2 4.32Å; Y21-T41 HydrophobicContact CE2-CG2 3.28Å; Y21-T41 VanDerWaalsContact OH-CG2 3.29Å; Y21-T41 WeakPolarHBondContact OH-CG2 3.31Å; Y21-I42 CarbonylContact C-O 3.43Å; Y21-I42 VanDerWaalsContact CA-O 3.28Å; Y21-I42 WeakPolarHBondContact CA-O 3.35Å; Y21-D43 HydrophobicContact CD2-CB 4.16Å
22	E	92.2	Very high	68.2	Low	58 Å²	58	98.9 Å²	98.9	27%	0.271	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	145.9	-177.1	-63.9	-175.3	170.2	0	0	111.4	F24 T41 I42 Q98	E22-F24 HydrophobicContact CB-CE2 3.83Å; E22-F24 HydrophobicContact CB-CZ 4.17Å; E22-F24 VanDerWaalsContact OE2-CZ 3.29Å; E22-F24 WeakPolarHBondContact OE2-CZ 3.43Å; E22-T41 CarbonylContact O-C 3.54Å; E22-T41 VanDerWaalsContact O-CA 3.32Å; E22-T41 WeakPolarHBondContact O-CA 3.26Å; E22-I42 PolarHBondContact N-O 2.83Å; E22-I42 PolarHBondContact O-N 3.37Å; E22-Q98 PolarHBondContact OE1-NE2 2.76Å; E22-Q98 WeakPolarHBondContact OE2-CG 3.38Å; E22-Q98 PolarHBondContact OE2-NE2 2.82Å
23	V	92.7	Very high	68.8	Low	66 Å²	66	95.3 Å²	95.3	40%	0.4	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	124.3	179	-175.6	0	0	0	0	109.7	Y21 T39 V40 T41	Y21-V23 HydrophobicContact CD1-CG2 4.2Å; Y21-V23 HydrophobicContact CE1-CG2 3.41Å; Y21-V23 VanDerWaalsContact CE1-CG2 3.41Å; V23-T39 HydrophobicContact CG1-CG2 3.64Å; V23-V40 CarbonylContact C-O 3.54Å; V23-V40 VanDerWaalsContact CA-O 3.3Å; V23-V40 WeakPolarHBondContact CA-O 3.4Å; V23-T41 HydrophobicContact CG2-CG2 4.32Å
24	F	89.8	Confident	69.5	Low	14 Å²	14	95.2 Å²	95.2	6%	0.061	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	129.8	177.2	-53.7	-93	0	0	0	109.2	E22 T39 V40 I42 Q98 S101	E22-F24 HydrophobicContact CB-CE2 3.83Å; E22-F24 HydrophobicContact CB-CZ 4.17Å; E22-F24 VanDerWaalsContact OE2-CZ 3.29Å; E22-F24 WeakPolarHBondContact OE2-CZ 3.43Å; F24-T39 CarbonylContact O-C 3.52Å; F24-T39 WeakPolarHBondContact O-CA 3.46Å; F24-V40 HydrophobicContact CB-CB 4.16Å; F24-V40 HydrophobicContact CD2-CB 4.26Å; F24-V40 PolarHBondContact N-O 3.43Å; F24-V40 PolarHBondContact O-N 3.02Å; F24-I42 HydrophobicContact CE2-CD1 4.05Å; F24-Q98 HydrophobicContact CZ-CG 4.23Å; F24-S101 VanDerWaalsContact CD2-CB 3.44Å; F24-S101 VanDerWaalsContact CG-CB 3.49Å
25	N	90	Very high	70.5	Confident	83 Å²	83	90.1 Å²	90.1	44%	0.444	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.6	172.6	-65.7	-63.8	0	0	0	108.1	T39 Q105	N25-T39 PolarHBondContact OD1-OG1 3.19Å; N25-T39 VanDerWaalsContact OD1-OG1 3.1Å; N25-Q105 PolarHBondContact O-NE2 2.76Å
26	I	83.3	Confident	72.1	Confident	6 Å²	6	87.9 Å²	87.9	3%	0.031	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	138.5	-172.4	-59.7	174.1	0	0	0	107.7	E38 V40 K104 F170	I26-E38 HydrophobicContact CB-CB 4.27Å; I26-E38 PolarHBondContact N-O 2.66Å; I26-E38 PolarHBondContact O-N 2.92Å; I26-V40 HydrophobicContact CD1-CG2 3.75Å; I26-K104 HydrophobicContact CD1-CB 4.26Å; I26-K104 HydrophobicContact CD1-CG 4.06Å; I26-K104 HydrophobicContact CG1-CG 4.45Å; I26-K104 HydrophobicContact CG2-CG 3.75Å; I26-F170 HydrophobicContact CD1-CB 4.48Å; I26-F170 HydrophobicContact CD1-CD1 4.31Å; I26-F170 HydrophobicContact CD1-CD2 3.23Å; I26-F170 HydrophobicContact CD1-CE1 4.31Å; I26-F170 HydrophobicContact CD1-CE2 3.37Å; I26-F170 HydrophobicContact CD1-CG 3.77Å; I26-F170 HydrophobicContact CD1-CZ 3.94Å
27	I	81.1	Confident	74	Confident	107 Å²	107	84 Å²	84	55%	0.549	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	115.6	175.7	-58.4	178.5	0	0	0	107.1	N35	I27-N35 HydrophobicContact CG2-CB 3.67Å
28	S	72.8	Confident	75.9	Confident	14 Å²	14	75.4 Å²	75.4	10%	0.098	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	121.5	-175.6	-72.3	0	0	0	0	109.2	V36 E38	S28-V36 PolarHBondContact N-O 2.71Å; S28-V36 PolarHBondContact O-N 3.46Å; S28-E38 WeakPolarHBondContact CB-OE2 3.23Å; S28-E38 PolarHBondContact OG-OE2 2.86Å
29	P	67.9	Low	77.7	Confident	102 Å²	102	73.8 Å²	73.8	66%	0.662	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	141.5	177.7	27.9	-33.2	0	0	0	110.9
30	R	64.8	Low	79.3	Confident	114 Å²	114	62.8 Å²	62.8	43%	0.43	35%	0.349	S	S	.	.			trans	-101.1	154.7	176.6	-166.4	175.4	-175	171	3	110	N32 G33 D34 V36	R30-N32 VanDerWaalsContact CB-OD1 3.25Å; R30-N32 WeakPolarHBondContact CB-OD1 3.36Å; R30-N32 VanDerWaalsContact CD-OD1 3.27Å; R30-N32 WeakPolarHBondContact CD-OD1 3.28Å; R30-N32 WeakPolarHBondContact CG-OD1 3.3Å; R30-N32 PolarHBondContact O-N 3.5Å; R30-G33 PolarHBondContact O-N 2.86Å; R30-D34 WeakPolarHBondContact CA-O 3.36Å; R30-D34 WeakPolarHBondContact CB-O 3.33Å; R30-D34 PolarHBondContact N-O 2.86Å; R30-V36 HydrophobicContact CB-CG2 4.47Å
31	S	58.8	Low	80.2	Confident	114 Å²	114	63.1 Å²	63.1	80%	0.797	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.2	-177.5	56.3	0	0	0	0	115.1
32	N	65.5	Low	80.4	Confident	93 Å²	93	57.5 Å²	57.5	50%	0.497	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	3.8	176	66.5	-25.5	0	0	0	113.2	R30 D34	R30-N32 VanDerWaalsContact CB-OD1 3.25Å; R30-N32 WeakPolarHBondContact CB-OD1 3.36Å; R30-N32 VanDerWaalsContact CD-OD1 3.27Å; R30-N32 WeakPolarHBondContact CD-OD1 3.28Å; R30-N32 WeakPolarHBondContact CG-OD1 3.3Å; R30-N32 PolarHBondContact O-N 3.5Å; N32-D34 PolarHBondContact ND2-OD2 3.1Å; N32-D34 PolarHBondContact OD1-N 3.42Å
33	G	64.9	Low	80.4	Confident	66 Å²	66	55.3 Å²	55.3	68%	0.68	32%	0.317	S	S	*	.	S	Bend	trans	91.2	-6.8	-178.8	0	0	0	0	0	115	R30	R30-G33 PolarHBondContact O-N 2.86Å
34	D	69.9	Low	80.4	Confident	94 Å²	94	55.1 Å²	55.1	50%	0.503	31%	0.314	S	S	.	.			trans	-79.3	157.4	174.8	-65	-30.9	0	0	0	111.5	R30 N32	R30-D34 WeakPolarHBondContact CA-O 3.36Å; R30-D34 WeakPolarHBondContact CB-O 3.33Å; R30-D34 PolarHBondContact N-O 2.86Å; N32-D34 PolarHBondContact ND2-OD2 3.1Å; N32-D34 PolarHBondContact OD1-N 3.42Å
35	N	75.3	Confident	80.4	Confident	112 Å²	112	61.9 Å²	61.9	60%	0.599	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.5	140.9	172.2	-70.9	-31.5	0	0	0	110.8	I27	I27-N35 HydrophobicContact CG2-CB 3.67Å
36	V	78.8	Confident	80.5	Confident	19 Å²	19	63.9 Å²	63.9	12%	0.115	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	129.6	171.8	176.8	0	0	0	0	108.5	S28 R30 E38 I53 A55	S28-V36 PolarHBondContact N-O 2.71Å; S28-V36 PolarHBondContact O-N 3.46Å; R30-V36 HydrophobicContact CB-CG2 4.47Å; V36-E38 HydrophobicContact CG1-CG 4.05Å; V36-I53 HydrophobicContact CG1-CG2 3.66Å; V36-A55 HydrophobicContact CG1-CB 4.02Å; V36-A55 HydrophobicContact CG2-CB 4.32Å
37	Q	85.2	Confident	80.9	Confident	106 Å²	106	66.7 Å²	66.7	50%	0.495	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	133.1	172.6	-176.3	177.3	-5.6	0	0	109.6	H54	Q37-H54 HydrophobicContact CB-CB 4.42Å; Q37-H54 WeakPolarHBondContact O-CB 3.46Å; Q37-H54 PolarHBondContact O-CD2 2.85Å; Q37-H54 PolarHBondContact O-N 3.12Å
38	E	86.5	Confident	81.5	Confident	3 Å²	3	62.1 Å²	62.1	1%	0.014	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	138	-179	-58.9	-179.8	137.7	0	0	108.9	I26 S28 V36 N52 I53 G169 F170	I26-E38 HydrophobicContact CB-CB 4.27Å; I26-E38 PolarHBondContact N-O 2.66Å; I26-E38 PolarHBondContact O-N 2.92Å; S28-E38 WeakPolarHBondContact CB-OE2 3.23Å; S28-E38 PolarHBondContact OG-OE2 2.86Å; V36-E38 HydrophobicContact CG1-CG 4.05Å; E38-N52 CarbonylContact C-O 3.47Å; E38-N52 VanDerWaalsContact CA-O 3.24Å; E38-N52 WeakPolarHBondContact CA-O 3.37Å; E38-I53 HydrophobicContact CG-CG1 4.24Å; E38-I53 HydrophobicContact CG-CG2 4.32Å; E38-G169 WeakPolarHBondContact OE1-CA 3.35Å; E38-F170 HydrophobicContact CB-CB 4.48Å; E38-F170 VanDerWaalsContact CD-N 3.27Å; E38-F170 PolarHBondContact OE1-N 3.14Å; E38-F170 VanDerWaalsContact OE2-CB 3.24Å; E38-F170 WeakPolarHBondContact OE2-CB 3.41Å; E38-F170 PolarHBondContact OE2-N 3.07Å
39	T	90.4	Very high	82.5	Confident	20 Å²	20	61.4 Å²	61.4	12%	0.123	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	128.5	177.3	-59.7	0	0	0	0	109.6	V23 F24 N25 V51 N52	V23-T39 HydrophobicContact CG1-CG2 3.64Å; F24-T39 CarbonylContact O-C 3.52Å; F24-T39 WeakPolarHBondContact O-CA 3.46Å; N25-T39 PolarHBondContact OD1-OG1 3.19Å; N25-T39 VanDerWaalsContact OD1-OG1 3.1Å; T39-V51 CarbonylContact O-C 3.56Å; T39-V51 WeakPolarHBondContact O-CA 3.3Å; T39-N52 PolarHBondContact N-O 2.91Å; T39-N52 PolarHBondContact O-N 3.5Å
40	V	90.7	Very high	83.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.8	175.8	-168.3	0	0	0	0	108	V23 F24 I26 I42 I50 V51 S101 F170 W174	V23-V40 CarbonylContact C-O 3.54Å; V23-V40 VanDerWaalsContact CA-O 3.3Å; V23-V40 WeakPolarHBondContact CA-O 3.4Å; F24-V40 HydrophobicContact CB-CB 4.16Å; F24-V40 HydrophobicContact CD2-CB 4.26Å; F24-V40 PolarHBondContact N-O 3.43Å; F24-V40 PolarHBondContact O-N 3.02Å; I26-V40 HydrophobicContact CD1-CG2 3.75Å; V40-I42 HydrophobicContact CG1-CG1 4.3Å; V40-I50 CarbonylContact C-O 3.55Å; V40-I50 WeakPolarHBondContact CA-O 3.29Å; V40-V51 HydrophobicContact CG1-CG2 4.22Å; V40-S101 WeakPolarHBondContact CG1-OG 3.36Å; V40-F170 HydrophobicContact CB-CE1 4.06Å; V40-F170 HydrophobicContact CG1-CE1 3.86Å; V40-F170 HydrophobicContact CG2-CD1 3.28Å; V40-F170 HydrophobicContact CG2-CE1 3.09Å; V40-F170 HydrophobicContact CG2-CG 4.01Å; V40-F170 HydrophobicContact CG2-CZ 3.83Å; V40-W174 HydrophobicContact CG1-CH2 3.67Å; V40-W174 HydrophobicContact CG1-CZ2 3.92Å
41	T	94	Very high	85	Confident	17 Å²	17	53.5 Å²	53.5	10%	0.104	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	127.6	175.8	-57.7	0	0	0	0	108.7	Y21 E22 V23 A49 I50	Y21-T41 HydrophobicContact CD2-CG2 4.16Å; Y21-T41 HydrophobicContact CE1-CG2 4.32Å; Y21-T41 HydrophobicContact CE2-CG2 3.28Å; Y21-T41 VanDerWaalsContact OH-CG2 3.29Å; Y21-T41 WeakPolarHBondContact OH-CG2 3.31Å; E22-T41 CarbonylContact O-C 3.54Å; E22-T41 VanDerWaalsContact O-CA 3.32Å; E22-T41 WeakPolarHBondContact O-CA 3.26Å; V23-T41 HydrophobicContact CG2-CG2 4.32Å; T41-A49 CarbonylContact O-C 3.55Å; T41-A49 VanDerWaalsContact O-CA 3.27Å; T41-A49 WeakPolarHBondContact O-CA 3.32Å; T41-I50 PolarHBondContact N-O 2.98Å; T41-I50 PolarHBondContact O-N 2.95Å
42	I	92.9	Very high	86.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	124.5	178	-66.6	-178.1	0	0	0	107.8	Y21 E22 F24 V40 A49 L94 Q98	Y21-I42 CarbonylContact C-O 3.43Å; Y21-I42 VanDerWaalsContact CA-O 3.28Å; Y21-I42 WeakPolarHBondContact CA-O 3.35Å; E22-I42 PolarHBondContact N-O 2.83Å; E22-I42 PolarHBondContact O-N 3.37Å; F24-I42 HydrophobicContact CE2-CD1 4.05Å; V40-I42 HydrophobicContact CG1-CG1 4.3Å; I42-A49 HydrophobicContact CG1-CB 4.25Å; I42-L94 HydrophobicContact CG2-CD1 4.06Å; I42-L94 HydrophobicContact CG2-CD2 4.4Å; I42-L94 HydrophobicContact CG2-CG 4.25Å; I42-Q98 HydrophobicContact CD1-CB 3.48Å; I42-Q98 VanDerWaalsContact CD1-CB 3.48Å; I42-Q98 HydrophobicContact CD1-CG 3.92Å
43	D	93.8	Very high	87.5	Confident	12 Å²	12	46.1 Å²	46.1	6%	0.064	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	94.2	175.2	-173.1	-27.5	0	0	0	107.8	G20 Y21 E45 K46 N47 T48	G20-D43 CarbonylContact O-C 3.6Å; G20-D43 VanDerWaalsContact O-CA 3.3Å; G20-D43 WeakPolarHBondContact O-CA 3.26Å; Y21-D43 HydrophobicContact CD2-CB 4.16Å; D43-E45 VanDerWaalsContact C-N 3.26Å; D43-E45 PolarHBondContact O-N 3.15Å; D43-E45 WeakPolarHBondContact OD1-CB 3.44Å; D43-E45 PolarHBondContact OD1-N 3.14Å; D43-E45 VanDerWaalsContact OD1-N 3.1Å; D43-K46 HydrophobicContact CB-CB 4.25Å; D43-K46 PolarHBondContact O-N 3.24Å; D43-K46 PolarHBondContact OD1-N 2.74Å; D43-K46 WeakPolarHBondContact OD2-CD 3.16Å; D43-K46 WeakPolarHBondContact OD2-CG 3.19Å; D43-K46 IonicContact OD2-NZ 2.66Å; D43-K46 PolarHBondContact OD2-NZ 2.99Å; D43-N47 WeakPolarHBondContact O-CA 3.3Å; D43-N47 PolarHBondContact O-N 3.41Å; D43-T48 PolarHBondContact N-O 3.23Å; D43-T48 PolarHBondContact O-N 2.94Å
44	N	91.1	Very high	88.5	Confident	61 Å²	61	47.5 Å²	47.5	33%	0.326	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-25.5	177.8	-71.1	-61.8	0	0	0	112.3	G20 N47	G20-N44 PolarHBondContact O-N 3.43Å; N44-N47 PolarHBondContact O-N 3.28Å
45	E	91.2	Very high	89.1	Confident	157 Å²	157	44.1 Å²	44.1	73%	0.734	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-41.2	176.3	-65.7	-177.2	-178.9	0	0	110.9	D43 N47	D43-E45 VanDerWaalsContact C-N 3.26Å; D43-E45 PolarHBondContact O-N 3.15Å; D43-E45 WeakPolarHBondContact OD1-CB 3.44Å; D43-E45 PolarHBondContact OD1-N 3.14Å; D43-E45 VanDerWaalsContact OD1-N 3.1Å; E45-N47 VanDerWaalsContact C-N 3.33Å
46	K	91.4	Very high	89.5	Confident	125 Å²	125	41.5 Å²	41.5	54%	0.543	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-10.5	174.9	-62.2	-168	-169.4	88.5	0	113.4	D43 T48	D43-K46 HydrophobicContact CB-CB 4.25Å; D43-K46 PolarHBondContact O-N 3.24Å; D43-K46 PolarHBondContact OD1-N 2.74Å; D43-K46 WeakPolarHBondContact OD2-CD 3.16Å; D43-K46 WeakPolarHBondContact OD2-CG 3.19Å; D43-K46 IonicContact OD2-NZ 2.66Å; D43-K46 PolarHBondContact OD2-NZ 2.99Å; K46-T48 HydrophobicContact CB-CG2 4.04Å
47	N	92.7	Very high	89.4	Confident	64 Å²	64	45 Å²	45	34%	0.342	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	49.2	-172	-161.3	27.7	0	0	0	111.5	D43 N44 E45 Y66 L94	D43-N47 WeakPolarHBondContact O-CA 3.3Å; D43-N47 PolarHBondContact O-N 3.41Å; N44-N47 PolarHBondContact O-N 3.28Å; E45-N47 VanDerWaalsContact C-N 3.33Å; N47-Y66 VanDerWaalsContact ND2-CB 3.26Å; N47-Y66 WeakPolarHBondContact ND2-CB 3.04Å; N47-Y66 WeakPolarHBondContact O-CB 3.39Å; N47-Y66 PolarHBondContact O-N 2.96Å; N47-Y66 VanDerWaalsContact O-N 3.15Å; N47-L94 VanDerWaalsContact OD1-CD2 3.31Å; N47-L94 WeakPolarHBondContact OD1-CD2 3.32Å
48	T	93.7	Very high	89	Confident	11 Å²	11	42.7 Å²	42.7	7%	0.067	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	147.4	-177.6	62.4	0	0	0	0	112.6	D43 K46 F64 D65	D43-T48 PolarHBondContact N-O 3.23Å; D43-T48 PolarHBondContact O-N 2.94Å; K46-T48 HydrophobicContact CB-CG2 4.04Å; T48-F64 CarbonylContact C-O 3.59Å; T48-F64 WeakPolarHBondContact CA-O 3.29Å; T48-D65 HydrophobicContact CG2-CB 4.46Å
49	A	93.3	Very high	88.9	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	142.7	164.7	0	0	0	0	0	110.8	T41 I42 I63 F64 L94 L97 W174	T41-A49 CarbonylContact O-C 3.55Å; T41-A49 VanDerWaalsContact O-CA 3.27Å; T41-A49 WeakPolarHBondContact O-CA 3.32Å; I42-A49 HydrophobicContact CG1-CB 4.25Å; A49-I63 CarbonylContact O-C 3.53Å; A49-I63 WeakPolarHBondContact O-CA 3.01Å; A49-F64 HydrophobicContact CB-CB 4.15Å; A49-F64 HydrophobicContact CB-CD2 4.4Å; A49-F64 PolarHBondContact N-O 3.02Å; A49-F64 PolarHBondContact O-N 3.3Å; A49-L94 HydrophobicContact CB-CD1 3.74Å; A49-L97 HydrophobicContact CB-CD1 3.78Å; A49-W174 HydrophobicContact CB-CH2 4.31Å
50	I	93.8	Very high	88.7	Confident	49 Å²	49	43.3 Å²	43.3	25%	0.251	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	127.3	177.2	-49.5	-176	0	0	0	108.4	V40 T41 T61 T62 I63	V40-I50 CarbonylContact C-O 3.55Å; V40-I50 WeakPolarHBondContact CA-O 3.29Å; T41-I50 PolarHBondContact N-O 2.98Å; T41-I50 PolarHBondContact O-N 2.95Å; I50-T61 HydrophobicContact CG2-CG2 3.96Å; I50-T62 CarbonylContact C-O 3.57Å; I50-T62 VanDerWaalsContact CA-O 3.31Å; I50-T62 WeakPolarHBondContact CA-O 3.36Å; I50-I63 HydrophobicContact CD1-CG1 4.48Å; I50-I63 HydrophobicContact CG1-CG1 4.16Å; I50-I63 HydrophobicContact CG2-CG1 4.24Å
51	V	90.8	Very high	88.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.2	173.2	-177.6	0	0	0	0	108.8	T39 V40 I53 T61 T62 F64 F170 L171 W174	T39-V51 CarbonylContact O-C 3.56Å; T39-V51 WeakPolarHBondContact O-CA 3.3Å; V40-V51 HydrophobicContact CG1-CG2 4.22Å; V51-I53 HydrophobicContact CG1-CG1 4.29Å; V51-T61 CarbonylContact O-C 3.57Å; V51-T61 WeakPolarHBondContact O-CA 3.3Å; V51-T62 PolarHBondContact N-O 3Å; V51-T62 PolarHBondContact O-N 2.63Å; V51-F64 HydrophobicContact CG2-CE2 4.44Å; V51-F170 HydrophobicContact CG1-CD1 4.16Å; V51-F170 HydrophobicContact CG2-CD1 4.1Å; V51-F170 HydrophobicContact CG2-CE1 4.43Å; V51-L171 HydrophobicContact CB-CD2 4.03Å; V51-L171 HydrophobicContact CB-CG 4.45Å; V51-L171 HydrophobicContact CG1-CD2 4.19Å; V51-L171 HydrophobicContact CG1-CG 4.11Å; V51-L171 HydrophobicContact CG2-CD2 3.97Å; V51-W174 HydrophobicContact CG2-CE3 3.95Å; V51-W174 HydrophobicContact CG2-CH2 3.41Å; V51-W174 VanDerWaalsContact CG2-CH2 3.41Å; V51-W174 HydrophobicContact CG2-CZ2 4.46Å; V51-W174 HydrophobicContact CG2-CZ3 3.1Å
52	N	90.8	Very high	88.8	Confident	37 Å²	37	44.3 Å²	44.3	20%	0.198	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.7	172.5	-63.1	-70.5	0	0	0	109	E38 T39 S60 T61	E38-N52 CarbonylContact C-O 3.47Å; E38-N52 VanDerWaalsContact CA-O 3.24Å; E38-N52 WeakPolarHBondContact CA-O 3.37Å; T39-N52 PolarHBondContact N-O 2.91Å; T39-N52 PolarHBondContact O-N 3.5Å; N52-S60 WeakPolarHBondContact CA-O 3.24Å; N52-T61 VanDerWaalsContact OD1-CG2 3.28Å; N52-T61 WeakPolarHBondContact OD1-CG2 3.44Å; N52-T61 PolarHBondContact OD1-OG1 2.86Å
53	I	86.4	Confident	88.8	Confident	15 Å²	15	44.8 Å²	44.8	8%	0.077	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	118.6	174	-58.9	-177.5	0	0	0	107.5	V36 E38 V51 A55 S59 S60 L171	V36-I53 HydrophobicContact CG1-CG2 3.66Å; E38-I53 HydrophobicContact CG-CG1 4.24Å; E38-I53 HydrophobicContact CG-CG2 4.32Å; V51-I53 HydrophobicContact CG1-CG1 4.29Å; I53-A55 HydrophobicContact CG2-CB 4.07Å; I53-A55 PolarHBondContact O-N 2.71Å; I53-S59 WeakPolarHBondContact O-CA 3.13Å; I53-S59 WeakPolarHBondContact O-CB 3.43Å; I53-S59 PolarHBondContact O-OG 2.91Å; I53-S60 PolarHBondContact N-O 3.09Å; I53-S60 PolarHBondContact O-N 3.01Å; I53-L171 HydrophobicContact CD1-CD1 4.17Å; I53-L171 HydrophobicContact CD1-CG 4.47Å
54	H	86.2	Confident	88.8	Confident	96 Å²	96	44.2 Å²	44.2	44%	0.444	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	82.1	-178.2	-59.1	-68.4	0	0	0	110.5	Q37	Q37-H54 HydrophobicContact CB-CB 4.42Å; Q37-H54 WeakPolarHBondContact O-CB 3.46Å; Q37-H54 PolarHBondContact O-CD2 2.85Å; Q37-H54 PolarHBondContact O-N 3.12Å
55	A	82.8	Confident	88.9	Confident	22 Å²	22	41.4 Å²	41.4	18%	0.182	24%	0.239	C	C	.	.			trans	-124.6	34.9	-173.8	0	0	0	0	0	113	V36 I53 S57 C58 S59	V36-A55 HydrophobicContact CG1-CB 4.02Å; V36-A55 HydrophobicContact CG2-CB 4.32Å; I53-A55 HydrophobicContact CG2-CB 4.07Å; I53-A55 PolarHBondContact O-N 2.71Å; A55-S57 PolarHBondContact O-N 3.35Å; A55-C58 HydrophobicContact CB-CB 4.11Å; A55-C58 PolarHBondContact O-N 2.77Å; A55-C58 VanDerWaalsContact O-N 3.11Å; A55-S59 PolarHBondContact N-OG 2.84Å
56	G	82.1	Confident	89	Confident	57 Å²	57	36 Å²	36	59%	0.588	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	62	-124.3	-178.3	0	0	0	0	0	111.8	C58 S59	G56-C58 PolarHBondContact O-N 2.8Å; G56-S59 PolarHBondContact N-OG 2.82Å; G56-S59 VanDerWaalsContact N-OG 3.13Å; G56-S59 VanDerWaalsContact O-CB 3.31Å; G56-S59 WeakPolarHBondContact O-CB 3.5Å; G56-S59 PolarHBondContact O-N 3.38Å; G56-S59 VanDerWaalsContact O-N 3.08Å; G56-S59 PolarHBondContact O-OG 2.86Å
57	S	77.1	Confident	89.1	Confident	94 Å²	94	37.5 Å²	37.5	66%	0.657	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-63.4	-22.6	177	55.6	0	0	0	0	113.6	A55 S59 S77	A55-S57 PolarHBondContact O-N 3.35Å; S57-S59 VanDerWaalsContact C-N 3.32Å; S57-S77 WeakPolarHBondContact O-CA 3.26Å; S57-S77 WeakPolarHBondContact O-CB 3.15Å; S57-S77 PolarHBondContact O-N 2.81Å; S57-S77 VanDerWaalsContact O-N 3.08Å
58	C	76.9	Confident	89.2	Confident	57 Å²	57	37.5 Å²	37.5	39%	0.385	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-91.5	12.5	175.8	-63.9	0	0	0	0	113.3	A55 G56	A55-C58 HydrophobicContact CB-CB 4.11Å; A55-C58 PolarHBondContact O-N 2.77Å; A55-C58 VanDerWaalsContact O-N 3.11Å; G56-C58 PolarHBondContact O-N 2.8Å
59	S	84.4	Confident	89.2	Confident	21 Å²	21	38 Å²	38	15%	0.147	22%	0.224	C	C	.	.			trans	-64.6	150.2	178.5	-54.5	0	0	0	0	111.6	I53 A55 G56 S57 L76	I53-S59 WeakPolarHBondContact O-CA 3.13Å; I53-S59 WeakPolarHBondContact O-CB 3.43Å; I53-S59 PolarHBondContact O-OG 2.91Å; A55-S59 PolarHBondContact N-OG 2.84Å; G56-S59 PolarHBondContact N-OG 2.82Å; G56-S59 VanDerWaalsContact N-OG 3.13Å; G56-S59 VanDerWaalsContact O-CB 3.31Å; G56-S59 WeakPolarHBondContact O-CB 3.5Å; G56-S59 PolarHBondContact O-N 3.38Å; G56-S59 VanDerWaalsContact O-N 3.08Å; G56-S59 PolarHBondContact O-OG 2.86Å; S57-S59 VanDerWaalsContact C-N 3.32Å; S59-L76 WeakPolarHBondContact O-CB 3.33Å; S59-L76 WeakPolarHBondContact O-CG 3.31Å; S59-L76 PolarHBondContact O-N 3.47Å
60	S	87.6	Confident	89.1	Confident	14 Å²	14	40.4 Å²	40.4	10%	0.098	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	154.6	176.7	63.6	0	0	0	0	111.7	N52 I53 R74	N52-S60 WeakPolarHBondContact CA-O 3.24Å; I53-S60 PolarHBondContact N-O 3.09Å; I53-S60 PolarHBondContact O-N 3.01Å; S60-R74 CarbonylContact C-O 3.57Å; S60-R74 WeakPolarHBondContact CA-O 3.29Å; S60-R74 WeakPolarHBondContact CB-O 3.33Å
61	T	92.8	Very high	89	Confident	38 Å²	38	38.5 Å²	38.5	23%	0.233	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	125.5	170.3	-63	0	0	0	0	107.9	I50 V51 N52 S73 R74 L142	I50-T61 HydrophobicContact CG2-CG2 3.96Å; V51-T61 CarbonylContact O-C 3.57Å; V51-T61 WeakPolarHBondContact O-CA 3.3Å; N52-T61 VanDerWaalsContact OD1-CG2 3.28Å; N52-T61 WeakPolarHBondContact OD1-CG2 3.44Å; N52-T61 PolarHBondContact OD1-OG1 2.86Å; T61-S73 CarbonylContact O-C 3.31Å; T61-S73 WeakPolarHBondContact O-CA 3.42Å; T61-R74 PolarHBondContact N-O 2.91Å; T61-R74 PolarHBondContact O-N 3.49Å; T61-L142 HydrophobicContact CG2-CD1 3.74Å; T61-L142 HydrophobicContact CG2-CD2 4.24Å
62	T	92.1	Very high	89.1	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.9	178.3	-54.7	0	0	0	0	110.1	I50 V51 F64 I71 A72 S73 L171	I50-T62 CarbonylContact C-O 3.57Å; I50-T62 VanDerWaalsContact CA-O 3.31Å; I50-T62 WeakPolarHBondContact CA-O 3.36Å; V51-T62 PolarHBondContact N-O 3Å; V51-T62 PolarHBondContact O-N 2.63Å; T62-F64 HydrophobicContact CG2-CD2 4.17Å; T62-F64 HydrophobicContact CG2-CE2 3.55Å; T62-F64 HydrophobicContact CG2-CZ 4.11Å; T62-I71 HydrophobicContact CG2-CG2 3.69Å; T62-A72 CarbonylContact C-O 3.56Å; T62-A72 VanDerWaalsContact CA-O 3.24Å; T62-A72 WeakPolarHBondContact CA-O 3.35Å; T62-S73 WeakPolarHBondContact OG1-CB 3.11Å; T62-S73 PolarHBondContact OG1-OG 3.39Å; T62-L171 HydrophobicContact CG2-CD2 4.17Å; T62-L171 WeakPolarHBondContact OG1-CD1 3.29Å
63	I	94.2	Very high	89.2	Confident	10 Å²	10	36.9 Å²	36.9	5%	0.051	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	128.3	175.7	-64.5	174	0	0	0	108.5	A49 I50 D65 I71 A72 P138 I139 L142	A49-I63 CarbonylContact O-C 3.53Å; A49-I63 WeakPolarHBondContact O-CA 3.01Å; I50-I63 HydrophobicContact CD1-CG1 4.48Å; I50-I63 HydrophobicContact CG1-CG1 4.16Å; I50-I63 HydrophobicContact CG2-CG1 4.24Å; I63-D65 HydrophobicContact CG2-CB 4.37Å; I63-I71 CarbonylContact O-C 3.54Å; I63-I71 VanDerWaalsContact O-CA 3.25Å; I63-I71 WeakPolarHBondContact O-CA 3.42Å; I63-A72 PolarHBondContact N-O 3.22Å; I63-A72 PolarHBondContact O-N 2.88Å; I63-P138 HydrophobicContact CD1-CB 4.26Å; I63-P138 WeakPolarHBondContact CD1-O 2.93Å; I63-P138 HydrophobicContact CG2-CB 4.13Å; I63-I139 HydrophobicContact CG2-CG1 4.22Å; I63-L142 HydrophobicContact CB-CD2 4.45Å; I63-L142 HydrophobicContact CD1-CB 3.77Å; I63-L142 HydrophobicContact CD1-CD2 3.7Å; I63-L142 HydrophobicContact CD1-CG 4.25Å; I63-L142 HydrophobicContact CG1-CD2 3.87Å
64	F	92.8	Very high	89.4	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	104	167	-64.4	-107.1	0	0	0	106.8	T48 A49 V51 T62 Y66 I71 M86 L97 L171 W174 I176	T48-F64 CarbonylContact C-O 3.59Å; T48-F64 WeakPolarHBondContact CA-O 3.29Å; A49-F64 HydrophobicContact CB-CB 4.15Å; A49-F64 HydrophobicContact CB-CD2 4.4Å; A49-F64 PolarHBondContact N-O 3.02Å; A49-F64 PolarHBondContact O-N 3.3Å; V51-F64 HydrophobicContact CG2-CE2 4.44Å; T62-F64 HydrophobicContact CG2-CD2 4.17Å; T62-F64 HydrophobicContact CG2-CE2 3.55Å; T62-F64 HydrophobicContact CG2-CZ 4.11Å; F64-Y66 HydrophobicContact CB-CD2 4.27Å; F64-Y66 HydrophobicContact CB-CE2 3.72Å; F64-I71 HydrophobicContact CD1-CD1 3.69Å; F64-I71 HydrophobicContact CD1-CG1 3.63Å; F64-I71 HydrophobicContact CD1-CG2 4.32Å; F64-I71 HydrophobicContact CE1-CD1 3.59Å; F64-I71 HydrophobicContact CE1-CG1 3.96Å; F64-I71 HydrophobicContact CE1-CG2 4.19Å; F64-I71 HydrophobicContact CE2-CG2 4.48Å; F64-I71 HydrophobicContact CG-CG1 4.25Å; F64-I71 HydrophobicContact CZ-CG2 4.26Å; F64-M86 HydrophobicContact CB-CE 3.71Å; F64-M86 HydrophobicContact CD1-CE 4.07Å; F64-M86 HydrophobicContact CG-CE 4.36Å; F64-L97 HydrophobicContact CD1-CD1 4.2Å; F64-L97 HydrophobicContact CG-CD1 4.2Å; F64-L171 HydrophobicContact CE2-CD2 3.85Å; F64-L171 HydrophobicContact CZ-CD2 3.94Å; F64-W174 AromaticContact CD2-CZ3 3.9Å; F64-W174 HydrophobicContact CD2-CZ3 3.9Å; F64-W174 HydrophobicContact CE1-CE3 4.37Å; F64-W174 AromaticContact CE2-CE3 3.72Å; F64-W174 HydrophobicContact CE2-CE3 3.72Å; F64-W174 AromaticContact CE2-CZ3 3.42Å; F64-W174 HydrophobicContact CE2-CZ3 3.42Å; F64-W174 VanDerWaalsContact CE2-CZ3 3.42Å; F64-W174 AromaticContact CZ-CE3 3.62Å; F64-W174 HydrophobicContact CZ-CE3 3.62Å; F64-W174 AromaticContact CZ-CZ3 3.82Å; F64-W174 HydrophobicContact CZ-CZ3 3.82Å; F64-I176 HydrophobicContact CE1-CD1 3.35Å; F64-I176 HydrophobicContact CZ-CD1 3.48Å; F64-I176 VanDerWaalsContact CZ-CD1 3.48Å
65	D	94.6	Very high	89.4	Confident	2 Å²	2	37 Å²	37	1%	0.011	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	91.9	175.5	-169.3	-32.5	0	0	0	109.2	T48 I63 K67 H68 G69 Y70 I139	T48-D65 HydrophobicContact CG2-CB 4.46Å; I63-D65 HydrophobicContact CG2-CB 4.37Å; D65-K67 PolarHBondContact O-N 3.14Å; D65-K67 WeakPolarHBondContact OD1-CB 3.37Å; D65-K67 PolarHBondContact OD1-N 3.23Å; D65-K67 VanDerWaalsContact OD1-N 3.14Å; D65-H68 PolarHBondContact O-N 2.78Å; D65-H68 IonicContact OD1-CE1 3.98Å; D65-H68 IonicContact OD1-CG 3.71Å; D65-H68 PolarHBondContact OD1-N 2.86Å; D65-H68 IonicContact OD1-ND1 2.94Å; D65-H68 PolarHBondContact OD1-ND1 2.78Å; D65-H68 IonicContact OD2-CE1 3.63Å; D65-H68 IonicContact OD2-CG 3.84Å; D65-H68 IonicContact OD2-ND1 2.83Å; D65-H68 PolarHBondContact OD2-ND1 3.44Å; D65-G69 WeakPolarHBondContact O-CA 3.05Å; D65-G69 PolarHBondContact O-N 3.48Å; D65-Y70 PolarHBondContact N-O 3.27Å; D65-Y70 PolarHBondContact O-N 2.91Å; D65-Y70 VanDerWaalsContact O-N 3.09Å; D65-I139 HydrophobicContact CB-CD1 4.05Å; D65-I139 HydrophobicContact CB-CG1 4.37Å
66	Y	92.3	Very high	89.5	Confident	43 Å²	43	40.2 Å²	40.2	17%	0.169	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-21.6	-178.7	-68.9	-89.2	0	0	0	112.6	N47 F64 M86 T91 P92 L94 L97	N47-Y66 VanDerWaalsContact ND2-CB 3.26Å; N47-Y66 WeakPolarHBondContact ND2-CB 3.04Å; N47-Y66 WeakPolarHBondContact O-CB 3.39Å; N47-Y66 PolarHBondContact O-N 2.96Å; N47-Y66 VanDerWaalsContact O-N 3.15Å; F64-Y66 HydrophobicContact CB-CD2 4.27Å; F64-Y66 HydrophobicContact CB-CE2 3.72Å; Y66-M86 HydrophobicContact CD1-CE 4.05Å; Y66-M86 HydrophobicContact CD1-SD 3.74Å; Y66-M86 HydrophobicContact CD2-CE 4.26Å; Y66-M86 HydrophobicContact CE1-CE 4.13Å; Y66-M86 HydrophobicContact CE1-SD 4.06Å; Y66-M86 HydrophobicContact CE2-CE 4.31Å; Y66-M86 HydrophobicContact CG-CE 4.12Å; Y66-M86 HydrophobicContact CG-SD 4.2Å; Y66-T91 HydrophobicContact CE1-CG2 4.29Å; Y66-P92 VanDerWaalsContact CE1-O 3.29Å; Y66-P92 WeakPolarHBondContact CE1-O 3.43Å; Y66-P92 PolarHBondContact OH-O 3.31Å; Y66-L94 HydrophobicContact CD2-CB 4.02Å; Y66-L94 HydrophobicContact CD2-CD1 4.07Å; Y66-L94 HydrophobicContact CD2-CG 4.47Å; Y66-L94 HydrophobicContact CE2-CB 3.78Å; Y66-L94 HydrophobicContact CE2-CD1 3.64Å; Y66-L94 HydrophobicContact CE2-CG 4.28Å; Y66-L97 HydrophobicContact CE2-CD1 4.05Å; Y66-L97 WeakPolarHBondContact OH-CD1 3.27Å; Y66-L97 WeakPolarHBondContact OH-CG 3.42Å
67	K	93.4	Very high	89.5	Confident	157 Å²	157	40.7 Å²	40.7	68%	0.683	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-40.4	176.2	179.5	178.7	177	178.5	0	110.8	D65	D65-K67 PolarHBondContact O-N 3.14Å; D65-K67 WeakPolarHBondContact OD1-CB 3.37Å; D65-K67 PolarHBondContact OD1-N 3.23Å; D65-K67 VanDerWaalsContact OD1-N 3.14Å
68	H	94.9	Very high	89.7	Confident	64 Å²	64	41.9 Å²	41.9	30%	0.296	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-14.2	178.7	-58.4	93.7	0	0	0	113	D65 Y70 L134	D65-H68 PolarHBondContact O-N 2.78Å; D65-H68 IonicContact OD1-CE1 3.98Å; D65-H68 IonicContact OD1-CG 3.71Å; D65-H68 PolarHBondContact OD1-N 2.86Å; D65-H68 IonicContact OD1-ND1 2.94Å; D65-H68 PolarHBondContact OD1-ND1 2.78Å; D65-H68 IonicContact OD2-CE1 3.63Å; D65-H68 IonicContact OD2-CG 3.84Å; D65-H68 IonicContact OD2-ND1 2.83Å; D65-H68 PolarHBondContact OD2-ND1 3.44Å; H68-Y70 HydrophobicContact CB-CD2 4.23Å; H68-Y70 WeakPolarHBondContact O-CD2 3.28Å; H68-Y70 WeakPolarHBondContact O-CE2 3.31Å; H68-L134 WeakPolarHBondContact CB-O 2.93Å
69	G	93.1	Very high	90.2	Very high	22 Å²	22	41.4 Å²	41.4	23%	0.227	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	33	177.5	0	0	0	0	0	113.4	D65 M86	D65-G69 WeakPolarHBondContact O-CA 3.05Å; D65-G69 PolarHBondContact O-N 3.48Å; G69-M86 WeakPolarHBondContact O-CB 3.5Å; G69-M86 PolarHBondContact O-N 3.06Å
70	Y	93.2	Very high	90.4	Very high	50 Å²	50	40.5 Å²	40.5	20%	0.196	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	145.7	-177.6	-71.5	-84.9	0	0	0	112.4	D65 H68 I83 L84 K85 M86 L135	D65-Y70 PolarHBondContact N-O 3.27Å; D65-Y70 PolarHBondContact O-N 2.91Å; D65-Y70 VanDerWaalsContact O-N 3.09Å; H68-Y70 HydrophobicContact CB-CD2 4.23Å; H68-Y70 WeakPolarHBondContact O-CD2 3.28Å; H68-Y70 WeakPolarHBondContact O-CE2 3.31Å; Y70-I83 HydrophobicContact CD1-CG2 4.05Å; Y70-L84 CarbonylContact C-O 3.59Å; Y70-L84 WeakPolarHBondContact CA-O 3.38Å; Y70-K85 HydrophobicContact CD1-CB 4.2Å; Y70-K85 HydrophobicContact CE1-CB 3.92Å; Y70-K85 HydrophobicContact CE1-CG 4.06Å; Y70-M86 WeakPolarHBondContact O-CE 3.26Å; Y70-L135 HydrophobicContact CD1-CD2 3.66Å; Y70-L135 HydrophobicContact CD2-CD2 3.87Å; Y70-L135 HydrophobicContact CE1-CD2 3.89Å; Y70-L135 HydrophobicContact CE2-CD2 4.11Å; Y70-L135 HydrophobicContact CG-CD2 3.65Å
71	I	91.6	Very high	90.6	Very high	8 Å²	8	39.9 Å²	39.9	4%	0.041	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	132.5	168.7	-57.5	165	0	0	0	107.4	T62 I63 F64 L84 M86 T91 I176	T62-I71 HydrophobicContact CG2-CG2 3.69Å; I63-I71 CarbonylContact O-C 3.54Å; I63-I71 VanDerWaalsContact O-CA 3.25Å; I63-I71 WeakPolarHBondContact O-CA 3.42Å; F64-I71 HydrophobicContact CD1-CD1 3.69Å; F64-I71 HydrophobicContact CD1-CG1 3.63Å; F64-I71 HydrophobicContact CD1-CG2 4.32Å; F64-I71 HydrophobicContact CE1-CD1 3.59Å; F64-I71 HydrophobicContact CE1-CG1 3.96Å; F64-I71 HydrophobicContact CE1-CG2 4.19Å; F64-I71 HydrophobicContact CE2-CG2 4.48Å; F64-I71 HydrophobicContact CG-CG1 4.25Å; F64-I71 HydrophobicContact CZ-CG2 4.26Å; I71-L84 HydrophobicContact CB-CB 4.28Å; I71-L84 HydrophobicContact CD1-CD2 4.19Å; I71-L84 PolarHBondContact N-O 2.82Å; I71-L84 PolarHBondContact O-N 3.02Å; I71-M86 HydrophobicContact CD1-CE 4.22Å; I71-M86 HydrophobicContact CD1-CG 3.97Å; I71-M86 HydrophobicContact CG1-CE 3.43Å; I71-M86 VanDerWaalsContact CG1-CE 3.43Å; I71-M86 HydrophobicContact CG1-CG 3.71Å; I71-M86 HydrophobicContact CG1-SD 4.42Å; I71-T91 HydrophobicContact CD1-CG2 3.99Å; I71-I176 HydrophobicContact CD1-CD1 4.25Å
72	A	92.9	Very high	90.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	129.5	173.8	0	0	0	0	0	110.3	T62 I63 F82 I83 I139 L142	T62-A72 CarbonylContact C-O 3.56Å; T62-A72 VanDerWaalsContact CA-O 3.24Å; T62-A72 WeakPolarHBondContact CA-O 3.35Å; I63-A72 PolarHBondContact N-O 3.22Å; I63-A72 PolarHBondContact O-N 2.88Å; A72-F82 CarbonylContact C-O 3.52Å; A72-F82 VanDerWaalsContact CA-O 3.28Å; A72-F82 WeakPolarHBondContact CA-O 3.25Å; A72-I83 HydrophobicContact CB-CD1 3.71Å; A72-I139 HydrophobicContact CB-CB 4.14Å; A72-I139 HydrophobicContact CB-CD1 3.87Å; A72-I139 HydrophobicContact CB-CG1 3.72Å; A72-I139 HydrophobicContact CB-CG2 3.53Å; A72-L142 HydrophobicContact CB-CD2 4.38Å
73	S	91	Very high	90.4	Very high	4 Å²	4	38.7 Å²	38.7	3%	0.028	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	115.3	177	-167.5	0	0	0	0	111.2	T61 T62 C81 F82 I178	T61-S73 CarbonylContact O-C 3.31Å; T61-S73 WeakPolarHBondContact O-CA 3.42Å; T62-S73 WeakPolarHBondContact OG1-CB 3.11Å; T62-S73 PolarHBondContact OG1-OG 3.39Å; S73-C81 CarbonylContact O-C 3.57Å; S73-C81 WeakPolarHBondContact O-CA 3.47Å; S73-F82 PolarHBondContact N-O 3.45Å; S73-F82 WeakPolarHBondContact O-CD2 3.07Å; S73-F82 PolarHBondContact O-N 3.03Å; S73-I178 VanDerWaalsContact OG-CD1 3.25Å; S73-I178 WeakPolarHBondContact OG-CD1 3.45Å
74	R	91.4	Very high	90.1	Very high	101 Å²	101	38.9 Å²	38.9	38%	0.381	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	121.3	171	-179.5	-178	175.4	170.2	2	108.9	S60 T61 A80 L142 I146	S60-R74 CarbonylContact C-O 3.57Å; S60-R74 WeakPolarHBondContact CA-O 3.29Å; S60-R74 WeakPolarHBondContact CB-O 3.33Å; T61-R74 PolarHBondContact N-O 2.91Å; T61-R74 PolarHBondContact O-N 3.49Å; R74-A80 WeakPolarHBondContact CA-O 3.42Å; R74-L142 HydrophobicContact CB-CD1 3.91Å; R74-L142 HydrophobicContact CB-CD2 4.25Å; R74-L142 HydrophobicContact CB-CG 3.99Å; R74-I146 HydrophobicContact CG-CD1 4.13Å
75	V	85.8	Confident	89.9	Confident	11 Å²	11	45.8 Å²	45.8	7%	0.067	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	117.4	-179.9	-176.8	0	0	0	0	109.2	S77 R78 G79 A80 F82 I178	V75-S77 PolarHBondContact O-N 2.78Å; V75-R78 HydrophobicContact CB-CB 4.38Å; V75-R78 HydrophobicContact CB-CG 4.39Å; V75-R78 HydrophobicContact CG1-CB 4.42Å; V75-R78 HydrophobicContact CG1-CG 4.02Å; V75-R78 PolarHBondContact O-N 3.31Å; V75-G79 PolarHBondContact O-N 3.41Å; V75-G79 VanDerWaalsContact O-N 3.15Å; V75-A80 PolarHBondContact N-O 3.29Å; V75-F82 HydrophobicContact CB-CE2 4.06Å; V75-F82 HydrophobicContact CG2-CD2 3.96Å; V75-F82 HydrophobicContact CG2-CE2 3.79Å; V75-I178 HydrophobicContact CG2-CD1 4.42Å
76	L	86.1	Confident	89.5	Confident	91 Å²	91	47.1 Å²	47.1	48%	0.476	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-64	-43.9	-173	-66.9	-171.4	0	0	0	112.7	S59 R78 G79	S59-L76 WeakPolarHBondContact O-CB 3.33Å; S59-L76 WeakPolarHBondContact O-CG 3.31Å; S59-L76 PolarHBondContact O-N 3.47Å; L76-R78 PolarHBondContact O-N 3.03Å; L76-R78 VanDerWaalsContact O-N 3.12Å; L76-G79 PolarHBondContact O-N 3.28Å
77	S	80.5	Confident	89.1	Confident	66 Å²	66	48.1 Å²	48.1	46%	0.462	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-62.6	-19.4	-179.9	58.8	0	0	0	0	114.1	S57 V75	S57-S77 WeakPolarHBondContact O-CA 3.26Å; S57-S77 WeakPolarHBondContact O-CB 3.15Å; S57-S77 PolarHBondContact O-N 2.81Å; S57-S77 VanDerWaalsContact O-N 3.08Å; V75-S77 PolarHBondContact O-N 2.78Å
78	R	81.5	Confident	88	Confident	119 Å²	119	48.7 Å²	48.7	45%	0.449	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-101.4	-10.9	177	-57.6	-58.1	-171.6	175.7	4.3	112.8	V75 L76 A80 F82 D164	V75-R78 HydrophobicContact CB-CB 4.38Å; V75-R78 HydrophobicContact CB-CG 4.39Å; V75-R78 HydrophobicContact CG1-CB 4.42Å; V75-R78 HydrophobicContact CG1-CG 4.02Å; V75-R78 PolarHBondContact O-N 3.31Å; L76-R78 PolarHBondContact O-N 3.03Å; L76-R78 VanDerWaalsContact O-N 3.12Å; R78-A80 HydrophobicContact CB-CB 4.21Å; R78-A80 PolarHBondContact O-N 2.88Å; R78-F82 HydrophobicContact CB-CE2 4.43Å; R78-F82 HydrophobicContact CB-CZ 4.25Å; R78-F82 HydrophobicContact CG-CZ 4.44Å; R78-D164 IonicContact NH2-OD1 2.91Å
79	G	87.1	Confident	86.9	Confident	47 Å²	47	53 Å²	53	49%	0.485	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	29.3	-176	0	0	0	0	0	113.3	V75 L76 I146 P147	V75-G79 PolarHBondContact O-N 3.41Å; V75-G79 VanDerWaalsContact O-N 3.15Å; L76-G79 PolarHBondContact O-N 3.28Å; G79-I146 WeakPolarHBondContact O-CG2 3.45Å; G79-P147 WeakPolarHBondContact O-CD 3.47Å
80	A	89.1	Confident	85.9	Confident	3 Å²	3	53.6 Å²	53.6	3%	0.025	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	158.9	-167.2	0	0	0	0	0	111.8	R74 V75 R78 F82 Y149	R74-A80 WeakPolarHBondContact CA-O 3.42Å; V75-A80 PolarHBondContact N-O 3.29Å; R78-A80 HydrophobicContact CB-CB 4.21Å; R78-A80 PolarHBondContact O-N 2.88Å; A80-F82 HydrophobicContact CB-CE1 4.47Å; A80-F82 HydrophobicContact CB-CE2 4.32Å; A80-F82 HydrophobicContact CB-CZ 3.95Å; A80-Y149 HydrophobicContact CB-CD2 3.83Å; A80-Y149 HydrophobicContact CB-CE2 3.79Å
81	C	91.5	Very high	85.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	130	168.4	173.7	0	0	0	0	111	S73 I83 C143 I146 P147 L148 Y149	S73-C81 CarbonylContact O-C 3.57Å; S73-C81 WeakPolarHBondContact O-CA 3.47Å; C81-I83 VanDerWaalsContact SG-CD1 3.58Å; C81-C143 HydrophobicContact CB-CB 3.52Å; C81-C143 WeakPolarHBondContact CB-SG 3.38Å; C81-C143 WeakPolarHBondContact SG-CB 3.34Å; C81-C143 CovalentContact SG-SG 2.03Å; C81-C143 PolarHBondContact SG-SG 3.02Å; C81-I146 HydrophobicContact CB-CG2 4.43Å; C81-P147 PolarHBondContact N-O 3.25Å; C81-L148 HydrophobicContact CB-CD2 3.93Å; C81-L148 CarbonylContact O-C 3.48Å; C81-L148 WeakPolarHBondContact O-CA 3.16Å; C81-Y149 PolarHBondContact O-N 2.91Å
82	F	89.6	Confident	84.5	Confident	7 Å²	7	52.7 Å²	52.7	3%	0.031	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123.1	-179.3	-56.8	-75	0	0	0	109.4	A72 S73 V75 R78 A80 Y120 Y149 I178	A72-F82 CarbonylContact C-O 3.52Å; A72-F82 VanDerWaalsContact CA-O 3.28Å; A72-F82 WeakPolarHBondContact CA-O 3.25Å; S73-F82 PolarHBondContact N-O 3.45Å; S73-F82 WeakPolarHBondContact O-CD2 3.07Å; S73-F82 PolarHBondContact O-N 3.03Å; V75-F82 HydrophobicContact CB-CE2 4.06Å; V75-F82 HydrophobicContact CG2-CD2 3.96Å; V75-F82 HydrophobicContact CG2-CE2 3.79Å; R78-F82 HydrophobicContact CB-CE2 4.43Å; R78-F82 HydrophobicContact CB-CZ 4.25Å; R78-F82 HydrophobicContact CG-CZ 4.44Å; A80-F82 HydrophobicContact CB-CE1 4.47Å; A80-F82 HydrophobicContact CB-CE2 4.32Å; A80-F82 HydrophobicContact CB-CZ 3.95Å; F82-Y120 AromaticContact CD1-CD1 3.67Å; F82-Y120 HydrophobicContact CD1-CD1 3.67Å; F82-Y120 HydrophobicContact CD1-CD2 4.14Å; F82-Y120 HydrophobicContact CD1-CE1 4.06Å; F82-Y120 HydrophobicContact CD1-CE2 4.48Å; F82-Y120 AromaticContact CD1-CG 3.71Å; F82-Y120 HydrophobicContact CD1-CG 3.71Å; F82-Y120 AromaticContact CE1-CD1 3.32Å; F82-Y120 HydrophobicContact CE1-CD1 3.32Å; F82-Y120 AromaticContact CE1-CD2 3.55Å; F82-Y120 HydrophobicContact CE1-CD2 3.55Å; F82-Y120 AromaticContact CE1-CE1 3.26Å; F82-Y120 HydrophobicContact CE1-CE1 3.26Å; F82-Y120 AromaticContact CE1-CE2 3.48Å; F82-Y120 HydrophobicContact CE1-CE2 3.48Å; F82-Y120 VanDerWaalsContact CE1-CE2 3.48Å; F82-Y120 AromaticContact CE1-CG 3.47Å; F82-Y120 HydrophobicContact CE1-CG 3.47Å; F82-Y120 VanDerWaalsContact CE1-CG 3.47Å; F82-Y120 AromaticContact CE1-CZ 3.34Å; F82-Y120 HydrophobicContact CZ-CD1 4.06Å; F82-Y120 AromaticContact CZ-CE1 3.56Å; F82-Y120 HydrophobicContact CZ-CE1 3.56Å; F82-Y120 HydrophobicContact CZ-CE2 4.13Å; F82-Y120 AromaticContact CZ-CZ 3.6Å; F82-Y149 CarbonylContact C-O 3.52Å; F82-Y149 VanDerWaalsContact CA-O 3.31Å; F82-Y149 WeakPolarHBondContact CA-O 3.31Å; F82-Y149 HydrophobicContact CE1-CD2 4.09Å; F82-Y149 HydrophobicContact CE1-CG 4.26Å; F82-I178 HydrophobicContact CD2-CD1 4.29Å; F82-I178 HydrophobicContact CD2-CG2 3.97Å; F82-I178 HydrophobicContact CE2-CG2 4.24Å; F82-I178 HydrophobicContact CG-CG2 4.13Å
83	I	91.4	Very high	84.2	Confident	8 Å²	8	55.7 Å²	55.7	4%	0.041	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	122.5	-179.4	-53.4	-58.5	0	0	0	108.9	Y70 A72 C81 I127 L135 I139 L148 Y149 K150 G151	Y70-I83 HydrophobicContact CD1-CG2 4.05Å; A72-I83 HydrophobicContact CB-CD1 3.71Å; C81-I83 VanDerWaalsContact SG-CD1 3.58Å; I83-I127 HydrophobicContact CB-CD1 4.12Å; I83-I127 HydrophobicContact CG1-CD1 4.2Å; I83-L135 HydrophobicContact CD1-CD1 4.26Å; I83-L135 HydrophobicContact CG1-CD1 4.49Å; I83-L135 HydrophobicContact CG2-CD1 4.37Å; I83-L135 HydrophobicContact CG2-CD2 3.84Å; I83-I139 HydrophobicContact CD1-CG2 3.9Å; I83-L148 HydrophobicContact CD1-CD2 4.29Å; I83-L148 HydrophobicContact CG1-CD2 4.22Å; I83-Y149 PolarHBondContact N-O 2.83Å; I83-K150 WeakPolarHBondContact O-CA 3.23Å; I83-G151 PolarHBondContact O-N 3.45Å
84	L	88	Confident	84.1	Confident	13 Å²	13	56 Å²	56	7%	0.068	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	132	178.7	179.5	68.4	0	0	0	109.6	Y70 I71 V118 G151 V153	Y70-L84 CarbonylContact C-O 3.59Å; Y70-L84 WeakPolarHBondContact CA-O 3.38Å; I71-L84 HydrophobicContact CB-CB 4.28Å; I71-L84 HydrophobicContact CD1-CD2 4.19Å; I71-L84 PolarHBondContact N-O 2.82Å; I71-L84 PolarHBondContact O-N 3.02Å; L84-V118 HydrophobicContact CD1-CG1 4.25Å; L84-V118 HydrophobicContact CD2-CG1 4.21Å; L84-V118 HydrophobicContact CD2-CG2 3.62Å; L84-G151 VanDerWaalsContact CD1-O 3.31Å; L84-G151 WeakPolarHBondContact CD1-O 3.49Å; L84-V153 HydrophobicContact CD1-CG2 4.02Å; L84-V153 HydrophobicContact CD2-CG2 4.17Å
85	K	89.3	Confident	83.8	Confident	145 Å²	145	55.9 Å²	55.9	63%	0.63	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	129.6	169.6	-171.1	172.4	-177.9	174.2	0	109	Y70	Y70-K85 HydrophobicContact CD1-CB 4.2Å; Y70-K85 HydrophobicContact CE1-CB 3.92Å; Y70-K85 HydrophobicContact CE1-CG 4.06Å
86	M	86.6	Confident	83.8	Confident	30 Å²	30	57.2 Å²	57.2	15%	0.148	31%	0.305	C	S	.	.			trans	-66.8	142.2	176.7	-67	-179.4	173.5	0	0	110.6	F64 Y66 G69 Y70 I71 T91	F64-M86 HydrophobicContact CB-CE 3.71Å; F64-M86 HydrophobicContact CD1-CE 4.07Å; F64-M86 HydrophobicContact CG-CE 4.36Å; Y66-M86 HydrophobicContact CD1-CE 4.05Å; Y66-M86 HydrophobicContact CD1-SD 3.74Å; Y66-M86 HydrophobicContact CD2-CE 4.26Å; Y66-M86 HydrophobicContact CE1-CE 4.13Å; Y66-M86 HydrophobicContact CE1-SD 4.06Å; Y66-M86 HydrophobicContact CE2-CE 4.31Å; Y66-M86 HydrophobicContact CG-CE 4.12Å; Y66-M86 HydrophobicContact CG-SD 4.2Å; G69-M86 WeakPolarHBondContact O-CB 3.5Å; G69-M86 PolarHBondContact O-N 3.06Å; Y70-M86 WeakPolarHBondContact O-CE 3.26Å; I71-M86 HydrophobicContact CD1-CE 4.22Å; I71-M86 HydrophobicContact CD1-CG 3.97Å; I71-M86 HydrophobicContact CG1-CE 3.43Å; I71-M86 VanDerWaalsContact CG1-CE 3.43Å; I71-M86 HydrophobicContact CG1-CG 3.71Å; I71-M86 HydrophobicContact CG1-SD 4.42Å; M86-T91 HydrophobicContact CB-CG2 4.27Å; M86-T91 HydrophobicContact CE-CG2 4.42Å; M86-T91 HydrophobicContact CG-CG2 3.92Å; M86-T91 HydrophobicContact SD-CG2 4.09Å
87	D	82.9	Confident	83.6	Confident	65 Å²	65	52.9 Å²	52.9	35%	0.348	28%	0.282	S	S	.	.			trans	-120.9	135.4	169.3	168.6	31.1	0	0	0	109	Q89 N90 T91	D87-Q89 PolarHBondContact O-N 2.87Å; D87-Q89 PolarHBondContact OD1-N 2.93Å; D87-N90 HydrophobicContact CB-CB 4.42Å; D87-N90 PolarHBondContact O-N 3.45Å; D87-N90 PolarHBondContact OD2-ND2 2.82Å; D87-T91 PolarHBondContact N-OG1 2.86Å; D87-T91 WeakPolarHBondContact O-CA 3.05Å; D87-T91 WeakPolarHBondContact O-CB 3.28Å; D87-T91 PolarHBondContact O-N 3.1Å; D87-T91 PolarHBondContact O-OG1 3.3Å
88	L	70.1	Confident	83.9	Confident	169 Å²	169	52.1 Å²	52.1	89%	0.885	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-26.8	-176.7	-71.1	168.7	0	0	0	113
89	Q	72.8	Confident	84.1	Confident	154 Å²	154	52.1 Å²	52.1	72%	0.72	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-32	178.8	-60.8	-63.3	-7.5	0	0	112.6	D87	D87-Q89 PolarHBondContact O-N 2.87Å; D87-Q89 PolarHBondContact OD1-N 2.93Å
90	N	71.6	Confident	83.9	Confident	35 Å²	35	52.9 Å²	52.9	19%	0.187	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-20	-168.8	-71.5	-53.5	0	0	0	113.9	D87 T116 V153	D87-N90 HydrophobicContact CB-CB 4.42Å; D87-N90 PolarHBondContact O-N 3.45Å; D87-N90 PolarHBondContact OD2-ND2 2.82Å; N90-T116 HydrophobicContact CB-CG2 4.13Å; N90-T116 PolarHBondContact O-OG1 3.25Å; N90-V153 HydrophobicContact CB-CG1 4.36Å
91	T	77.3	Confident	83.7	Confident	19 Å²	19	52.7 Å²	52.7	12%	0.117	26%	0.258	C	S	.	.	S	Bend	trans	-100.5	119.2	-179.8	-48.9	0	0	0	0	109.8	Y66 I71 M86 D87	Y66-T91 HydrophobicContact CE1-CG2 4.29Å; I71-T91 HydrophobicContact CD1-CG2 3.99Å; M86-T91 HydrophobicContact CB-CG2 4.27Å; M86-T91 HydrophobicContact CE-CG2 4.42Å; M86-T91 HydrophobicContact CG-CG2 3.92Å; M86-T91 HydrophobicContact SD-CG2 4.09Å; D87-T91 PolarHBondContact N-OG1 2.86Å; D87-T91 WeakPolarHBondContact O-CA 3.05Å; D87-T91 WeakPolarHBondContact O-CB 3.28Å; D87-T91 PolarHBondContact O-N 3.1Å; D87-T91 PolarHBondContact O-OG1 3.3Å
92	P	79	Confident	83.4	Confident	20 Å²	20	59.9 Å²	59.9	13%	0.13	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-63.1	143.5	175.6	27.1	-35.1	0	0	0	110.7	Y66 N96 L97	Y66-P92 VanDerWaalsContact CE1-O 3.29Å; Y66-P92 WeakPolarHBondContact CE1-O 3.43Å; Y66-P92 PolarHBondContact OH-O 3.31Å; P92-N96 HydrophobicContact CB-CB 4.27Å; P92-L97 HydrophobicContact CB-CD2 4.05Å; P92-L97 HydrophobicContact CG-CD2 3.46Å; P92-L97 VanDerWaalsContact CG-CD2 3.46Å; P92-L97 HydrophobicContact CG-CG 4.45Å
93	P	85.5	Confident	83	Confident	63 Å²	63	62.1 Å²	62.1	41%	0.409	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-66.8	157.8	172.9	29.1	-35.7	0	0	0	111.6	N95 N96 L97	P93-N95 VanDerWaalsContact C-N 3.29Å; P93-N95 VanDerWaalsContact CB-OD1 3.3Å; P93-N95 WeakPolarHBondContact CB-OD1 3.41Å; P93-N95 VanDerWaalsContact CG-OD1 3.24Å; P93-N95 WeakPolarHBondContact CG-OD1 3.24Å; P93-N95 PolarHBondContact O-N 2.78Å; P93-N96 WeakPolarHBondContact CD-ND2 3.45Å; P93-N96 HydrophobicContact CG-CB 4.06Å; P93-N96 WeakPolarHBondContact O-CB 3.18Å; P93-N96 PolarHBondContact O-N 3.22Å; P93-L97 PolarHBondContact O-N 3.27Å
94	L	88.3	Confident	82.4	Confident	11 Å²	11	62.2 Å²	62.2	6%	0.058	30%	0.297	C	S	.	.	H	α-helix	trans	-56.7	-38.6	-174.6	-176.4	63.8	0	0	0	113.5	I42 N47 A49 Y66 N96 L97 Q98	I42-L94 HydrophobicContact CG2-CD1 4.06Å; I42-L94 HydrophobicContact CG2-CD2 4.4Å; I42-L94 HydrophobicContact CG2-CG 4.25Å; N47-L94 VanDerWaalsContact OD1-CD2 3.31Å; N47-L94 WeakPolarHBondContact OD1-CD2 3.32Å; A49-L94 HydrophobicContact CB-CD1 3.74Å; Y66-L94 HydrophobicContact CD2-CB 4.02Å; Y66-L94 HydrophobicContact CD2-CD1 4.07Å; Y66-L94 HydrophobicContact CD2-CG 4.47Å; Y66-L94 HydrophobicContact CE2-CB 3.78Å; Y66-L94 HydrophobicContact CE2-CD1 3.64Å; Y66-L94 HydrophobicContact CE2-CG 4.28Å; L94-N96 VanDerWaalsContact C-N 3.29Å; L94-N96 PolarHBondContact O-N 2.79Å; L94-L97 HydrophobicContact CD1-CD1 4.41Å; L94-L97 VanDerWaalsContact O-CB 3.3Å; L94-L97 WeakPolarHBondContact O-CB 3.38Å; L94-L97 PolarHBondContact O-N 3.2Å; L94-L97 VanDerWaalsContact O-N 3.12Å; L94-Q98 PolarHBondContact O-N 2.96Å
95	N	86.8	Confident	82	Confident	98 Å²	98	65.9 Å²	65.9	52%	0.524	31%	0.314	S	S	.	.	H	α-helix	trans	-64.3	-33.2	177.4	65.1	-25.6	0	0	0	112.9	P93 Q98 R99	P93-N95 VanDerWaalsContact C-N 3.29Å; P93-N95 VanDerWaalsContact CB-OD1 3.3Å; P93-N95 WeakPolarHBondContact CB-OD1 3.41Å; P93-N95 VanDerWaalsContact CG-OD1 3.24Å; P93-N95 WeakPolarHBondContact CG-OD1 3.24Å; P93-N95 PolarHBondContact O-N 2.78Å; N95-Q98 PolarHBondContact O-N 3Å; N95-R99 PolarHBondContact O-N 2.91Å
96	N	84.3	Confident	81.7	Confident	39 Å²	39	61.8 Å²	61.8	21%	0.209	31%	0.308	C	S	.	.	H	α-helix	trans	-68.4	-40.7	173.5	-73.8	3.4	0	0	0	110	P92 P93 L94 Q98 R99 Y100	P92-N96 HydrophobicContact CB-CB 4.27Å; P93-N96 WeakPolarHBondContact CD-ND2 3.45Å; P93-N96 HydrophobicContact CG-CB 4.06Å; P93-N96 WeakPolarHBondContact O-CB 3.18Å; P93-N96 PolarHBondContact O-N 3.22Å; L94-N96 VanDerWaalsContact C-N 3.29Å; L94-N96 PolarHBondContact O-N 2.79Å; N96-Q98 VanDerWaalsContact C-N 3.32Å; N96-Q98 PolarHBondContact O-N 2.84Å; N96-R99 PolarHBondContact O-N 2.81Å; N96-Y100 HydrophobicContact CB-CD2 4.45Å; N96-Y100 HydrophobicContact CB-CE2 3.87Å; N96-Y100 WeakPolarHBondContact O-CB 3.5Å; N96-Y100 WeakPolarHBondContact O-CD2 3.32Å; N96-Y100 PolarHBondContact O-N 3.26Å
97	L	83.1	Confident	80.9	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-56.9	-47.5	174.3	-62.7	-165.9	0	0	0	111.4	A49 F64 Y66 P92 P93 L94 R99 Y100 S101 W174	A49-L97 HydrophobicContact CB-CD1 3.78Å; F64-L97 HydrophobicContact CD1-CD1 4.2Å; F64-L97 HydrophobicContact CG-CD1 4.2Å; Y66-L97 HydrophobicContact CE2-CD1 4.05Å; Y66-L97 WeakPolarHBondContact OH-CD1 3.27Å; Y66-L97 WeakPolarHBondContact OH-CG 3.42Å; P92-L97 HydrophobicContact CB-CD2 4.05Å; P92-L97 HydrophobicContact CG-CD2 3.46Å; P92-L97 VanDerWaalsContact CG-CD2 3.46Å; P92-L97 HydrophobicContact CG-CG 4.45Å; P93-L97 PolarHBondContact O-N 3.27Å; L94-L97 HydrophobicContact CD1-CD1 4.41Å; L94-L97 VanDerWaalsContact O-CB 3.3Å; L94-L97 WeakPolarHBondContact O-CB 3.38Å; L94-L97 PolarHBondContact O-N 3.2Å; L94-L97 VanDerWaalsContact O-N 3.12Å; L97-R99 PolarHBondContact O-N 3.15Å; L97-Y100 PolarHBondContact O-N 3.4Å; L97-S101 PolarHBondContact O-N 2.03Å; L97-S101 PolarHBondContact O-OG 2.88Å; L97-S101 VanDerWaalsContact O-OG 3.06Å; L97-W174 HydrophobicContact CB-CH2 4.01Å; L97-W174 HydrophobicContact CB-CZ2 3.53Å; L97-W174 HydrophobicContact CD1-CE3 4.23Å; L97-W174 HydrophobicContact CD1-CH2 3.68Å; L97-W174 HydrophobicContact CD1-CZ2 4.01Å; L97-W174 HydrophobicContact CD1-CZ3 3.77Å; L97-W174 HydrophobicContact CD2-CB 4.33Å; L97-W174 HydrophobicContact CD2-CD2 3.5Å; L97-W174 VanDerWaalsContact CD2-CD2 3.5Å; L97-W174 HydrophobicContact CD2-CE3 3.86Å; L97-W174 HydrophobicContact CD2-CG 3.74Å; L97-W174 HydrophobicContact CD2-CH2 4.19Å; L97-W174 HydrophobicContact CD2-CZ2 3.79Å; L97-W174 HydrophobicContact CD2-CZ3 4.19Å; L97-W174 HydrophobicContact CG-CD2 4.48Å; L97-W174 HydrophobicContact CG-CH2 4.18Å; L97-W174 HydrophobicContact CG-CZ2 3.98Å; L97-W174 HydrophobicContact CG-CZ3 4.46Å
98	Q	86.8	Confident	80	Confident	49 Å²	49	67.4 Å²	67.4	23%	0.229	34%	0.338	C	S	.	.	H	α-helix	trans	-58.8	-47.8	177.5	-170.2	179.8	-14	0	0	112.4	E22 F24 I42 L94 N95 N96 Y100 S101 Y102	E22-Q98 PolarHBondContact OE1-NE2 2.76Å; E22-Q98 WeakPolarHBondContact OE2-CG 3.38Å; E22-Q98 PolarHBondContact OE2-NE2 2.82Å; F24-Q98 HydrophobicContact CZ-CG 4.23Å; I42-Q98 HydrophobicContact CD1-CB 3.48Å; I42-Q98 VanDerWaalsContact CD1-CB 3.48Å; I42-Q98 HydrophobicContact CD1-CG 3.92Å; L94-Q98 PolarHBondContact O-N 2.96Å; N95-Q98 PolarHBondContact O-N 3Å; N96-Q98 VanDerWaalsContact C-N 3.32Å; N96-Q98 PolarHBondContact O-N 2.84Å; Q98-Y100 PolarHBondContact O-N 3.39Å; Q98-S101 PolarHBondContact O-N 3.38Å; Q98-Y102 PolarHBondContact O-N 3.22Å
99	R	85.3	Confident	79.2	Confident	120 Å²	120	66 Å²	66	45%	0.453	33%	0.331	S	S	.	.	H	α-helix	trans	-59.4	-47.3	176.5	-175.6	180	65.3	-155.6	-6.4	111.2	N95 N96 L97 S101 Y102 E103	N95-R99 PolarHBondContact O-N 2.91Å; N96-R99 PolarHBondContact O-N 2.81Å; L97-R99 PolarHBondContact O-N 3.15Å; R99-S101 VanDerWaalsContact C-N 3.32Å; R99-S101 PolarHBondContact O-N 2.96Å; R99-Y102 PolarHBondContact O-N 3.47Å; R99-E103 WeakPolarHBondContact CD-OE1 3.49Å; R99-E103 HydrophobicContact CG-CG 4.28Å; R99-E103 VanDerWaalsContact CG-OE1 3.26Å; R99-E103 WeakPolarHBondContact CG-OE1 3.39Å; R99-E103 IonicContact NE-OE1 3.76Å; R99-E103 VanDerWaalsContact O-CB 3.29Å; R99-E103 WeakPolarHBondContact O-CB 3.24Å; R99-E103 WeakPolarHBondContact O-CG 3.26Å; R99-E103 PolarHBondContact O-N 3.32Å
100	Y	82.4	Confident	78.3	Confident	62 Å²	62	61 Å²	61	24%	0.243	31%	0.309	C	S	.	.	H	α-helix	trans	-63.1	-37	179.2	-60.7	-34.1	0	0	0	112.5	N96 L97 Q98 K104 W174	N96-Y100 HydrophobicContact CB-CD2 4.45Å; N96-Y100 HydrophobicContact CB-CE2 3.87Å; N96-Y100 WeakPolarHBondContact O-CB 3.5Å; N96-Y100 WeakPolarHBondContact O-CD2 3.32Å; N96-Y100 PolarHBondContact O-N 3.26Å; L97-Y100 PolarHBondContact O-N 3.4Å; Q98-Y100 PolarHBondContact O-N 3.39Å; Y100-K104 VanDerWaalsContact O-CB 3.26Å; Y100-K104 WeakPolarHBondContact O-CB 3.31Å; Y100-K104 PolarHBondContact O-N 3.49Å; Y100-W174 AromaticContact CD2-CD1 3.81Å
101	S	84.4	Confident	77.3	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-62.9	-47.4	174.7	-62.1	0	0	0	0	112	F24 V40 L97 Q98 R99 K104 Q105 F170	F24-S101 VanDerWaalsContact CD2-CB 3.44Å; F24-S101 VanDerWaalsContact CG-CB 3.49Å; V40-S101 WeakPolarHBondContact CG1-OG 3.36Å; L97-S101 PolarHBondContact O-N 2.03Å; L97-S101 PolarHBondContact O-OG 2.88Å; L97-S101 VanDerWaalsContact O-OG 3.06Å; Q98-S101 PolarHBondContact O-N 3.38Å; R99-S101 VanDerWaalsContact C-N 3.32Å; R99-S101 PolarHBondContact O-N 2.96Å; S101-K104 PolarHBondContact O-N 2.88Å; S101-Q105 WeakPolarHBondContact O-CB 3.18Å; S101-Q105 PolarHBondContact O-N 3.44Å; S101-F170 WeakPolarHBondContact OG-CZ 3.13Å
102	Y	86.2	Confident	75.8	Confident	150 Å²	150	67.6 Å²	67.6	59%	0.588	34%	0.338	S	S	*	.	H	α-helix	trans	-61.3	-49.8	176.6	174.2	-95.8	0	0	0	111.6	Q98 R99 K104 Q105 A106	Q98-Y102 PolarHBondContact O-N 3.22Å; R99-Y102 PolarHBondContact O-N 3.47Å; Y102-K104 VanDerWaalsContact C-N 3.32Å; Y102-K104 PolarHBondContact O-N 2.87Å; Y102-Q105 PolarHBondContact O-N 2.81Å; Y102-A106 VanDerWaalsContact O-CB 3.31Å; Y102-A106 WeakPolarHBondContact O-CB 3.24Å; Y102-A106 PolarHBondContact O-N 2.82Å
103	E	81.4	Confident	73.9	Confident	54 Å²	54	73.7 Å²	73.7	25%	0.252	37%	0.37	S	S	.	.	H	α-helix	trans	-57.5	-44.2	178.4	-82.6	175.6	-174.3	0	0	111.9	R99 A106 L107 I110	R99-E103 WeakPolarHBondContact CD-OE1 3.49Å; R99-E103 HydrophobicContact CG-CG 4.28Å; R99-E103 VanDerWaalsContact CG-OE1 3.26Å; R99-E103 WeakPolarHBondContact CG-OE1 3.39Å; R99-E103 IonicContact NE-OE1 3.76Å; R99-E103 VanDerWaalsContact O-CB 3.29Å; R99-E103 WeakPolarHBondContact O-CB 3.24Å; R99-E103 WeakPolarHBondContact O-CG 3.26Å; R99-E103 PolarHBondContact O-N 3.32Å; E103-A106 PolarHBondContact O-N 3.42Å; E103-L107 WeakPolarHBondContact O-CB 3.35Å; E103-L107 PolarHBondContact O-N 2.68Å; E103-I110 HydrophobicContact CB-CD1 3.65Å; E103-I110 HydrophobicContact CG-CD1 4.14Å
104	K	77.9	Confident	71.8	Confident	10 Å²	10	76.8 Å²	76.8	4%	0.043	38%	0.377	C	S	.	.	H	α-helix	trans	-65.4	-43.7	178	-177.1	55.7	171	-174.2	0	112	I26 Y100 S101 Y102 A106 D108 F170 I173	I26-K104 HydrophobicContact CD1-CB 4.26Å; I26-K104 HydrophobicContact CD1-CG 4.06Å; I26-K104 HydrophobicContact CG1-CG 4.45Å; I26-K104 HydrophobicContact CG2-CG 3.75Å; Y100-K104 VanDerWaalsContact O-CB 3.26Å; Y100-K104 WeakPolarHBondContact O-CB 3.31Å; Y100-K104 PolarHBondContact O-N 3.49Å; S101-K104 PolarHBondContact O-N 2.88Å; Y102-K104 VanDerWaalsContact C-N 3.32Å; Y102-K104 PolarHBondContact O-N 2.87Å; K104-A106 VanDerWaalsContact C-N 3.29Å; K104-A106 PolarHBondContact O-N 3.36Å; K104-D108 PolarHBondContact NZ-O 3.21Å; K104-D108 PolarHBondContact O-N 2.83Å; K104-F170 HydrophobicContact CB-CD2 4.43Å; K104-F170 HydrophobicContact CB-CE2 4Å; K104-F170 HydrophobicContact CG-CD2 4.18Å; K104-F170 HydrophobicContact CG-CE2 4.25Å; K104-I173 HydrophobicContact CB-CD1 4.25Å; K104-I173 HydrophobicContact CD-CD1 3.44Å; K104-I173 VanDerWaalsContact CD-CD1 3.44Å; K104-I173 HydrophobicContact CG-CD1 3.67Å
105	Q	81.1	Confident	69.9	Low	90 Å²	90	81 Å²	81	42%	0.421	39%	0.393	S	S	.	.	H	α-helix	trans	-65.7	-32.3	178.3	-173.1	176.6	48.2	0	0	112.5	N25 S101 Y102	N25-Q105 PolarHBondContact O-NE2 2.76Å; S101-Q105 WeakPolarHBondContact O-CB 3.18Å; S101-Q105 PolarHBondContact O-N 3.44Å; Y102-Q105 PolarHBondContact O-N 2.81Å
106	A	81.3	Confident	68.2	Low	60 Å²	60	77 Å²	77	50%	0.496	37%	0.371	S	S	.	.	H	α-helix	trans	-88.6	-31.6	-175.3	0	0	0	0	0	114.3	Y102 E103 K104	Y102-A106 VanDerWaalsContact O-CB 3.31Å; Y102-A106 WeakPolarHBondContact O-CB 3.24Å; Y102-A106 PolarHBondContact O-N 2.82Å; E103-A106 PolarHBondContact O-N 3.42Å; K104-A106 VanDerWaalsContact C-N 3.29Å; K104-A106 PolarHBondContact O-N 3.36Å
107	L	70.8	Confident	66.8	Low	105 Å²	105	77.6 Å²	77.6	55%	0.55	37%	0.371	S	S	.	.	H	α-helix	trans	-117.8	-6.7	-166.2	-63.7	171.7	0	0	0	114.9	E103 N109 I110	E103-L107 WeakPolarHBondContact O-CB 3.35Å; E103-L107 PolarHBondContact O-N 2.68Å; L107-N109 PolarHBondContact O-N 3.45Å; L107-N109 PolarHBondContact O-ND2 2.85Å; L107-I110 HydrophobicContact CB-CD1 4.23Å; L107-I110 HydrophobicContact CD1-CD1 3.72Å
108	D	63.4	Low	65.5	Low	108 Å²	108	78 Å²	78	58%	0.578	37%	0.373	S	S	*	.	S	Bend	trans	53.2	-25.4	-176.4	-80.8	-18.3	0	0	0	116.9	K104	K104-D108 PolarHBondContact NZ-O 3.21Å; K104-D108 PolarHBondContact O-N 2.83Å
109	N	54.8	Low	64.4	Low	138 Å²	138	77.9 Å²	77.9	74%	0.738	37%	0.372	S	S	*	.			trans	-109.4	12	-162.6	-72.9	-54.7	0	0	0	115.2	L107 F111	L107-N109 PolarHBondContact O-N 3.45Å; L107-N109 PolarHBondContact O-ND2 2.85Å; N109-F111 PolarHBondContact O-N 2.83Å
110	I	53.3	Low	63.2	Low	51 Å²	51	73.1 Å²	73.1	26%	0.262	35%	0.354	S	S	.	.			trans	-86.9	110.4	177.8	-66	168.4	0	0	0	109.5	E103 L107	E103-I110 HydrophobicContact CB-CD1 3.65Å; E103-I110 HydrophobicContact CG-CD1 4.14Å; L107-I110 HydrophobicContact CB-CD1 4.23Å; L107-I110 HydrophobicContact CD1-CD1 3.72Å
111	F	49.5	Very low	62.3	Low	159 Å²	159	72.2 Å²	72.2	70%	0.697	35%	0.353	S	S	*	.			trans	-104.5	117	165.3	-80.7	-89.1	0	0	0	107.9	N109	N109-F111 PolarHBondContact O-N 2.83Å
112	S	46.5	Very low	61.1	Low	32 Å²	32	74.8 Å²	74.8	22%	0.224	37%	0.37	C	S	.	.			trans	-71.8	133.3	162.5	-178.5	0	0	0	0	108.5	K114 I173	S112-K114 PolarHBondContact OG-N 2.81Å; S112-I173 WeakPolarHBondContact CB-O 3.47Å; S112-I173 PolarHBondContact OG-O 2.88Å
113	N	38.8	Very low	59.9	Low	148 Å²	148	75.1 Å²	75.1	79%	0.791	38%	0.381	S	S	*	.			trans	-90.8	-4.6	174.4	63	-8.1	0	0	0	112.7	Y115	N113-Y115 WeakPolarHBondContact O-CD2 3.44Å
114	K	42	Very low	59.4	Low	129 Å²	129	80.4 Å²	80.4	56%	0.561	41%	0.406	S	S	*	.			trans	-91.5	115.4	179.5	-167.3	177.5	-178.8	-173.8	0	108.5	S112 G175	S112-K114 PolarHBondContact OG-N 2.81Å; K114-G175 WeakPolarHBondContact O-CA 3.33Å
115	Y	48.9	Very low	59.5	Low	100 Å²	100	80.7 Å²	80.7	39%	0.392	41%	0.409	S	S	.	.			trans	-116.8	111.9	177.7	-60.3	-87.3	0	0	0	110	N113 W117	N113-Y115 WeakPolarHBondContact O-CD2 3.44Å; Y115-W117 HydrophobicContact CD1-CZ2 4.44Å; Y115-W117 HydrophobicContact CG-CZ2 4.05Å; Y115-W117 VanDerWaalsContact O-CD1 3.24Å; Y115-W117 PolarHBondContact O-NE1 3.38Å
116	T	51.2	Low	59.7	Low	12 Å²	12	80 Å²	80	7%	0.074	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	110	161	-50.9	0	0	0	0	108.3	N90 V153 G175 I176 S177	N90-T116 HydrophobicContact CB-CG2 4.13Å; N90-T116 PolarHBondContact O-OG1 3.25Å; T116-V153 HydrophobicContact CG2-CB 4.27Å; T116-V153 HydrophobicContact CG2-CG1 3.37Å; T116-V153 HydrophobicContact CG2-CG2 3.98Å; T116-G175 CarbonylContact C-O 3.58Å; T116-G175 VanDerWaalsContact C-O 3.31Å; T116-G175 WeakPolarHBondContact CA-O 3.18Å; T116-G175 WeakPolarHBondContact CB-O 3.25Å; T116-G175 PolarHBondContact N-O 2.03Å; T116-G175 PolarHBondContact OG1-O 3.05Å; T116-I176 WeakPolarHBondContact O-CA 3.46Å; T116-S177 PolarHBondContact O-N 2.82Å
117	W	53.2	Low	60	Low	53 Å²	53	79.1 Å²	79.1	20%	0.201	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	134.3	-177.7	-59	89.6	0	0	0	109.8	Y115 V153 V154 T157 C165 S177 C179	Y115-W117 HydrophobicContact CD1-CZ2 4.44Å; Y115-W117 HydrophobicContact CG-CZ2 4.05Å; Y115-W117 VanDerWaalsContact O-CD1 3.24Å; Y115-W117 PolarHBondContact O-NE1 3.38Å; W117-V153 CarbonylContact O-C 3.6Å; W117-V153 WeakPolarHBondContact O-CA 3.49Å; W117-V154 HydrophobicContact CB-CG2 3.64Å; W117-V154 PolarHBondContact N-O 3.44Å; W117-V154 PolarHBondContact O-N 2.91Å; W117-T157 HydrophobicContact CB-CG2 3.93Å; W117-T157 VanDerWaalsContact CD1-CG2 3.46Å; W117-T157 HydrophobicContact CD2-CG2 3.11Å; W117-T157 HydrophobicContact CE3-CG2 3.6Å; W117-T157 HydrophobicContact CG-CG2 3.23Å; W117-T157 HydrophobicContact CH2-CG2 4.34Å; W117-T157 HydrophobicContact CZ2-CG2 3.94Å; W117-T157 HydrophobicContact CZ3-CG2 4.19Å; W117-C165 HydrophobicContact CZ3-CB 4.47Å; W117-S177 VanDerWaalsContact CE3-CB 3.42Å; W117-S177 VanDerWaalsContact CZ3-CB 3.49Å; W117-S177 VanDerWaalsContact CZ3-OG 3.28Å; W117-S177 WeakPolarHBondContact CZ3-OG 3.43Å; W117-C179 VanDerWaalsContact CE3-SG 3.53Å
118	V	56.8	Low	60.7	Low	7 Å²	7	82.5 Å²	82.5	4%	0.042	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	108.5	177.5	-174.8	0	0	0	0	107.7	L84 E152 I176 S177 I178 C179	L84-V118 HydrophobicContact CD1-CG1 4.25Å; L84-V118 HydrophobicContact CD2-CG1 4.21Å; L84-V118 HydrophobicContact CD2-CG2 3.62Å; V118-E152 CarbonylContact C-O 3.47Å; V118-E152 WeakPolarHBondContact CA-O 3.4Å; V118-I176 HydrophobicContact CG2-CG2 4.05Å; V118-S177 PolarHBondContact N-O 3.49Å; V118-I178 HydrophobicContact CB-CG1 4.44Å; V118-I178 WeakPolarHBondContact O-CA 3.31Å; V118-C179 PolarHBondContact O-N 2.61Å
119	K	63.7	Low	61.8	Low	48 Å²	48	84.6 Å²	84.6	21%	0.209	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	140.4	178.5	-170.8	174.3	177.8	-178.2	0	109.1	G151 E152 V154 V160 C179 D181	K119-G151 CarbonylContact O-C 3.37Å; K119-G151 WeakPolarHBondContact O-CA 3.21Å; K119-E152 PolarHBondContact N-O 2.87Å; K119-E152 PolarHBondContact O-N 3.43Å; K119-V154 HydrophobicContact CB-CG1 3.93Å; K119-V154 HydrophobicContact CB-CG2 4.1Å; K119-V154 HydrophobicContact CD-CG1 4.12Å; K119-V160 HydrophobicContact CD-CG2 4.3Å; K119-C179 WeakPolarHBondContact CA-O 3.41Å; K119-D181 HydrophobicContact CD-CB 4.34Å; K119-D181 WeakPolarHBondContact CE-OD1 3Å; K119-D181 WeakPolarHBondContact CE-OD2 3.04Å; K119-D181 HydrophobicContact CG-CB 4.13Å; K119-D181 IonicContact NZ-OD1 2.75Å; K119-D181 PolarHBondContact NZ-OD1 2.89Å; K119-D181 IonicContact NZ-OD2 3.65Å; K119-D181 PolarHBondContact NZ-OD2 2.92Å
120	Y	59.1	Low	63.5	Low	20 Å²	20	80.7 Å²	80.7	8%	0.078	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	144.5	166.4	78.7	-81.5	0	0	0	110	F82 P122 Y149 I178 C179 A180 D181	F82-Y120 AromaticContact CD1-CD1 3.67Å; F82-Y120 HydrophobicContact CD1-CD1 3.67Å; F82-Y120 HydrophobicContact CD1-CD2 4.14Å; F82-Y120 HydrophobicContact CD1-CE1 4.06Å; F82-Y120 HydrophobicContact CD1-CE2 4.48Å; F82-Y120 AromaticContact CD1-CG 3.71Å; F82-Y120 HydrophobicContact CD1-CG 3.71Å; F82-Y120 AromaticContact CE1-CD1 3.32Å; F82-Y120 HydrophobicContact CE1-CD1 3.32Å; F82-Y120 AromaticContact CE1-CD2 3.55Å; F82-Y120 HydrophobicContact CE1-CD2 3.55Å; F82-Y120 AromaticContact CE1-CE1 3.26Å; F82-Y120 HydrophobicContact CE1-CE1 3.26Å; F82-Y120 AromaticContact CE1-CE2 3.48Å; F82-Y120 HydrophobicContact CE1-CE2 3.48Å; F82-Y120 VanDerWaalsContact CE1-CE2 3.48Å; F82-Y120 AromaticContact CE1-CG 3.47Å; F82-Y120 HydrophobicContact CE1-CG 3.47Å; F82-Y120 VanDerWaalsContact CE1-CG 3.47Å; F82-Y120 AromaticContact CE1-CZ 3.34Å; F82-Y120 HydrophobicContact CZ-CD1 4.06Å; F82-Y120 AromaticContact CZ-CE1 3.56Å; F82-Y120 HydrophobicContact CZ-CE1 3.56Å; F82-Y120 HydrophobicContact CZ-CE2 4.13Å; F82-Y120 AromaticContact CZ-CZ 3.6Å; Y120-P122 HydrophobicContact CD2-CG 4.25Å; Y120-P122 HydrophobicContact CE2-CB 4.13Å; Y120-P122 HydrophobicContact CE2-CG 3.67Å; Y120-Y149 HydrophobicContact CD2-CD1 4.16Å; Y120-Y149 HydrophobicContact CD2-CG 4.04Å; Y120-Y149 HydrophobicContact CE2-CG 4.38Å; Y120-I178 HydrophobicContact CD1-CG2 4.42Å; Y120-C179 WeakPolarHBondContact CD1-O 3.06Å; Y120-C179 PolarHBondContact N-O 2.83Å; Y120-A180 HydrophobicContact CE1-CB 3.79Å; Y120-D181 PolarHBondContact O-N 2.82Å
121	N	63.3	Low	65.4	Low	42 Å²	42	82.2 Å²	82.2	23%	0.225	40%	0.403	C	S	.	.			trans	-97.5	112.2	172.7	-179.7	-33.9	0	0	0	108.7	L123 E124 S125	N121-L123 PolarHBondContact O-N 3.49Å; N121-L123 WeakPolarHBondContact OD1-CB 3.08Å; N121-L123 PolarHBondContact OD1-N 3.15Å; N121-E124 HydrophobicContact CB-CB 4.23Å; N121-E124 PolarHBondContact ND2-OE2 2.98Å; N121-E124 PolarHBondContact O-N 3.23Å; N121-E124 PolarHBondContact OD1-N 3.37Å; N121-E124 VanDerWaalsContact OD1-N 3.15Å; N121-S125 PolarHBondContact N-OG 3.41Å; N121-S125 WeakPolarHBondContact O-CB 2.93Å; N121-S125 PolarHBondContact O-N 3.44Å; N121-S125 PolarHBondContact O-OG 3.04Å
122	P	60.1	Low	67.5	Low	54 Å²	54	77.4 Å²	77.4	35%	0.351	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-22.2	-177.3	-21.5	30.1	0	0	0	115.1	Y120 Y149	Y120-P122 HydrophobicContact CD2-CG 4.25Å; Y120-P122 HydrophobicContact CE2-CB 4.13Å; Y120-P122 HydrophobicContact CE2-CG 3.67Å; P122-Y149 VanDerWaalsContact O-CE1 3.29Å; P122-Y149 WeakPolarHBondContact O-CE1 3.39Å
123	L	60.5	Low	69.7	Low	158 Å²	158	84.1 Å²	84.1	83%	0.827	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-41.8	-178.8	-67.1	165.5	0	0	0	112.1	N121	N121-L123 PolarHBondContact O-N 3.49Å; N121-L123 WeakPolarHBondContact OD1-CB 3.08Å; N121-L123 PolarHBondContact OD1-N 3.15Å
124	E	70.9	Confident	72.3	Confident	165 Å²	165	81.7 Å²	81.7	77%	0.771	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-19.1	-170.5	-62.1	-175.7	164.8	0	0	113.9	N121	N121-E124 HydrophobicContact CB-CB 4.23Å; N121-E124 PolarHBondContact ND2-OE2 2.98Å; N121-E124 PolarHBondContact O-N 3.23Å; N121-E124 PolarHBondContact OD1-N 3.37Å; N121-E124 VanDerWaalsContact OD1-N 3.15Å
125	S	79.5	Confident	74.6	Confident	16 Å²	16	75.7 Å²	75.7	11%	0.112	37%	0.367	C	S	.	.			trans	-95.7	1.5	-173.6	71.7	0	0	0	0	114.7	N121 I127 Y149 K150	N121-S125 PolarHBondContact N-OG 3.41Å; N121-S125 WeakPolarHBondContact O-CB 2.93Å; N121-S125 PolarHBondContact O-N 3.44Å; N121-S125 PolarHBondContact O-OG 3.04Å; S125-I127 PolarHBondContact O-N 3.18Å; S125-Y149 CarbonylContact O-C 3.52Å; S125-Y149 WeakPolarHBondContact O-CA 3.32Å; S125-Y149 WeakPolarHBondContact OG-CD1 3.32Å; S125-K150 VanDerWaalsContact CB-O 3.23Å; S125-K150 WeakPolarHBondContact CB-O 3.41Å; S125-K150 PolarHBondContact O-N 3.45Å
126	L	85.3	Confident	76.8	Confident	76 Å²	76	71.1 Å²	71.1	40%	0.398	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-63.2	119.5	179	-176.9	72.4	0	0	0	110.5	K128 P147 L148 Y149	L126-K128 PolarHBondContact O-N 2.93Å; L126-P147 HydrophobicContact CD1-CB 4.44Å; L126-L148 WeakPolarHBondContact CA-O 3.44Å; L126-Y149 HydrophobicContact CB-CD1 4.29Å; L126-Y149 HydrophobicContact CB-CE1 3.99Å; L126-Y149 HydrophobicContact CD1-CD1 4.4Å; L126-Y149 HydrophobicContact CD1-CE1 3.86Å; L126-Y149 HydrophobicContact CD1-CE2 4.44Å
127	I	87.6	Confident	78.8	Confident	40 Å²	40	73.6 Å²	73.6	21%	0.205	37%	0.367	C	S	.	.			trans	-86.1	110.9	176.8	-54.9	173.6	0	0	0	107.9	I83 S125 D129 I130 L148 K150	I83-I127 HydrophobicContact CB-CD1 4.12Å; I83-I127 HydrophobicContact CG1-CD1 4.2Å; S125-I127 PolarHBondContact O-N 3.18Å; I127-D129 VanDerWaalsContact CG2-O 3.26Å; I127-D129 WeakPolarHBondContact CG2-O 3.25Å; I127-I130 HydrophobicContact CG2-CB 4.02Å; I127-I130 HydrophobicContact CG2-CD1 4.15Å; I127-L148 HydrophobicContact CB-CB 3.88Å; I127-L148 HydrophobicContact CD1-CB 4.24Å; I127-L148 HydrophobicContact CG1-CB 4.38Å; I127-L148 PolarHBondContact N-O 3.11Å; I127-K150 HydrophobicContact CD1-CB 4.18Å; I127-K150 HydrophobicContact CG1-CB 4.24Å
128	K	86.4	Confident	80.8	Confident	177 Å²	177	72.6 Å²	72.6	77%	0.77	37%	0.368	S	S	*	.	S	Bend	trans	-84.5	-39.8	179.5	-65.2	-179.1	-178.7	176.1	0	112.4	L126	L126-K128 PolarHBondContact O-N 2.93Å
129	D	86.4	Confident	82.7	Confident	151 Å²	151	72.2 Å²	72.2	81%	0.807	37%	0.366	S	S	*	.	S	Bend	trans	-122.5	128.2	-180	-60.4	-57.9	0	0	0	108.9	I127	I127-D129 VanDerWaalsContact CG2-O 3.26Å; I127-D129 WeakPolarHBondContact CG2-O 3.25Å
130	I	89.9	Confident	84.2	Confident	57 Å²	57	72.4 Å²	72.4	29%	0.292	37%	0.367	S	S	.	.			trans	-134	135.6	-178.4	-171.5	64.8	0	0	0	110.4	I127 W132 L135 L148	I127-I130 HydrophobicContact CG2-CB 4.02Å; I127-I130 HydrophobicContact CG2-CD1 4.15Å; I130-W132 HydrophobicContact CG2-CD2 3.91Å; I130-W132 HydrophobicContact CG2-CE3 4.42Å; I130-W132 HydrophobicContact CG2-CG 4.46Å; I130-W132 HydrophobicContact CG2-CH2 4.06Å; I130-W132 HydrophobicContact CG2-CZ2 3.46Å; I130-W132 VanDerWaalsContact CG2-CZ2 3.46Å; I130-W132 HydrophobicContact CG2-CZ3 4.49Å; I130-L135 HydrophobicContact CD1-CD1 3.61Å; I130-L135 HydrophobicContact CD1-CD2 4.39Å; I130-L135 HydrophobicContact CD1-CG 3.96Å; I130-L135 HydrophobicContact CG1-CD1 3.53Å; I130-L135 HydrophobicContact CG1-CG 4.16Å; I130-L148 HydrophobicContact CB-CD1 4.07Å; I130-L148 HydrophobicContact CG1-CD1 4.19Å; I130-L148 HydrophobicContact CG2-CD1 3.82Å
131	D	93.3	Very high	86	Confident	83 Å²	83	79.6 Å²	79.6	44%	0.444	40%	0.399	S	S	.	.			trans	-89.4	103.1	168.1	-172.7	-14.3	0	0	0	109.3	F133 L134 L135	D131-F133 PolarHBondContact O-N 3.18Å; D131-F133 VanDerWaalsContact OD1-CB 3.23Å; D131-F133 WeakPolarHBondContact OD1-CB 3.43Å; D131-F133 PolarHBondContact OD1-N 3.2Å; D131-L134 HydrophobicContact CB-CB 4.29Å; D131-L134 HydrophobicContact CB-CD1 3.9Å; D131-L134 HydrophobicContact CB-CG 3.96Å; D131-L134 PolarHBondContact O-N 2.97Å; D131-L135 PolarHBondContact O-N 3.24Å
132	W	93.4	Very high	87.5	Confident	58 Å²	58	78.6 Å²	78.6	22%	0.22	39%	0.393	C	S	.	.	H	α-helix	trans	-66.1	-24.8	179.1	-64.3	111.2	0	0	0	113.2	I130 L134 L135 G136 E140 K144 L148	I130-W132 HydrophobicContact CG2-CD2 3.91Å; I130-W132 HydrophobicContact CG2-CE3 4.42Å; I130-W132 HydrophobicContact CG2-CG 4.46Å; I130-W132 HydrophobicContact CG2-CH2 4.06Å; I130-W132 HydrophobicContact CG2-CZ2 3.46Å; I130-W132 VanDerWaalsContact CG2-CZ2 3.46Å; I130-W132 HydrophobicContact CG2-CZ3 4.49Å; W132-L134 VanDerWaalsContact C-N 3.29Å; W132-L134 PolarHBondContact O-N 3.44Å; W132-L135 HydrophobicContact CE3-CD1 4.06Å; W132-L135 HydrophobicContact CZ3-CD1 4.01Å; W132-L135 PolarHBondContact O-N 2.91Å; W132-G136 PolarHBondContact O-N 3.06Å; W132-E140 HydrophobicContact CB-CB 4.36Å; W132-E140 HydrophobicContact CB-CG 4.11Å; W132-E140 HydrophobicContact CD2-CB 4.2Å; W132-E140 HydrophobicContact CD2-CG 3.81Å; W132-E140 HydrophobicContact CE3-CB 3.71Å; W132-E140 HydrophobicContact CE3-CG 3.8Å; W132-E140 HydrophobicContact CG-CG 3.97Å; W132-E140 HydrophobicContact CZ3-CB 4.35Å; W132-E140 HydrophobicContact CZ3-CG 4.48Å; W132-K144 HydrophobicContact CH2-CB 4.31Å; W132-K144 HydrophobicContact CZ2-CB 4.27Å; W132-K144 HydrophobicContact CZ2-CG 4.28Å; W132-L148 HydrophobicContact CH2-CD1 3.71Å; W132-L148 HydrophobicContact CH2-CD2 4.3Å; W132-L148 HydrophobicContact CH2-CG 4.49Å; W132-L148 HydrophobicContact CZ2-CD1 4.16Å; W132-L148 HydrophobicContact CZ3-CD1 4.41Å
133	F	93.3	Very high	89.3	Confident	173 Å²	173	76 Å²	76	76%	0.759	38%	0.377	S	S	*	.	H	α-helix	trans	-66.3	-36.6	175.2	-177.7	-98.2	0	0	0	110.8	D131	D131-F133 PolarHBondContact O-N 3.18Å; D131-F133 VanDerWaalsContact OD1-CB 3.23Å; D131-F133 WeakPolarHBondContact OD1-CB 3.43Å; D131-F133 PolarHBondContact OD1-N 3.2Å
134	L	92.6	Very high	90.9	Very high	97 Å²	97	72.7 Å²	72.7	51%	0.508	36%	0.356	S	S	.	.	H	α-helix	trans	-68.9	-36.5	175.3	-66.8	-179.7	0	0	0	113	H68 D131 W132	H68-L134 WeakPolarHBondContact CB-O 2.93Å; D131-L134 HydrophobicContact CB-CB 4.29Å; D131-L134 HydrophobicContact CB-CD1 3.9Å; D131-L134 HydrophobicContact CB-CG 3.96Å; D131-L134 PolarHBondContact O-N 2.97Å; W132-L134 VanDerWaalsContact C-N 3.29Å; W132-L134 PolarHBondContact O-N 3.44Å
135	L	92.1	Very high	92	Very high	3 Å²	3	73.1 Å²	73.1	2%	0.016	36%	0.357	C	S	.	.	H	α-helix	trans	-79.4	-24.4	178.8	-65.1	-172.2	0	0	0	113.3	Y70 I83 I130 D131 W132 I139	Y70-L135 HydrophobicContact CD1-CD2 3.66Å; Y70-L135 HydrophobicContact CD2-CD2 3.87Å; Y70-L135 HydrophobicContact CE1-CD2 3.89Å; Y70-L135 HydrophobicContact CE2-CD2 4.11Å; Y70-L135 HydrophobicContact CG-CD2 3.65Å; I83-L135 HydrophobicContact CD1-CD1 4.26Å; I83-L135 HydrophobicContact CG1-CD1 4.49Å; I83-L135 HydrophobicContact CG2-CD1 4.37Å; I83-L135 HydrophobicContact CG2-CD2 3.84Å; I130-L135 HydrophobicContact CD1-CD1 3.61Å; I130-L135 HydrophobicContact CD1-CD2 4.39Å; I130-L135 HydrophobicContact CD1-CG 3.96Å; I130-L135 HydrophobicContact CG1-CD1 3.53Å; I130-L135 HydrophobicContact CG1-CG 4.16Å; D131-L135 PolarHBondContact O-N 3.24Å; W132-L135 HydrophobicContact CE3-CD1 4.06Å; W132-L135 HydrophobicContact CZ3-CD1 4.01Å; W132-L135 PolarHBondContact O-N 2.91Å; L135-I139 HydrophobicContact CB-CB 4.14Å; L135-I139 HydrophobicContact CB-CG2 3.95Å; L135-I139 HydrophobicContact CD1-CG2 3.86Å; L135-I139 HydrophobicContact CG-CG2 4.45Å
136	G	93.9	Very high	92.6	Very high	3 Å²	3	73.7 Å²	73.7	3%	0.031	36%	0.358	C	S	.	.			trans	84.9	156.8	-178.2	0	0	0	0	0	114	W132 I139 E140	W132-G136 PolarHBondContact O-N 3.06Å; G136-I139 PolarHBondContact O-N 3.15Å; G136-E140 PolarHBondContact O-N 3.35Å
137	S	94.5	Very high	93	Very high	64 Å²	64	73.2 Å²	73.2	45%	0.448	36%	0.36	S	S	.	.	H	α-helix	trans	-59	-33.3	-176.2	87.6	0	0	0	0	115.6	K141	S137-K141 WeakPolarHBondContact O-CB 3.49Å; S137-K141 VanDerWaalsContact O-CG 3.26Å; S137-K141 WeakPolarHBondContact O-CG 3.41Å; S137-K141 PolarHBondContact O-N 2.67Å
138	P	94.6	Very high	93.2	Very high	32 Å²	32	71.8 Å²	71.8	21%	0.208	35%	0.353	C	S	.	.	H	α-helix	trans	-62.4	-45.6	177.9	-24.2	36.8	0	0	0	112	I63 L142	I63-P138 HydrophobicContact CD1-CB 4.26Å; I63-P138 WeakPolarHBondContact CD1-O 2.93Å; I63-P138 HydrophobicContact CG2-CB 4.13Å; P138-L142 PolarHBondContact O-N 3.02Å
139	I	95.9	Very high	93.3	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-71	-41.5	179.1	-65.1	-178.3	0	0	0	110.8	I63 D65 A72 I83 L135 G136 K141 L142 C143	I63-I139 HydrophobicContact CG2-CG1 4.22Å; D65-I139 HydrophobicContact CB-CD1 4.05Å; D65-I139 HydrophobicContact CB-CG1 4.37Å; A72-I139 HydrophobicContact CB-CB 4.14Å; A72-I139 HydrophobicContact CB-CD1 3.87Å; A72-I139 HydrophobicContact CB-CG1 3.72Å; A72-I139 HydrophobicContact CB-CG2 3.53Å; I83-I139 HydrophobicContact CD1-CG2 3.9Å; L135-I139 HydrophobicContact CB-CB 4.14Å; L135-I139 HydrophobicContact CB-CG2 3.95Å; L135-I139 HydrophobicContact CD1-CG2 3.86Å; L135-I139 HydrophobicContact CG-CG2 4.45Å; G136-I139 PolarHBondContact O-N 3.15Å; I139-K141 VanDerWaalsContact C-N 3.33Å; I139-K141 PolarHBondContact O-N 2.89Å; I139-L142 PolarHBondContact O-N 3.48Å; I139-L142 VanDerWaalsContact O-N 3.14Å; I139-C143 PolarHBondContact O-N 3.08Å
140	E	96.3	Very high	93.4	Very high	52 Å²	52	63.4 Å²	63.4	24%	0.243	31%	0.308	C	S	.	.	H	α-helix	trans	-54.5	-51	174.2	-176.7	-174.5	175.2	0	0	110.7	W132 G136 L142 C143 K144	W132-E140 HydrophobicContact CB-CB 4.36Å; W132-E140 HydrophobicContact CB-CG 4.11Å; W132-E140 HydrophobicContact CD2-CB 4.2Å; W132-E140 HydrophobicContact CD2-CG 3.81Å; W132-E140 HydrophobicContact CE3-CB 3.71Å; W132-E140 HydrophobicContact CE3-CG 3.8Å; W132-E140 HydrophobicContact CG-CG 3.97Å; W132-E140 HydrophobicContact CZ3-CB 4.35Å; W132-E140 HydrophobicContact CZ3-CG 4.48Å; G136-E140 PolarHBondContact O-N 3.35Å; E140-L142 PolarHBondContact O-N 3.12Å; E140-C143 PolarHBondContact O-N 3.03Å; E140-K144 HydrophobicContact CG-CB 4.25Å; E140-K144 HydrophobicContact CG-CD 4Å; E140-K144 WeakPolarHBondContact O-CB 3.49Å; E140-K144 PolarHBondContact O-N 3.26Å; E140-K144 IonicContact OE1-NZ 2.74Å; E140-K144 PolarHBondContact OE1-NZ 3.08Å
141	K	96.2	Very high	93	Very high	170 Å²	170	60.9 Å²	60.9	74%	0.739	30%	0.296	S	S	*	.	H	α-helix	trans	-59.6	-35	179.6	-73.9	170.1	-177.1	173.1	0	113	S137 I139	S137-K141 WeakPolarHBondContact O-CB 3.49Å; S137-K141 VanDerWaalsContact O-CG 3.26Å; S137-K141 WeakPolarHBondContact O-CG 3.41Å; S137-K141 PolarHBondContact O-N 2.67Å; I139-K141 VanDerWaalsContact C-N 3.33Å; I139-K141 PolarHBondContact O-N 2.89Å
142	L	95.8	Very high	92.1	Very high	21 Å²	21	62.1 Å²	62.1	11%	0.11	30%	0.299	C	S	.	.	H	α-helix	trans	-73.9	-41.6	-179.4	-179.9	63.8	0	0	0	112.6	T61 I63 A72 R74 P138 I139 E140	T61-L142 HydrophobicContact CG2-CD1 3.74Å; T61-L142 HydrophobicContact CG2-CD2 4.24Å; I63-L142 HydrophobicContact CB-CD2 4.45Å; I63-L142 HydrophobicContact CD1-CB 3.77Å; I63-L142 HydrophobicContact CD1-CD2 3.7Å; I63-L142 HydrophobicContact CD1-CG 4.25Å; I63-L142 HydrophobicContact CG1-CD2 3.87Å; A72-L142 HydrophobicContact CB-CD2 4.38Å; R74-L142 HydrophobicContact CB-CD1 3.91Å; R74-L142 HydrophobicContact CB-CD2 4.25Å; R74-L142 HydrophobicContact CB-CG 3.99Å; P138-L142 PolarHBondContact O-N 3.02Å; I139-L142 PolarHBondContact O-N 3.48Å; I139-L142 VanDerWaalsContact O-N 3.14Å; E140-L142 PolarHBondContact O-N 3.12Å
143	C	96.1	Very high	91.1	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-116.9	-7.9	-161.8	-60.8	0	0	0	0	114.9	C81 I139 E140 H145 I146 L148	C81-C143 HydrophobicContact CB-CB 3.52Å; C81-C143 WeakPolarHBondContact CB-SG 3.38Å; C81-C143 WeakPolarHBondContact SG-CB 3.34Å; C81-C143 CovalentContact SG-SG 2.03Å; C81-C143 PolarHBondContact SG-SG 3.02Å; I139-C143 PolarHBondContact O-N 3.08Å; E140-C143 PolarHBondContact O-N 3.03Å; C143-H145 PolarHBondContact O-N 2.66Å; C143-I146 PolarHBondContact O-N 3.13Å; C143-I146 VanDerWaalsContact O-N 3.15Å; C143-L148 HydrophobicContact CB-CD2 3.68Å
144	K	94.4	Very high	89.9	Confident	89 Å²	89	55 Å²	55	39%	0.387	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	134.1	176.4	-168.1	-179.5	-168.9	158.5	0	110.4	W132 E140 I146	W132-K144 HydrophobicContact CH2-CB 4.31Å; W132-K144 HydrophobicContact CZ2-CB 4.27Å; W132-K144 HydrophobicContact CZ2-CG 4.28Å; E140-K144 HydrophobicContact CG-CB 4.25Å; E140-K144 HydrophobicContact CG-CD 4Å; E140-K144 WeakPolarHBondContact O-CB 3.49Å; E140-K144 PolarHBondContact O-N 3.26Å; E140-K144 IonicContact OE1-NZ 2.74Å; E140-K144 PolarHBondContact OE1-NZ 3.08Å; K144-I146 VanDerWaalsContact C-N 3.33Å
145	H	93.6	Very high	88.2	Confident	173 Å²	173	58.1 Å²	58.1	80%	0.801	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	16.4	-175.7	-39.2	106.9	0	0	0	115.9	C143	C143-H145 PolarHBondContact O-N 2.66Å
146	I	92.6	Very high	86.4	Confident	28 Å²	28	63 Å²	63	14%	0.144	31%	0.314	C	S	.	.	S	Bend	trans	-119.8	143.7	175.5	-55.2	175.7	0	0	0	108	R74 G79 C81 C143 K144 L148	R74-I146 HydrophobicContact CG-CD1 4.13Å; G79-I146 WeakPolarHBondContact O-CG2 3.45Å; C81-I146 HydrophobicContact CB-CG2 4.43Å; C143-I146 PolarHBondContact O-N 3.13Å; C143-I146 VanDerWaalsContact O-N 3.15Å; K144-I146 VanDerWaalsContact C-N 3.33Å; I146-L148 PolarHBondContact O-N 3.32Å
147	P	93.3	Very high	84.3	Confident	66 Å²	66	64.9 Å²	64.9	43%	0.429	33%	0.325	S	S	.	.			trans	-50.6	127.3	171.4	-28.3	35.5	0	0	0	111.9	G79 C81 L126 Y149	G79-P147 WeakPolarHBondContact O-CD 3.47Å; C81-P147 PolarHBondContact N-O 3.25Å; L126-P147 HydrophobicContact CD1-CB 4.44Å; P147-Y149 HydrophobicContact CB-CE2 3.84Å
148	L	92.9	Very high	82.1	Confident	10 Å²	10	69.8 Å²	69.8	5%	0.052	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	129.2	-178.1	-62.9	-178.8	0	0	0	110.1	C81 I83 L126 I127 I130 W132 C143 I146	C81-L148 HydrophobicContact CB-CD2 3.93Å; C81-L148 CarbonylContact O-C 3.48Å; C81-L148 WeakPolarHBondContact O-CA 3.16Å; I83-L148 HydrophobicContact CD1-CD2 4.29Å; I83-L148 HydrophobicContact CG1-CD2 4.22Å; L126-L148 WeakPolarHBondContact CA-O 3.44Å; I127-L148 HydrophobicContact CB-CB 3.88Å; I127-L148 HydrophobicContact CD1-CB 4.24Å; I127-L148 HydrophobicContact CG1-CB 4.38Å; I127-L148 PolarHBondContact N-O 3.11Å; I130-L148 HydrophobicContact CB-CD1 4.07Å; I130-L148 HydrophobicContact CG1-CD1 4.19Å; I130-L148 HydrophobicContact CG2-CD1 3.82Å; W132-L148 HydrophobicContact CH2-CD1 3.71Å; W132-L148 HydrophobicContact CH2-CD2 4.3Å; W132-L148 HydrophobicContact CH2-CG 4.49Å; W132-L148 HydrophobicContact CZ2-CD1 4.16Å; W132-L148 HydrophobicContact CZ3-CD1 4.41Å; C143-L148 HydrophobicContact CB-CD2 3.68Å; I146-L148 PolarHBondContact O-N 3.32Å
149	Y	89.3	Confident	79.7	Confident	44 Å²	44	73.8 Å²	73.8	17%	0.173	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	131.3	175.5	-66.1	-83.5	0	0	0	110.4	A80 C81 F82 I83 Y120 P122 S125 L126 P147 G151	A80-Y149 HydrophobicContact CB-CD2 3.83Å; A80-Y149 HydrophobicContact CB-CE2 3.79Å; C81-Y149 PolarHBondContact O-N 2.91Å; F82-Y149 CarbonylContact C-O 3.52Å; F82-Y149 VanDerWaalsContact CA-O 3.31Å; F82-Y149 WeakPolarHBondContact CA-O 3.31Å; F82-Y149 HydrophobicContact CE1-CD2 4.09Å; F82-Y149 HydrophobicContact CE1-CG 4.26Å; I83-Y149 PolarHBondContact N-O 2.83Å; Y120-Y149 HydrophobicContact CD2-CD1 4.16Å; Y120-Y149 HydrophobicContact CD2-CG 4.04Å; Y120-Y149 HydrophobicContact CE2-CG 4.38Å; P122-Y149 VanDerWaalsContact O-CE1 3.29Å; P122-Y149 WeakPolarHBondContact O-CE1 3.39Å; S125-Y149 CarbonylContact O-C 3.52Å; S125-Y149 WeakPolarHBondContact O-CA 3.32Å; S125-Y149 WeakPolarHBondContact OG-CD1 3.32Å; L126-Y149 HydrophobicContact CB-CD1 4.29Å; L126-Y149 HydrophobicContact CB-CE1 3.99Å; L126-Y149 HydrophobicContact CD1-CD1 4.4Å; L126-Y149 HydrophobicContact CD1-CE1 3.86Å; L126-Y149 HydrophobicContact CD1-CE2 4.44Å; P147-Y149 HydrophobicContact CB-CE2 3.84Å; Y149-G151 PolarHBondContact O-N 3.49Å
150	K	88.4	Confident	77.6	Confident	109 Å²	109	74.4 Å²	74.4	47%	0.474	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	121.6	172.7	-174.6	-170.9	169.8	-135.5	0	109.3	I83 S125 I127 E152	I83-K150 WeakPolarHBondContact O-CA 3.23Å; S125-K150 VanDerWaalsContact CB-O 3.23Å; S125-K150 WeakPolarHBondContact CB-O 3.41Å; S125-K150 PolarHBondContact O-N 3.45Å; I127-K150 HydrophobicContact CD1-CB 4.18Å; I127-K150 HydrophobicContact CG1-CB 4.24Å; K150-E152 IonicContact NZ-OE1 2.82Å; K150-E152 PolarHBondContact NZ-OE1 2.83Å
151	G	80.8	Confident	75.1	Confident	4 Å²	4	73.8 Å²	73.8	4%	0.041	37%	0.372	C	S	.	.			trans	-85.8	152.4	169.2	0	0	0	0	0	111.5	I83 L84 K119 Y149	I83-G151 PolarHBondContact O-N 3.45Å; L84-G151 VanDerWaalsContact CD1-O 3.31Å; L84-G151 WeakPolarHBondContact CD1-O 3.49Å; K119-G151 CarbonylContact O-C 3.37Å; K119-G151 WeakPolarHBondContact O-CA 3.21Å; Y149-G151 PolarHBondContact O-N 3.49Å
152	E	74.9	Confident	72.7	Confident	108 Å²	108	70 Å²	70	51%	0.505	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	135.4	174.7	-58	-165.6	154.9	0	0	109.8	V118 K119 K150 V154	V118-E152 CarbonylContact C-O 3.47Å; V118-E152 WeakPolarHBondContact CA-O 3.4Å; K119-E152 PolarHBondContact N-O 2.87Å; K119-E152 PolarHBondContact O-N 3.43Å; K150-E152 IonicContact NZ-OE1 2.82Å; K150-E152 PolarHBondContact NZ-OE1 2.83Å; E152-V154 PolarHBondContact O-N 2.54Å
153	V	72.2	Confident	70.3	Confident	46 Å²	46	72.6 Å²	72.6	28%	0.279	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	127.7	174.9	174.4	0	0	0	0	108.9	L84 N90 T116 W117	L84-V153 HydrophobicContact CD1-CG2 4.02Å; L84-V153 HydrophobicContact CD2-CG2 4.17Å; N90-V153 HydrophobicContact CB-CG1 4.36Å; T116-V153 HydrophobicContact CG2-CB 4.27Å; T116-V153 HydrophobicContact CG2-CG1 3.37Å; T116-V153 HydrophobicContact CG2-CG2 3.98Å; W117-V153 CarbonylContact O-C 3.6Å; W117-V153 WeakPolarHBondContact O-CA 3.49Å
154	V	67.3	Low	68.2	Low	35 Å²	35	75 Å²	75	21%	0.212	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.4	171.3	-59.8	0	0	0	0	109.8	W117 K119 E152 N156	W117-V154 HydrophobicContact CB-CG2 3.64Å; W117-V154 PolarHBondContact N-O 3.44Å; W117-V154 PolarHBondContact O-N 2.91Å; K119-V154 HydrophobicContact CB-CG1 3.93Å; K119-V154 HydrophobicContact CB-CG2 4.1Å; K119-V154 HydrophobicContact CD-CG1 4.12Å; E152-V154 PolarHBondContact O-N 2.54Å; V154-N156 VanDerWaalsContact C-N 3.28Å; V154-N156 PolarHBondContact O-N 3.34Å
155	E	57.4	Low	66.3	Low	163 Å²	163	71.9 Å²	71.9	76%	0.762	41%	0.406	S	S	*	.	S	Bend	trans	-78	-11.7	-176.8	-66.4	-174.2	165.3	0	0	112.9
156	N	53.9	Low	64.6	Low	105 Å²	105	66 Å²	66	56%	0.561	39%	0.388	S	S	*	.			trans	-146.5	124.1	-171.5	-139.3	-29.2	0	0	0	113.1	V154 H158	V154-N156 VanDerWaalsContact C-N 3.28Å; V154-N156 PolarHBondContact O-N 3.34Å; N156-H158 PolarHBondContact OD1-CD2 3.06Å
157	T	50.5	Low	62.7	Low	43 Å²	43	73.8 Å²	73.8	26%	0.264	42%	0.421	S	S	.	.			trans	-96.3	6.1	-175.9	40.8	0	0	0	0	115.4	W117 N159 V160	W117-T157 HydrophobicContact CB-CG2 3.93Å; W117-T157 VanDerWaalsContact CD1-CG2 3.46Å; W117-T157 HydrophobicContact CD2-CG2 3.11Å; W117-T157 HydrophobicContact CE3-CG2 3.6Å; W117-T157 HydrophobicContact CG-CG2 3.23Å; W117-T157 HydrophobicContact CH2-CG2 4.34Å; W117-T157 HydrophobicContact CZ2-CG2 3.94Å; W117-T157 HydrophobicContact CZ3-CG2 4.19Å; T157-N159 PolarHBondContact O-N 2.8Å; T157-V160 HydrophobicContact CG2-CB 4.21Å; T157-V160 HydrophobicContact CG2-CG2 4.37Å; T157-V160 PolarHBondContact O-N 3.27Å
158	H	48	Very low	60.8	Low	167 Å²	167	71.8 Å²	71.8	77%	0.773	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-22.6	176.7	-73.9	-61.2	0	0	0	113.3	N156	N156-H158 PolarHBondContact OD1-CD2 3.06Å
159	N	45	Very low	59.2	Low	116 Å²	116	72.6 Å²	72.6	62%	0.62	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	17.8	177.7	-54.8	-35.4	0	0	0	113.8	T157 H183	T157-N159 PolarHBondContact O-N 2.8Å; N159-H183 PolarHBondContact O-CD2 3.05Å; N159-H183 PolarHBondContact O-NE2 2.91Å
160	V	50.3	Low	57.8	Low	13 Å²	13	70.5 Å²	70.5	8%	0.079	41%	0.412	C	S	.	.	S	Bend	trans	-116.7	112.4	175.3	-177.3	0	0	0	0	107.1	K119 T157 A162 C179	K119-V160 HydrophobicContact CD-CG2 4.3Å; T157-V160 HydrophobicContact CG2-CB 4.21Å; T157-V160 HydrophobicContact CG2-CG2 4.37Å; T157-V160 PolarHBondContact O-N 3.27Å; V160-A162 PolarHBondContact O-N 2.82Å; V160-C179 HydrophobicContact CG1-CB 3.56Å
161	G	45.3	Very low	56.8	Low	39 Å²	39	65.6 Å²	65.6	40%	0.402	39%	0.391	S	S	.	.			trans	-53.9	110.6	177.3	0	0	0	0	0	110.3	G163 D164	G161-G163 PolarHBondContact O-N 2.84Å; G161-D164 PolarHBondContact O-N 2.9Å
162	A	44.8	Very low	55.8	Low	91 Å²	91	65.8 Å²	65.8	75%	0.752	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-14.2	-175.5	0	0	0	0	0	114	V160	V160-A162 PolarHBondContact O-N 2.82Å
163	G	45.3	Very low	54.9	Low	76 Å²	76	61.1 Å²	61.1	78%	0.784	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-21.1	175.9	0	0	0	0	0	115.2	G161	G161-G163 PolarHBondContact O-N 2.84Å
164	D	51.2	Low	54.5	Low	51 Å²	51	59.3 Å²	59.3	27%	0.273	36%	0.36	S	S	.	.	S	Bend	trans	-101.8	0	-177.5	-78.6	-56.3	0	0	0	114.4	R78 G161 A180 T182	R78-D164 IonicContact NH2-OD1 2.91Å; G161-D164 PolarHBondContact O-N 2.9Å; D164-A180 HydrophobicContact CB-CB 4.23Å; D164-T182 HydrophobicContact CB-CG2 4.02Å; D164-T182 VanDerWaalsContact OD2-CB 3.29Å; D164-T182 WeakPolarHBondContact OD2-CB 2.94Å; D164-T182 WeakPolarHBondContact OD2-CG2 3.29Å; D164-T182 PolarHBondContact OD2-OG1 2.74Å
165	C	56.3	Low	54.1	Low	22 Å²	22	57.7 Å²	57.7	15%	0.149	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	123.2	172.1	-64	0	0	0	0	110.2	W117 K167 C179	W117-C165 HydrophobicContact CZ3-CB 4.47Å; C165-K167 PolarHBondContact O-N 3.42Å; C165-K167 VanDerWaalsContact O-N 3.07Å; C165-C179 HydrophobicContact CB-CB 4.07Å; C165-C179 WeakPolarHBondContact CB-SG 3.03Å; C165-C179 WeakPolarHBondContact SG-CB 2.86Å; C165-C179 CovalentContact SG-SG 2.03Å; C165-C179 PolarHBondContact SG-SG 3.42Å
166	A	57	Low	54.4	Low	51 Å²	51	50.4 Å²	50.4	42%	0.421	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	107.6	163.7	0	0	0	0	0	107	A168 I178	A166-A168 PolarHBondContact O-N 3.38Å; A166-I178 PolarHBondContact N-O 3.33Å; A166-I178 VanDerWaalsContact N-O 3.14Å
167	K	52.2	Low	54.9	Low	191 Å²	191	45.7 Å²	45.7	83%	0.83	29%	0.291	S	S	*	.			trans	-51.5	111.8	173.7	-81.3	-171.6	179.1	-178.2	0	108.3	C165 G169	C165-K167 PolarHBondContact O-N 3.42Å; C165-K167 VanDerWaalsContact O-N 3.07Å; K167-G169 PolarHBondContact O-N 3.37Å
168	A	54.8	Low	55.6	Low	23 Å²	23	44.8 Å²	44.8	19%	0.19	29%	0.285	C	S	.	.			trans	-79.5	112.8	-178	0	0	0	0	0	107.9	A166 L171 G172 I176	A166-A168 PolarHBondContact O-N 3.38Å; A168-L171 HydrophobicContact CB-CB 3.73Å; A168-G172 WeakPolarHBondContact O-CA 3.41Å; A168-G172 PolarHBondContact O-N 2.74Å; A168-I176 WeakPolarHBondContact CB-O 3.15Å
169	G	59.1	Low	56.3	Low	28 Å²	28	36.9 Å²	36.9	29%	0.289	25%	0.248	S	C	.	.	S	Bend	trans	-65.8	-101.2	177.6	0	0	0	0	0	111	E38 K167 L171 G172	E38-G169 WeakPolarHBondContact OE1-CA 3.35Å; K167-G169 PolarHBondContact O-N 3.37Å; G169-L171 PolarHBondContact O-N 2.91Å; G169-G172 PolarHBondContact O-N 3.37Å
170	F	59.9	Low	57	Low	0 Å²	0	31.7 Å²	31.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.3	-32.5	177.5	-175.8	-111.7	0	0	0	113.6	I26 E38 V40 V51 S101 K104 G172 I173 W174	I26-F170 HydrophobicContact CD1-CB 4.48Å; I26-F170 HydrophobicContact CD1-CD1 4.31Å; I26-F170 HydrophobicContact CD1-CD2 3.23Å; I26-F170 HydrophobicContact CD1-CE1 4.31Å; I26-F170 HydrophobicContact CD1-CE2 3.37Å; I26-F170 HydrophobicContact CD1-CG 3.77Å; I26-F170 HydrophobicContact CD1-CZ 3.94Å; E38-F170 HydrophobicContact CB-CB 4.48Å; E38-F170 VanDerWaalsContact CD-N 3.27Å; E38-F170 PolarHBondContact OE1-N 3.14Å; E38-F170 VanDerWaalsContact OE2-CB 3.24Å; E38-F170 WeakPolarHBondContact OE2-CB 3.41Å; E38-F170 PolarHBondContact OE2-N 3.07Å; V40-F170 HydrophobicContact CB-CE1 4.06Å; V40-F170 HydrophobicContact CG1-CE1 3.86Å; V40-F170 HydrophobicContact CG2-CD1 3.28Å; V40-F170 HydrophobicContact CG2-CE1 3.09Å; V40-F170 HydrophobicContact CG2-CG 4.01Å; V40-F170 HydrophobicContact CG2-CZ 3.83Å; V51-F170 HydrophobicContact CG1-CD1 4.16Å; V51-F170 HydrophobicContact CG2-CD1 4.1Å; V51-F170 HydrophobicContact CG2-CE1 4.43Å; S101-F170 WeakPolarHBondContact OG-CZ 3.13Å; K104-F170 HydrophobicContact CB-CD2 4.43Å; K104-F170 HydrophobicContact CB-CE2 4Å; K104-F170 HydrophobicContact CG-CD2 4.18Å; K104-F170 HydrophobicContact CG-CE2 4.25Å; F170-G172 PolarHBondContact O-N 3.41Å; F170-I173 HydrophobicContact CD2-CD1 3.92Å; F170-I173 HydrophobicContact CE2-CD1 4.34Å; F170-I173 WeakPolarHBondContact O-CB 3.28Å; F170-I173 PolarHBondContact O-N 3.15Å; F170-W174 HydrophobicContact CD1-CD2 4.18Å; F170-W174 AromaticContact CD1-CE2 3.83Å; F170-W174 HydrophobicContact CD1-CH2 4.26Å; F170-W174 AromaticContact CD1-CZ2 3.96Å; F170-W174 HydrophobicContact CD1-CZ2 3.96Å; F170-W174 AromaticContact CE1-CD2 3.78Å; F170-W174 HydrophobicContact CE1-CD2 3.78Å; F170-W174 AromaticContact CE1-CE2 2.99Å; F170-W174 HydrophobicContact CE1-CE3 4.31Å; F170-W174 AromaticContact CE1-CH2 3.56Å; F170-W174 HydrophobicContact CE1-CH2 3.56Å; F170-W174 AromaticContact CE1-CZ2 2.95Å; F170-W174 HydrophobicContact CE1-CZ2 2.95Å; F170-W174 HydrophobicContact CE1-CZ3 4.21Å; F170-W174 AromaticContact CE1-NE1 3.33Å; F170-W174 VanDerWaalsContact CE1-NE1 3.33Å; F170-W174 AromaticContact CE2-NE1 3.87Å; F170-W174 HydrophobicContact CZ-CD2 4.29Å; F170-W174 AromaticContact CZ-CE2 3.28Å; F170-W174 HydrophobicContact CZ-CH2 4.46Å; F170-W174 AromaticContact CZ-CZ2 3.46Å; F170-W174 HydrophobicContact CZ-CZ2 3.46Å; F170-W174 VanDerWaalsContact CZ-CZ2 3.46Å; F170-W174 AromaticContact CZ-NE1 3.06Å; F170-W174 PolarHBondContact O-N 2.99Å
171	L	65.8	Low	57.4	Low	6 Å²	6	32.7 Å²	32.7	3%	0.031	23%	0.226	C	C	.	.	H	α-helix	trans	-60	-29.2	173.2	-70.6	175.1	0	0	0	112.8	V51 I53 T62 F64 A168 G169 I173 W174 G175 I176	V51-L171 HydrophobicContact CB-CD2 4.03Å; V51-L171 HydrophobicContact CB-CG 4.45Å; V51-L171 HydrophobicContact CG1-CD2 4.19Å; V51-L171 HydrophobicContact CG1-CG 4.11Å; V51-L171 HydrophobicContact CG2-CD2 3.97Å; I53-L171 HydrophobicContact CD1-CD1 4.17Å; I53-L171 HydrophobicContact CD1-CG 4.47Å; T62-L171 HydrophobicContact CG2-CD2 4.17Å; T62-L171 WeakPolarHBondContact OG1-CD1 3.29Å; F64-L171 HydrophobicContact CE2-CD2 3.85Å; F64-L171 HydrophobicContact CZ-CD2 3.94Å; A168-L171 HydrophobicContact CB-CB 3.73Å; G169-L171 PolarHBondContact O-N 2.91Å; L171-I173 VanDerWaalsContact C-N 3.33Å; L171-I173 PolarHBondContact O-N 2.96Å; L171-W174 HydrophobicContact CD2-CE3 3.9Å; L171-W174 HydrophobicContact CD2-CZ3 4.32Å; L171-W174 CarbonylContact O-C 3.53Å; L171-W174 WeakPolarHBondContact O-CA 3.29Å; L171-W174 WeakPolarHBondContact O-CB 3.35Å; L171-W174 PolarHBondContact O-N 3.06Å; L171-W174 VanDerWaalsContact O-N 3.15Å; L171-G175 PolarHBondContact O-N 2.71Å; L171-I176 CarbonylContact C-O 3.52Å; L171-I176 PolarHBondContact O-N 3.04Å
172	G	59.8	Low	57.7	Low	7 Å²	7	34 Å²	34	7%	0.072	23%	0.226	C	C	.	.	H	α-helix	trans	-69.4	-29.2	175.7	0	0	0	0	0	113	A168 G169 F170 W174 G175	A168-G172 WeakPolarHBondContact O-CA 3.41Å; A168-G172 PolarHBondContact O-N 2.74Å; G169-G172 PolarHBondContact O-N 3.37Å; F170-G172 PolarHBondContact O-N 3.41Å; G172-W174 PolarHBondContact O-N 2.75Å; G172-G175 WeakPolarHBondContact O-CA 3.27Å; G172-G175 PolarHBondContact O-N 2.91Å
173	I	57.1	Low	57.6	Low	10 Å²	10	35.8 Å²	35.8	5%	0.051	22%	0.219	C	C	.	.	H	α-helix	trans	-67.6	-31	171.9	-60.7	175.9	0	0	0	110.4	K104 S112 F170 L171 G175	K104-I173 HydrophobicContact CB-CD1 4.25Å; K104-I173 HydrophobicContact CD-CD1 3.44Å; K104-I173 VanDerWaalsContact CD-CD1 3.44Å; K104-I173 HydrophobicContact CG-CD1 3.67Å; S112-I173 WeakPolarHBondContact CB-O 3.47Å; S112-I173 PolarHBondContact OG-O 2.88Å; F170-I173 HydrophobicContact CD2-CD1 3.92Å; F170-I173 HydrophobicContact CE2-CD1 4.34Å; F170-I173 WeakPolarHBondContact O-CB 3.28Å; F170-I173 PolarHBondContact O-N 3.15Å; L171-I173 VanDerWaalsContact C-N 3.33Å; L171-I173 PolarHBondContact O-N 2.96Å; I173-G175 PolarHBondContact O-N 3.39Å
174	W	64.2	Low	57.2	Low	9 Å²	9	42.1 Å²	42.1	3%	0.034	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	4.1	172.8	-61	-11.1	0	0	0	113	V40 A49 V51 F64 L97 Y100 F170 L171 G172 I176	V40-W174 HydrophobicContact CG1-CH2 3.67Å; V40-W174 HydrophobicContact CG1-CZ2 3.92Å; A49-W174 HydrophobicContact CB-CH2 4.31Å; V51-W174 HydrophobicContact CG2-CE3 3.95Å; V51-W174 HydrophobicContact CG2-CH2 3.41Å; V51-W174 VanDerWaalsContact CG2-CH2 3.41Å; V51-W174 HydrophobicContact CG2-CZ2 4.46Å; V51-W174 HydrophobicContact CG2-CZ3 3.1Å; F64-W174 AromaticContact CD2-CZ3 3.9Å; F64-W174 HydrophobicContact CD2-CZ3 3.9Å; F64-W174 HydrophobicContact CE1-CE3 4.37Å; F64-W174 AromaticContact CE2-CE3 3.72Å; F64-W174 HydrophobicContact CE2-CE3 3.72Å; F64-W174 AromaticContact CE2-CZ3 3.42Å; F64-W174 HydrophobicContact CE2-CZ3 3.42Å; F64-W174 VanDerWaalsContact CE2-CZ3 3.42Å; F64-W174 AromaticContact CZ-CE3 3.62Å; F64-W174 HydrophobicContact CZ-CE3 3.62Å; F64-W174 AromaticContact CZ-CZ3 3.82Å; F64-W174 HydrophobicContact CZ-CZ3 3.82Å; L97-W174 HydrophobicContact CB-CH2 4.01Å; L97-W174 HydrophobicContact CB-CZ2 3.53Å; L97-W174 HydrophobicContact CD1-CE3 4.23Å; L97-W174 HydrophobicContact CD1-CH2 3.68Å; L97-W174 HydrophobicContact CD1-CZ2 4.01Å; L97-W174 HydrophobicContact CD1-CZ3 3.77Å; L97-W174 HydrophobicContact CD2-CB 4.33Å; L97-W174 HydrophobicContact CD2-CD2 3.5Å; L97-W174 VanDerWaalsContact CD2-CD2 3.5Å; L97-W174 HydrophobicContact CD2-CE3 3.86Å; L97-W174 HydrophobicContact CD2-CG 3.74Å; L97-W174 HydrophobicContact CD2-CH2 4.19Å; L97-W174 HydrophobicContact CD2-CZ2 3.79Å; L97-W174 HydrophobicContact CD2-CZ3 4.19Å; L97-W174 HydrophobicContact CG-CD2 4.48Å; L97-W174 HydrophobicContact CG-CH2 4.18Å; L97-W174 HydrophobicContact CG-CZ2 3.98Å; L97-W174 HydrophobicContact CG-CZ3 4.46Å; Y100-W174 AromaticContact CD2-CD1 3.81Å; F170-W174 HydrophobicContact CD1-CD2 4.18Å; F170-W174 AromaticContact CD1-CE2 3.83Å; F170-W174 HydrophobicContact CD1-CH2 4.26Å; F170-W174 AromaticContact CD1-CZ2 3.96Å; F170-W174 HydrophobicContact CD1-CZ2 3.96Å; F170-W174 AromaticContact CE1-CD2 3.78Å; F170-W174 HydrophobicContact CE1-CD2 3.78Å; F170-W174 AromaticContact CE1-CE2 2.99Å; F170-W174 HydrophobicContact CE1-CE3 4.31Å; F170-W174 AromaticContact CE1-CH2 3.56Å; F170-W174 HydrophobicContact CE1-CH2 3.56Å; F170-W174 AromaticContact CE1-CZ2 2.95Å; F170-W174 HydrophobicContact CE1-CZ2 2.95Å; F170-W174 HydrophobicContact CE1-CZ3 4.21Å; F170-W174 AromaticContact CE1-NE1 3.33Å; F170-W174 VanDerWaalsContact CE1-NE1 3.33Å; F170-W174 AromaticContact CE2-NE1 3.87Å; F170-W174 HydrophobicContact CZ-CD2 4.29Å; F170-W174 AromaticContact CZ-CE2 3.28Å; F170-W174 HydrophobicContact CZ-CH2 4.46Å; F170-W174 AromaticContact CZ-CZ2 3.46Å; F170-W174 HydrophobicContact CZ-CZ2 3.46Å; F170-W174 VanDerWaalsContact CZ-CZ2 3.46Å; F170-W174 AromaticContact CZ-NE1 3.06Å; F170-W174 PolarHBondContact O-N 2.99Å; L171-W174 HydrophobicContact CD2-CE3 3.9Å; L171-W174 HydrophobicContact CD2-CZ3 4.32Å; L171-W174 CarbonylContact O-C 3.53Å; L171-W174 WeakPolarHBondContact O-CA 3.29Å; L171-W174 WeakPolarHBondContact O-CB 3.35Å; L171-W174 PolarHBondContact O-N 3.06Å; L171-W174 VanDerWaalsContact O-N 3.15Å; G172-W174 PolarHBondContact O-N 2.75Å; W174-I176 VanDerWaalsContact C-N 3.35Å
175	G	58.5	Low	57.5	Low	1 Å²	1	41.7 Å²	41.7	1%	0.01	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	63	40.5	-177	0	0	0	0	0	111.7	K114 T116 L171 G172 I173	K114-G175 WeakPolarHBondContact O-CA 3.33Å; T116-G175 CarbonylContact C-O 3.58Å; T116-G175 VanDerWaalsContact C-O 3.31Å; T116-G175 WeakPolarHBondContact CA-O 3.18Å; T116-G175 WeakPolarHBondContact CB-O 3.25Å; T116-G175 PolarHBondContact N-O 2.03Å; T116-G175 PolarHBondContact OG1-O 3.05Å; L171-G175 PolarHBondContact O-N 2.71Å; G172-G175 WeakPolarHBondContact O-CA 3.27Å; G172-G175 PolarHBondContact O-N 2.91Å; I173-G175 PolarHBondContact O-N 3.39Å
176	I	64.3	Low	57.6	Low	10 Å²	10	42.7 Å²	42.7	5%	0.051	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	118.5	175.5	-67	167.2	0	0	0	108.1	F64 I71 T116 V118 A168 L171 W174	F64-I176 HydrophobicContact CE1-CD1 3.35Å; F64-I176 HydrophobicContact CZ-CD1 3.48Å; F64-I176 VanDerWaalsContact CZ-CD1 3.48Å; I71-I176 HydrophobicContact CD1-CD1 4.25Å; T116-I176 WeakPolarHBondContact O-CA 3.46Å; V118-I176 HydrophobicContact CG2-CG2 4.05Å; A168-I176 WeakPolarHBondContact CB-O 3.15Å; L171-I176 CarbonylContact C-O 3.52Å; L171-I176 PolarHBondContact O-N 3.04Å; W174-I176 VanDerWaalsContact C-N 3.35Å
177	S	63.7	Low	57.6	Low	6 Å²	6	42.2 Å²	42.2	4%	0.042	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	130.3	172.7	178.8	0	0	0	0	109.2	T116 W117 V118	T116-S177 PolarHBondContact O-N 2.82Å; W117-S177 VanDerWaalsContact CE3-CB 3.42Å; W117-S177 VanDerWaalsContact CZ3-CB 3.49Å; W117-S177 VanDerWaalsContact CZ3-OG 3.28Å; W117-S177 WeakPolarHBondContact CZ3-OG 3.43Å; V118-S177 PolarHBondContact N-O 3.49Å
178	I	64.9	Low	57.9	Low	24 Å²	24	33.5 Å²	33.5	12%	0.123	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	120.2	-179.5	-57.7	173.7	0	0	0	108.3	S73 V75 F82 V118 Y120 A166	S73-I178 VanDerWaalsContact OG-CD1 3.25Å; S73-I178 WeakPolarHBondContact OG-CD1 3.45Å; V75-I178 HydrophobicContact CG2-CD1 4.42Å; F82-I178 HydrophobicContact CD2-CD1 4.29Å; F82-I178 HydrophobicContact CD2-CG2 3.97Å; F82-I178 HydrophobicContact CE2-CG2 4.24Å; F82-I178 HydrophobicContact CG-CG2 4.13Å; V118-I178 HydrophobicContact CB-CG1 4.44Å; V118-I178 WeakPolarHBondContact O-CA 3.31Å; Y120-I178 HydrophobicContact CD1-CG2 4.42Å; A166-I178 PolarHBondContact N-O 3.33Å; A166-I178 VanDerWaalsContact N-O 3.14Å
179	C	63	Low	58.1	Low	1 Å²	1	34.1 Å²	34.1	1%	0.007	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	137.9	-178	-56	0	0	0	0	110.4	W117 V118 K119 Y120 V160 C165	W117-C179 VanDerWaalsContact CE3-SG 3.53Å; V118-C179 PolarHBondContact O-N 2.61Å; K119-C179 WeakPolarHBondContact CA-O 3.41Å; Y120-C179 WeakPolarHBondContact CD1-O 3.06Å; Y120-C179 PolarHBondContact N-O 2.83Å; V160-C179 HydrophobicContact CG1-CB 3.56Å; C165-C179 HydrophobicContact CB-CB 4.07Å; C165-C179 WeakPolarHBondContact CB-SG 3.03Å; C165-C179 WeakPolarHBondContact SG-CB 2.86Å; C165-C179 CovalentContact SG-SG 2.03Å; C165-C179 PolarHBondContact SG-SG 3.42Å
180	A	60.3	Low	58.1	Low	6 Å²	6	34.5 Å²	34.5	5%	0.05	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	140.4	166.8	0	0	0	0	0	109.5	Y120 D164 T182	Y120-A180 HydrophobicContact CE1-CB 3.79Å; D164-A180 HydrophobicContact CB-CB 4.23Å; A180-T182 HydrophobicContact CB-CG2 4.24Å; A180-T182 PolarHBondContact O-N 2.9Å
181	D	57.6	Low	57.9	Low	35 Å²	35	37 Å²	37	19%	0.187	21%	0.209	C	C	.	.			trans	-72.7	114.2	162.1	-164.8	10.6	0	0	0	109.2	K119 Y120 H183	K119-D181 HydrophobicContact CD-CB 4.34Å; K119-D181 WeakPolarHBondContact CE-OD1 3Å; K119-D181 WeakPolarHBondContact CE-OD2 3.04Å; K119-D181 HydrophobicContact CG-CB 4.13Å; K119-D181 IonicContact NZ-OD1 2.75Å; K119-D181 PolarHBondContact NZ-OD1 2.89Å; K119-D181 IonicContact NZ-OD2 3.65Å; K119-D181 PolarHBondContact NZ-OD2 2.92Å; Y120-D181 PolarHBondContact O-N 2.82Å; D181-H183 IonicContact OD1-CD2 3.85Å; D181-H183 PolarHBondContact OD1-N 2.96Å
182	T	51.7	Low	57.3	Low	66 Å²	66	39.4 Å²	39.4	41%	0.405	22%	0.222	S	C	.	.			trans	-112.5	22.3	176.8	52.4	0	0	0	0	113.7	D164 A180 V184	D164-T182 HydrophobicContact CB-CG2 4.02Å; D164-T182 VanDerWaalsContact OD2-CB 3.29Å; D164-T182 WeakPolarHBondContact OD2-CB 2.94Å; D164-T182 WeakPolarHBondContact OD2-CG2 3.29Å; D164-T182 PolarHBondContact OD2-OG1 2.74Å; A180-T182 HydrophobicContact CB-CG2 4.24Å; A180-T182 PolarHBondContact O-N 2.9Å; T182-V184 VanDerWaalsContact C-N 3.33Å; T182-V184 PolarHBondContact O-N 2.95Å
183	H	43.9	Very low	57.1	Low	129 Å²	129	42.1 Å²	42.1	60%	0.597	24%	0.235	S	C	*	.			trans	-67.8	95.2	160.2	-80.8	-73.2	0	0	0	110	N159 D181	N159-H183 PolarHBondContact O-CD2 3.05Å; N159-H183 PolarHBondContact O-NE2 2.91Å; D181-H183 IonicContact OD1-CD2 3.85Å; D181-H183 PolarHBondContact OD1-N 2.96Å
184	V	36.5	Very low	57.1	Low	208 Å²	208	45 Å²	45	100%	1.261	25%	0.252	S	S	*	.			trans	-83.6	0	153.9	-175.1	0	0	0	0	108.3	T182	T182-V184 VanDerWaalsContact C-N 3.33Å; T182-V184 PolarHBondContact O-N 2.95Å

Retrieved 184 of 184 residues in 117.7 ms (Link to these results)

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