A0A087WUQ7_HUMAN Loading...

Cytochrome P450 family 1 subfamily B member 1

AlphaFold DB , UniProt , Accession A0A087WUQ7, Species HUMAN (Homo sapiens, Human), Gene CYP1B1, Length 143 aa.

						>A0A087WUQ7_HUMAN|A0A087WUQ7|CYP1B1
MGTSLSPNDPWPLNPLSIQQTTLLLLLSVLATVHVGQRLLRQRRRQLRSAPPGPFAWPLIGNAAAVGQAAHLSFARLARRYGDVFQIRLGSCPIVVLNGERAIHQALVQQGSAFADRPAFASFRVVSGGRSMAFGHYSEHWKV
					

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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	46.7	Very low	59.9	Low	251 Å²	251	138.2 Å²	138.2	100%	1.236	79%	0.792	S	S	*	*				0	78.3	0	-163.9	154.3	154.6	0	0	106.9
2	G	49.3	Very low	59.9	Low	80 Å²	80	135.6 Å²	135.6	83%	0.825	78%	0.784	S	S	*	*			trans	-95.5	124.4	-172.6	0	0	0	0	0	110	S4	G2-S4 PolarHBondContact O-N 3.12Å
3	T	54.4	Low	60.5	Low	134 Å²	134	137.1 Å²	137.1	82%	0.822	79%	0.786	S	S	*	*			trans	-79.6	107.8	169.6	47.5	0	0	0	0	108.3	L5	T3-L5 PolarHBondContact O-N 3.2Å
4	S	55.4	Low	61.3	Low	113 Å²	113	137.4 Å²	137.4	79%	0.79	78%	0.784	S	S	*	*			trans	-62.9	111.3	167	53.8	0	0	0	0	108.8	G2 S6	G2-S4 PolarHBondContact O-N 3.12Å; S4-S6 PolarHBondContact O-N 3.11Å
5	L	56.1	Low	62	Low	157 Å²	157	136.2 Å²	136.2	82%	0.822	78%	0.784	S	S	*	*			trans	-71.9	114.6	167.3	-74.5	164.1	0	0	0	107.7	T3	T3-L5 PolarHBondContact O-N 3.2Å
6	S	65.1	Low	62.8	Low	60 Å²	60	133.8 Å²	133.8	42%	0.42	77%	0.767	S	S	.	*			trans	-69.7	129.4	174.5	-177.7	0	0	0	0	108.5	S4 N8 D9	S4-S6 PolarHBondContact O-N 3.11Å; S6-N8 PolarHBondContact O-N 3.43Å; S6-D9 PolarHBondContact O-N 3.33Å
7	P	66.4	Low	64.1	Low	130 Å²	130	129.4 Å²	129.4	84%	0.844	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-6	-178.6	-21.9	32.3	0	0	0	115
8	N	64.9	Low	65.3	Low	141 Å²	141	130 Å²	130	75%	0.754	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115	9.6	-172.8	-77.9	-19.1	0	0	0	114.4	S6 P10	S6-N8 PolarHBondContact O-N 3.43Å; N8-P10 WeakPolarHBondContact O-CD 3.33Å
9	D	65.1	Low	66.5	Low	110 Å²	110	131.2 Å²	131.2	59%	0.588	74%	0.743	S	S	*	*			trans	-71.1	113.3	176.7	-67.9	-30.2	0	0	0	109.5	S6 W11	S6-D9 PolarHBondContact O-N 3.33Å; D9-W11 PolarHBondContact O-N 3.25Å
10	P	69	Low	67.6	Low	115 Å²	115	129.5 Å²	129.5	75%	0.747	73%	0.728	S	S	*	*			trans	-63.4	134.4	178.1	25.2	-30.8	0	0	0	109.1	N8	N8-P10 WeakPolarHBondContact O-CD 3.33Å
11	W	65.9	Low	68.7	Low	229 Å²	229	126 Å²	126	87%	0.867	71%	0.71	S	S	*	*			trans	-45.2	134.2	178.3	-64.5	103	0	0	0	111.1	D9 L13	D9-W11 PolarHBondContact O-N 3.25Å; W11-L13 VanDerWaalsContact C-N 3.28Å; W11-L13 PolarHBondContact O-N 3.45Å
12	P	60.5	Low	70.8	Confident	107 Å²	107	117.3 Å²	117.3	70%	0.695	67%	0.671	S	S	*	*			trans	-67.2	92.7	175.3	27.6	-32.4	0	0	0	108.3	N14	P12-N14 PolarHBondContact O-N 2.87Å
13	L	67.4	Low	73	Confident	155 Å²	155	118 Å²	118	81%	0.812	66%	0.655	S	S	*	*			trans	-71.8	89.8	166.3	-62.6	178.1	0	0	0	105.8	W11 P15	W11-L13 VanDerWaalsContact C-N 3.28Å; W11-L13 PolarHBondContact O-N 3.45Å; L13-P15 WeakPolarHBondContact O-CD 3.32Å
14	N	71.7	Confident	74.9	Confident	141 Å²	141	116.2 Å²	116.2	75%	0.754	64%	0.64	S	S	*	*			trans	-56.8	110.8	171.6	-71.4	-28.1	0	0	0	107.4	P12 L16	P12-N14 PolarHBondContact O-N 2.87Å; N14-L16 PolarHBondContact O-N 3.45Å; N14-L16 VanDerWaalsContact O-N 3.17Å
15	P	71.7	Confident	76.8	Confident	120 Å²	120	116.2 Å²	116.2	78%	0.779	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-65.3	123.8	179.1	27.1	-31.6	0	0	0	107.3	L13 S17	L13-P15 WeakPolarHBondContact O-CD 3.32Å; P15-S17 PolarHBondContact O-N 3.23Å
16	L	75.6	Confident	78.8	Confident	98 Å²	98	114.9 Å²	114.9	51%	0.513	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-54.1	137.9	174.6	-68.5	167.9	0	0	0	109	N14 Q20 T21 L24	N14-L16 PolarHBondContact O-N 3.45Å; N14-L16 VanDerWaalsContact O-N 3.17Å; L16-Q20 HydrophobicContact CB-CB 4.21Å; L16-Q20 HydrophobicContact CD2-CB 4.39Å; L16-T21 HydrophobicContact CB-CG2 3.84Å; L16-L24 HydrophobicContact CD1-CD1 4.12Å
17	S	83.8	Confident	80.3	Confident	58 Å²	58	116.6 Å²	116.6	41%	0.406	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-63.4	152.9	176.9	72.9	0	0	0	0	110.3	P15 Q19 Q20 T21	P15-S17 PolarHBondContact O-N 3.23Å; S17-Q19 PolarHBondContact O-N 2.96Å; S17-Q19 VanDerWaalsContact O-N 3.09Å; S17-Q20 WeakPolarHBondContact O-CA 3.39Å; S17-Q20 WeakPolarHBondContact O-CB 3.43Å; S17-Q20 PolarHBondContact O-N 3Å; S17-Q20 WeakPolarHBondContact OG-CG 3.32Å; S17-Q20 PolarHBondContact OG-N 2.91Å; S17-T21 PolarHBondContact O-N 3.3Å
18	I	85.8	Confident	81.7	Confident	141 Å²	141	113.1 Å²	113.1	72%	0.723	61%	0.607	S	S	*	*	H	α-helix	trans	-54.7	-33.2	178.8	-61.7	172.3	0	0	0	111	T21 T22	I18-T21 WeakPolarHBondContact CA-OG1 3.35Å; I18-T21 PolarHBondContact O-OG1 2.92Å; I18-T22 HydrophobicContact CG2-CG2 4.36Å; I18-T22 WeakPolarHBondContact O-CB 3.48Å; I18-T22 VanDerWaalsContact O-CG2 3.25Å; I18-T22 WeakPolarHBondContact O-CG2 2.92Å; I18-T22 PolarHBondContact O-N 3.06Å; I18-T22 PolarHBondContact O-OG1 3.22Å
19	Q	88.9	Confident	83.2	Confident	153 Å²	153	110.5 Å²	110.5	72%	0.715	60%	0.595	S	S	*	*	H	α-helix	trans	-66.7	-37.1	174.8	-171.3	177.5	-28.3	0	0	112.8	S17 T22 L23	S17-Q19 PolarHBondContact O-N 2.96Å; S17-Q19 VanDerWaalsContact O-N 3.09Å; Q19-T22 WeakPolarHBondContact CA-OG1 3.44Å; Q19-T22 PolarHBondContact O-OG1 3Å; Q19-L23 VanDerWaalsContact O-CB 3.32Å; Q19-L23 WeakPolarHBondContact O-CB 3.32Å; Q19-L23 PolarHBondContact O-N 2.67Å; Q19-L23 VanDerWaalsContact O-N 3.16Å
20	Q	88.8	Confident	84.8	Confident	97 Å²	97	110.8 Å²	110.8	45%	0.453	60%	0.596	S	S	.	*	H	α-helix	trans	-70.6	-42.4	175.9	-71.2	169.9	-31.4	0	0	111.5	L16 S17 L23 L24	L16-Q20 HydrophobicContact CB-CB 4.21Å; L16-Q20 HydrophobicContact CD2-CB 4.39Å; S17-Q20 WeakPolarHBondContact O-CA 3.39Å; S17-Q20 WeakPolarHBondContact O-CB 3.43Å; S17-Q20 PolarHBondContact O-N 3Å; S17-Q20 WeakPolarHBondContact OG-CG 3.32Å; S17-Q20 PolarHBondContact OG-N 2.91Å; Q20-L23 PolarHBondContact O-N 3.26Å; Q20-L24 VanDerWaalsContact O-CG 3.3Å; Q20-L24 WeakPolarHBondContact O-CG 3.49Å; Q20-L24 PolarHBondContact O-N 3.34Å
21	T	89.6	Confident	86.1	Confident	56 Å²	56	107.8 Å²	107.8	34%	0.344	58%	0.582	S	S	.	*	H	α-helix	trans	-66.8	-42.9	179.7	58.1	0	0	0	0	111.9	L16 S17 I18 L23 L24 L25	L16-T21 HydrophobicContact CB-CG2 3.84Å; S17-T21 PolarHBondContact O-N 3.3Å; I18-T21 WeakPolarHBondContact CA-OG1 3.35Å; I18-T21 PolarHBondContact O-OG1 2.92Å; T21-L23 PolarHBondContact O-N 3.31Å; T21-L24 PolarHBondContact O-N 2.86Å; T21-L25 WeakPolarHBondContact O-CG 3.27Å; T21-L25 PolarHBondContact O-N 3.39Å
22	T	91.8	Very high	87.6	Confident	68 Å²	68	101.4 Å²	101.4	42%	0.417	57%	0.568	S	S	.	*	H	α-helix	trans	-61.2	-42.7	175	48	0	0	0	0	112.4	I18 Q19 L25 L26	I18-T22 HydrophobicContact CG2-CG2 4.36Å; I18-T22 WeakPolarHBondContact O-CB 3.48Å; I18-T22 VanDerWaalsContact O-CG2 3.25Å; I18-T22 WeakPolarHBondContact O-CG2 2.92Å; I18-T22 PolarHBondContact O-N 3.06Å; I18-T22 PolarHBondContact O-OG1 3.22Å; Q19-T22 WeakPolarHBondContact CA-OG1 3.44Å; Q19-T22 PolarHBondContact O-OG1 3Å; T22-L25 PolarHBondContact O-N 3.43Å; T22-L26 WeakPolarHBondContact O-CG 3.45Å; T22-L26 PolarHBondContact O-N 3.06Å
23	L	94.7	Very high	89.3	Confident	95 Å²	95	99.7 Å²	99.7	50%	0.497	56%	0.555	S	S	.	*	H	α-helix	trans	-63.3	-44.7	176.3	-171.7	153.8	0	0	0	111.7	Q19 Q20 T21 L25 L26 L27	Q19-L23 VanDerWaalsContact O-CB 3.32Å; Q19-L23 WeakPolarHBondContact O-CB 3.32Å; Q19-L23 PolarHBondContact O-N 2.67Å; Q19-L23 VanDerWaalsContact O-N 3.16Å; Q20-L23 PolarHBondContact O-N 3.26Å; T21-L23 PolarHBondContact O-N 3.31Å; L23-L25 PolarHBondContact O-N 3.38Å; L23-L26 PolarHBondContact O-N 3.27Å; L23-L27 HydrophobicContact CD2-CD1 3.49Å; L23-L27 VanDerWaalsContact CD2-CD1 3.49Å; L23-L27 HydrophobicContact CD2-CG 4.06Å; L23-L27 WeakPolarHBondContact O-CG 3.41Å; L23-L27 PolarHBondContact O-N 3.38Å
24	L	94.9	Very high	90.6	Very high	96 Å²	96	96.5 Å²	96.5	50%	0.503	54%	0.536	S	S	.	.	H	α-helix	trans	-62.3	-41.6	177.2	-71.6	173.5	0	0	0	112.1	L16 Q20 T21 L27 S28	L16-L24 HydrophobicContact CD1-CD1 4.12Å; Q20-L24 VanDerWaalsContact O-CG 3.3Å; Q20-L24 WeakPolarHBondContact O-CG 3.49Å; Q20-L24 PolarHBondContact O-N 3.34Å; T21-L24 PolarHBondContact O-N 2.86Å; L24-L27 PolarHBondContact O-N 2.92Å; L24-S28 WeakPolarHBondContact O-CB 3.05Å; L24-S28 PolarHBondContact O-N 3.18Å
25	L	96.1	Very high	91.8	Very high	114 Å²	114	93.7 Å²	93.7	60%	0.597	52%	0.524	S	S	*	.	H	α-helix	trans	-61.9	-46.9	176	-73.4	173.3	0	0	0	111.3	T21 T22 L23 L27 S28 V29	T21-L25 WeakPolarHBondContact O-CG 3.27Å; T21-L25 PolarHBondContact O-N 3.39Å; T22-L25 PolarHBondContact O-N 3.43Å; L23-L25 PolarHBondContact O-N 3.38Å; L25-L27 PolarHBondContact O-N 2.91Å; L25-S28 PolarHBondContact O-N 2.83Å; L25-S28 PolarHBondContact O-OG 2.83Å; L25-V29 WeakPolarHBondContact O-CG2 3.4Å; L25-V29 PolarHBondContact O-N 3.44Å
26	L	96.6	Very high	92.9	Very high	129 Å²	129	89.1 Å²	89.1	68%	0.675	50%	0.499	S	S	*	.	H	α-helix	trans	-60.2	-44.2	177.3	-74.6	170.5	0	0	0	112.2	T22 L23 S28 V29 L30	T22-L26 WeakPolarHBondContact O-CG 3.45Å; T22-L26 PolarHBondContact O-N 3.06Å; L23-L26 PolarHBondContact O-N 3.27Å; L26-S28 PolarHBondContact O-N 3.35Å; L26-V29 PolarHBondContact O-N 3.34Å; L26-L30 WeakPolarHBondContact O-CB 3.21Å; L26-L30 PolarHBondContact O-N 3.45Å
27	L	96.6	Very high	93.8	Very high	96 Å²	96	88.9 Å²	88.9	50%	0.503	50%	0.495	S	S	.	.	H	α-helix	trans	-63.3	-40.6	175.8	-72.5	-179.5	0	0	0	112	L23 L24 L25 L30 A31	L23-L27 HydrophobicContact CD2-CD1 3.49Å; L23-L27 VanDerWaalsContact CD2-CD1 3.49Å; L23-L27 HydrophobicContact CD2-CG 4.06Å; L23-L27 WeakPolarHBondContact O-CG 3.41Å; L23-L27 PolarHBondContact O-N 3.38Å; L24-L27 PolarHBondContact O-N 2.92Å; L25-L27 PolarHBondContact O-N 2.91Å; L27-L30 PolarHBondContact O-N 3.2Å; L27-A31 VanDerWaalsContact O-CB 3.27Å; L27-A31 WeakPolarHBondContact O-CB 3.45Å; L27-A31 PolarHBondContact O-N 3.38Å
28	S	96.4	Very high	94.3	Very high	57 Å²	57	93.4 Å²	93.4	40%	0.399	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-41.2	178.4	78.4	0	0	0	0	112.1	L24 L25 L26 A31 T32	L24-S28 WeakPolarHBondContact O-CB 3.05Å; L24-S28 PolarHBondContact O-N 3.18Å; L25-S28 PolarHBondContact O-N 2.83Å; L25-S28 PolarHBondContact O-OG 2.83Å; L26-S28 PolarHBondContact O-N 3.35Å; S28-A31 PolarHBondContact O-N 2.79Å; S28-T32 WeakPolarHBondContact O-CG2 3.14Å; S28-T32 PolarHBondContact O-N 3.35Å; S28-T32 PolarHBondContact O-OG1 3.47Å
29	V	97.4	Very high	94.6	Very high	85 Å²	85	91 Å²	91	52%	0.515	49%	0.491	S	S	.	.	H	α-helix	trans	-66.7	-45	175.9	173.4	0	0	0	0	110.3	L25 L26 A31 T32 V33	L25-V29 WeakPolarHBondContact O-CG2 3.4Å; L25-V29 PolarHBondContact O-N 3.44Å; L26-V29 PolarHBondContact O-N 3.34Å; V29-A31 VanDerWaalsContact C-N 3.33Å; V29-A31 PolarHBondContact O-N 3.34Å; V29-T32 WeakPolarHBondContact CA-OG1 3.36Å; V29-T32 PolarHBondContact O-N 3.14Å; V29-T32 PolarHBondContact O-OG1 2.97Å; V29-V33 HydrophobicContact CG1-CG2 4.36Å; V29-V33 WeakPolarHBondContact O-CB 3.37Å; V29-V33 WeakPolarHBondContact O-CG2 3.22Å; V29-V33 PolarHBondContact O-N 2.99Å
30	L	97.1	Very high	94.7	Very high	116 Å²	116	88.5 Å²	88.5	61%	0.607	48%	0.482	S	S	*	.	H	α-helix	trans	-61.5	-42.8	177.3	-173.5	68.4	0	0	0	111.4	L26 L27 V33 H34	L26-L30 WeakPolarHBondContact O-CB 3.21Å; L26-L30 PolarHBondContact O-N 3.45Å; L27-L30 PolarHBondContact O-N 3.2Å; L30-V33 PolarHBondContact O-N 2.98Å; L30-H34 VanDerWaalsContact O-CB 3.29Å; L30-H34 WeakPolarHBondContact O-CB 3.43Å; L30-H34 PolarHBondContact O-N 2.94Å
31	A	96.9	Very high	94.7	Very high	53 Å²	53	91.4 Å²	91.4	44%	0.438	49%	0.489	S	S	.	.	H	α-helix	trans	-63.4	-46.8	177.9	0	0	0	0	0	111.9	L27 S28 V29 V33 H34 V35	L27-A31 VanDerWaalsContact O-CB 3.27Å; L27-A31 WeakPolarHBondContact O-CB 3.45Å; L27-A31 PolarHBondContact O-N 3.38Å; S28-A31 PolarHBondContact O-N 2.79Å; V29-A31 VanDerWaalsContact C-N 3.33Å; V29-A31 PolarHBondContact O-N 3.34Å; A31-V33 PolarHBondContact O-N 3.49Å; A31-H34 PolarHBondContact O-N 3.47Å; A31-V35 WeakPolarHBondContact O-CB 3.48Å; A31-V35 VanDerWaalsContact O-CG2 3.27Å; A31-V35 WeakPolarHBondContact O-CG2 3.41Å; A31-V35 PolarHBondContact O-N 2.91Å
32	T	96.4	Very high	94.4	Very high	94 Å²	94	94.1 Å²	94.1	58%	0.577	50%	0.498	S	S	*	.	H	α-helix	trans	-63.3	-42.1	178	51.5	0	0	0	0	112	S28 V29 G36	S28-T32 WeakPolarHBondContact O-CG2 3.14Å; S28-T32 PolarHBondContact O-N 3.35Å; S28-T32 PolarHBondContact O-OG1 3.47Å; V29-T32 WeakPolarHBondContact CA-OG1 3.36Å; V29-T32 PolarHBondContact O-N 3.14Å; V29-T32 PolarHBondContact O-OG1 2.97Å; T32-G36 PolarHBondContact O-N 3.25Å
33	V	97.2	Very high	93.8	Very high	71 Å²	71	99.6 Å²	99.6	43%	0.43	51%	0.511	S	S	.	.	H	α-helix	trans	-62	-46	174.4	172	0	0	0	0	110.7	V29 L30 A31 G36 Q37	V29-V33 HydrophobicContact CG1-CG2 4.36Å; V29-V33 WeakPolarHBondContact O-CB 3.37Å; V29-V33 WeakPolarHBondContact O-CG2 3.22Å; V29-V33 PolarHBondContact O-N 2.99Å; L30-V33 PolarHBondContact O-N 2.98Å; A31-V33 PolarHBondContact O-N 3.49Å; V33-G36 PolarHBondContact O-N 3.35Å; V33-Q37 HydrophobicContact CG1-CG 4.37Å; V33-Q37 WeakPolarHBondContact O-CB 3.48Å; V33-Q37 VanDerWaalsContact O-CG 3.25Å; V33-Q37 WeakPolarHBondContact O-CG 3.22Å; V33-Q37 PolarHBondContact O-N 3.22Å
34	H	95.4	Very high	93.1	Very high	89 Å²	89	102.7 Å²	102.7	41%	0.412	52%	0.516	S	S	.	.	H	α-helix	trans	-68	-42.4	-177.5	-156	63.8	0	0	0	112	L30 A31 Q37 R38	L30-H34 VanDerWaalsContact O-CB 3.29Å; L30-H34 WeakPolarHBondContact O-CB 3.43Å; L30-H34 PolarHBondContact O-N 2.94Å; A31-H34 PolarHBondContact O-N 3.47Å; H34-Q37 PolarHBondContact O-N 3.16Å; H34-R38 PolarHBondContact CD2-NE 2.87Å; H34-R38 VanDerWaalsContact CD2-NE 3.35Å; H34-R38 PolarHBondContact CD2-NH2 3.48Å; H34-R38 PolarHBondContact NE2-NE 2.85Å; H34-R38 PolarHBondContact NE2-NH2 2.96Å; H34-R38 WeakPolarHBondContact O-CB 3.4Å; H34-R38 VanDerWaalsContact O-CG 3.31Å; H34-R38 WeakPolarHBondContact O-CG 3.27Å; H34-R38 PolarHBondContact O-N 3.13Å
35	V	96.4	Very high	92.3	Very high	81 Å²	81	106.6 Å²	106.6	49%	0.491	52%	0.524	S	S	.	.	H	α-helix	trans	-62.3	-47.3	172.7	171.6	0	0	0	0	110.3	A31 Q37 R38 L39	A31-V35 WeakPolarHBondContact O-CB 3.48Å; A31-V35 VanDerWaalsContact O-CG2 3.27Å; A31-V35 WeakPolarHBondContact O-CG2 3.41Å; A31-V35 PolarHBondContact O-N 2.91Å; V35-Q37 PolarHBondContact O-N 3.35Å; V35-R38 PolarHBondContact O-N 3.02Å; V35-R38 VanDerWaalsContact O-N 3.16Å; V35-L39 HydrophobicContact CG1-CD1 3.88Å; V35-L39 HydrophobicContact CG1-CG 4.24Å; V35-L39 VanDerWaalsContact O-CG 3.31Å; V35-L39 WeakPolarHBondContact O-CG 3.18Å; V35-L39 PolarHBondContact O-N 3.45Å
36	G	95.3	Very high	91.3	Very high	25 Å²	25	107.6 Å²	107.6	26%	0.258	53%	0.525	S	S	.	.	H	α-helix	trans	-56.9	-47.7	176.2	0	0	0	0	0	112.2	T32 V33 R38 L39 L40	T32-G36 PolarHBondContact O-N 3.25Å; V33-G36 PolarHBondContact O-N 3.35Å; G36-R38 PolarHBondContact O-N 3.45Å; G36-L39 PolarHBondContact O-N 3.28Å; G36-L40 WeakPolarHBondContact O-CB 3.43Å; G36-L40 WeakPolarHBondContact O-CD1 3.35Å; G36-L40 PolarHBondContact O-N 2.88Å
37	Q	93.9	Very high	90.2	Very high	92 Å²	92	107.8 Å²	107.8	43%	0.43	53%	0.527	S	S	.	.	H	α-helix	trans	-60.5	-42.3	175.4	-75.2	178.4	-3.9	0	0	112.3	V33 H34 V35 R41	V33-Q37 HydrophobicContact CG1-CG 4.37Å; V33-Q37 WeakPolarHBondContact O-CB 3.48Å; V33-Q37 VanDerWaalsContact O-CG 3.25Å; V33-Q37 WeakPolarHBondContact O-CG 3.22Å; V33-Q37 PolarHBondContact O-N 3.22Å; H34-Q37 PolarHBondContact O-N 3.16Å; V35-Q37 PolarHBondContact O-N 3.35Å; Q37-R41 VanDerWaalsContact O-CB 3.31Å; Q37-R41 WeakPolarHBondContact O-CB 3.21Å; Q37-R41 WeakPolarHBondContact O-CG 3.37Å; Q37-R41 PolarHBondContact O-N 3.23Å
38	R	93.4	Very high	89.1	Confident	153 Å²	153	113.5 Å²	113.5	58%	0.577	54%	0.542	S	S	*	.	H	α-helix	trans	-63.1	-46.3	176.2	-75.1	-178.9	-175	-163.3	2.9	111.3	H34 V35 G36 R41 Q42	H34-R38 PolarHBondContact CD2-NE 2.87Å; H34-R38 VanDerWaalsContact CD2-NE 3.35Å; H34-R38 PolarHBondContact CD2-NH2 3.48Å; H34-R38 PolarHBondContact NE2-NE 2.85Å; H34-R38 PolarHBondContact NE2-NH2 2.96Å; H34-R38 WeakPolarHBondContact O-CB 3.4Å; H34-R38 VanDerWaalsContact O-CG 3.31Å; H34-R38 WeakPolarHBondContact O-CG 3.27Å; H34-R38 PolarHBondContact O-N 3.13Å; V35-R38 PolarHBondContact O-N 3.02Å; V35-R38 VanDerWaalsContact O-N 3.16Å; G36-R38 PolarHBondContact O-N 3.45Å; R38-R41 PolarHBondContact O-N 3.38Å; R38-Q42 WeakPolarHBondContact O-CB 3.46Å; R38-Q42 WeakPolarHBondContact O-CG 3.36Å; R38-Q42 PolarHBondContact O-N 3.17Å
39	L	93.1	Very high	88.3	Confident	91 Å²	91	116 Å²	116	48%	0.476	56%	0.559	S	S	.	*	H	α-helix	trans	-62.5	-44.4	177.6	-69.3	175	0	0	0	111.8	V35 G36 Q42 R43	V35-L39 HydrophobicContact CG1-CD1 3.88Å; V35-L39 HydrophobicContact CG1-CG 4.24Å; V35-L39 VanDerWaalsContact O-CG 3.31Å; V35-L39 WeakPolarHBondContact O-CG 3.18Å; V35-L39 PolarHBondContact O-N 3.45Å; G36-L39 PolarHBondContact O-N 3.28Å; L39-Q42 PolarHBondContact O-N 3.46Å; L39-R43 WeakPolarHBondContact O-CB 3.38Å; L39-R43 WeakPolarHBondContact O-CG 3.36Å; L39-R43 PolarHBondContact O-N 3.22Å
40	L	91	Very high	87.8	Confident	101 Å²	101	113.8 Å²	113.8	53%	0.529	55%	0.55	S	S	.	.	H	α-helix	trans	-63.5	-43	175.9	-93.1	75.1	0	0	0	111.5	G36 R43 R44	G36-L40 WeakPolarHBondContact O-CB 3.43Å; G36-L40 WeakPolarHBondContact O-CD1 3.35Å; G36-L40 PolarHBondContact O-N 2.88Å; L40-R43 PolarHBondContact O-N 3.18Å; L40-R44 WeakPolarHBondContact O-CB 3.38Å; L40-R44 VanDerWaalsContact O-CG 3.29Å; L40-R44 WeakPolarHBondContact O-CG 3.43Å; L40-R44 PolarHBondContact O-N 3.36Å
41	R	89.3	Confident	87.6	Confident	157 Å²	157	110 Å²	110	59%	0.592	53%	0.532	S	S	*	.	H	α-helix	trans	-63.3	-44.2	176.7	-76.4	174.9	-172.9	-110.8	4.1	111.5	Q37 R38 R44 R45	Q37-R41 VanDerWaalsContact O-CB 3.31Å; Q37-R41 WeakPolarHBondContact O-CB 3.21Å; Q37-R41 WeakPolarHBondContact O-CG 3.37Å; Q37-R41 PolarHBondContact O-N 3.23Å; R38-R41 PolarHBondContact O-N 3.38Å; R41-R44 PolarHBondContact O-N 2.98Å; R41-R45 WeakPolarHBondContact O-CB 3.35Å; R41-R45 WeakPolarHBondContact O-CG 3.48Å; R41-R45 PolarHBondContact O-N 2.76Å
42	Q	82.2	Confident	87.5	Confident	113 Å²	113	111 Å²	111	53%	0.528	53%	0.534	S	S	.	.	H	α-helix	trans	-60.7	-48.9	176.1	-78	177	-21.1	0	0	111.4	R38 L39 R44 R45 Q46	R38-Q42 WeakPolarHBondContact O-CB 3.46Å; R38-Q42 WeakPolarHBondContact O-CG 3.36Å; R38-Q42 PolarHBondContact O-N 3.17Å; L39-Q42 PolarHBondContact O-N 3.46Å; Q42-R44 PolarHBondContact O-N 3.17Å; Q42-R45 PolarHBondContact O-N 2.79Å; Q42-Q46 WeakPolarHBondContact O-CG 3.5Å; Q42-Q46 PolarHBondContact O-N 2.78Å
43	R	80.6	Confident	87.4	Confident	183 Å²	183	108 Å²	108	69%	0.691	52%	0.521	S	S	*	.	H	α-helix	trans	-58.7	-45.5	175.9	-78	-165.8	174.2	-137.8	1.8	112.2	L39 L40 R45 Q46 L47	L39-R43 WeakPolarHBondContact O-CB 3.38Å; L39-R43 WeakPolarHBondContact O-CG 3.36Å; L39-R43 PolarHBondContact O-N 3.22Å; L40-R43 PolarHBondContact O-N 3.18Å; R43-R45 VanDerWaalsContact C-N 3.33Å; R43-R45 PolarHBondContact O-N 3.34Å; R43-Q46 PolarHBondContact O-N 3.28Å; R43-L47 WeakPolarHBondContact O-CB 3.35Å; R43-L47 WeakPolarHBondContact O-CD1 3.39Å; R43-L47 WeakPolarHBondContact O-CG 3.47Å; R43-L47 PolarHBondContact O-N 3.11Å
44	R	79.7	Confident	87.3	Confident	161 Å²	161	105.9 Å²	105.9	61%	0.608	51%	0.51	S	S	*	.	H	α-helix	trans	-61.7	-39.7	177.3	-76.2	178.6	-179.2	-168.7	1.5	112.3	L40 R41 Q42 L47 R48	L40-R44 WeakPolarHBondContact O-CB 3.38Å; L40-R44 VanDerWaalsContact O-CG 3.29Å; L40-R44 WeakPolarHBondContact O-CG 3.43Å; L40-R44 PolarHBondContact O-N 3.36Å; R41-R44 PolarHBondContact O-N 2.98Å; Q42-R44 PolarHBondContact O-N 3.17Å; R44-L47 PolarHBondContact O-N 3.27Å; R44-R48 WeakPolarHBondContact O-CB 3.5Å; R44-R48 VanDerWaalsContact O-CG 3.29Å; R44-R48 WeakPolarHBondContact O-CG 3.37Å; R44-R48 PolarHBondContact O-N 2.68Å
45	R	77.8	Confident	87.1	Confident	177 Å²	177	109.1 Å²	109.1	67%	0.668	52%	0.523	S	S	*	.	H	α-helix	trans	-64.5	-47.3	175.9	-75.4	176.4	179.4	-174.4	-1.2	111.2	R41 Q42 R43 L47 R48 S49	R41-R45 WeakPolarHBondContact O-CB 3.35Å; R41-R45 WeakPolarHBondContact O-CG 3.48Å; R41-R45 PolarHBondContact O-N 2.76Å; Q42-R45 PolarHBondContact O-N 2.79Å; R43-R45 VanDerWaalsContact C-N 3.33Å; R43-R45 PolarHBondContact O-N 3.34Å; R45-L47 VanDerWaalsContact C-N 3.32Å; R45-L47 PolarHBondContact O-N 3.35Å; R45-R48 PolarHBondContact O-N 3.03Å; R45-R48 VanDerWaalsContact O-N 3.16Å; R45-S49 PolarHBondContact O-N 3.47Å; R45-S49 PolarHBondContact O-OG 3.37Å
46	Q	74.4	Confident	87	Confident	135 Å²	135	106.2 Å²	106.2	63%	0.631	51%	0.507	S	S	*	.	H	α-helix	trans	-58	-45	175.5	-72.6	173.5	-17.7	0	0	111.6	Q42 R43 R48 S49 A50	Q42-Q46 WeakPolarHBondContact O-CG 3.5Å; Q42-Q46 PolarHBondContact O-N 2.78Å; R43-Q46 PolarHBondContact O-N 3.28Å; Q46-R48 VanDerWaalsContact C-N 3.34Å; Q46-R48 PolarHBondContact O-N 2.96Å; Q46-S49 PolarHBondContact O-N 3.31Å; Q46-A50 WeakPolarHBondContact O-CB 3.34Å; Q46-A50 PolarHBondContact O-N 2.93Å
47	L	72.9	Confident	86.9	Confident	134 Å²	134	112.7 Å²	112.7	70%	0.702	52%	0.524	S	S	*	.	H	α-helix	trans	-64.3	-34	176.7	-81.4	153.6	0	0	0	113.5	R43 R44 R45	R43-L47 WeakPolarHBondContact O-CB 3.35Å; R43-L47 WeakPolarHBondContact O-CD1 3.39Å; R43-L47 WeakPolarHBondContact O-CG 3.47Å; R43-L47 PolarHBondContact O-N 3.11Å; R44-L47 PolarHBondContact O-N 3.27Å; R45-L47 VanDerWaalsContact C-N 3.32Å; R45-L47 PolarHBondContact O-N 3.35Å
48	R	74.5	Confident	86.6	Confident	216 Å²	216	113.5 Å²	113.5	82%	0.815	54%	0.537	S	S	*	.	H	α-helix	trans	-74.9	-30.7	177.9	-77.5	179.8	-177.7	-153.6	-0.7	113.1	R44 R45 Q46	R44-R48 WeakPolarHBondContact O-CB 3.5Å; R44-R48 VanDerWaalsContact O-CG 3.29Å; R44-R48 WeakPolarHBondContact O-CG 3.37Å; R44-R48 PolarHBondContact O-N 2.68Å; R45-R48 PolarHBondContact O-N 3.03Å; R45-R48 VanDerWaalsContact O-N 3.16Å; Q46-R48 VanDerWaalsContact C-N 3.34Å; Q46-R48 PolarHBondContact O-N 2.96Å
49	S	80.1	Confident	86.6	Confident	108 Å²	108	113.3 Å²	113.3	76%	0.755	55%	0.547	S	S	*	.	H	α-helix	trans	-98.3	-12.2	-177.9	-60.5	0	0	0	0	113.3	R45 Q46	R45-S49 PolarHBondContact O-N 3.47Å; R45-S49 PolarHBondContact O-OG 3.37Å; Q46-S49 PolarHBondContact O-N 3.31Å
50	A	86.4	Confident	86.7	Confident	40 Å²	40	112.9 Å²	112.9	33%	0.331	55%	0.545	S	S	.	.	S	Bend	trans	-75	143.1	175.9	0	0	0	0	0	110.5	Q46	Q46-A50 WeakPolarHBondContact O-CB 3.34Å; Q46-A50 PolarHBondContact O-N 2.93Å
51	P	92.8	Very high	86.8	Confident	37 Å²	37	108.1 Å²	108.1	24%	0.24	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-55.8	151.9	167.3	-22.7	33.4	0	0	0	111.4	V84 Q86 V95	P51-V84 HydrophobicContact CB-CG1 4.21Å; P51-V84 HydrophobicContact CG-CG1 4.15Å; P51-Q86 HydrophobicContact CB-CB 4.17Å; P51-Q86 HydrophobicContact CG-CB 4.46Å; P51-V95 HydrophobicContact CG-CG1 4.26Å; P51-V95 HydrophobicContact CG-CG2 4.2Å
52	P	94.1	Very high	87.1	Confident	72 Å²	72	101 Å²	101	47%	0.468	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-60.6	161.3	172.8	29.7	-36.8	0	0	0	110.8	Y81 F85 Q86	P52-Y81 HydrophobicContact CB-CD1 4.25Å; P52-Y81 WeakPolarHBondContact CG-O 3.43Å; P52-F85 CarbonylContact O-C 3.53Å; P52-F85 WeakPolarHBondContact O-CA 3.43Å; P52-F85 WeakPolarHBondContact O-CB 3.29Å; P52-Q86 PolarHBondContact O-N 2.86Å
53	G	94.6	Very high	87.7	Confident	31 Å²	31	97.7 Å²	97.7	32%	0.32	49%	0.485	S	S	.	.			trans	-177.2	167.8	179.4	0	0	0	0	0	114.8	Y81 Q86	G53-Y81 VanDerWaalsContact C-CE1 3.5Å; G53-Y81 WeakPolarHBondContact O-CE1 3.46Å; G53-Q86 WeakPolarHBondContact CA-O 3.37Å
54	P	94.5	Very high	88.2	Confident	28 Å²	28	92.8 Å²	92.8	18%	0.182	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-66.7	155	174.1	29.6	-35.5	0	0	0	111.8	A56 L77 Y81 Q86 I87	P54-A56 PolarHBondContact O-N 3.19Å; P54-L77 HydrophobicContact CB-CD2 4.32Å; P54-L77 HydrophobicContact CG-CD1 4.47Å; P54-L77 HydrophobicContact CG-CD2 4.07Å; P54-Y81 WeakPolarHBondContact CA-OH 3.42Å; P54-Y81 HydrophobicContact CB-CE2 4.17Å; P54-Y81 HydrophobicContact CG-CE2 4.48Å; P54-Q86 WeakPolarHBondContact CD-O 3.39Å; P54-I87 HydrophobicContact CG-CG2 4.09Å
55	F	93.1	Very high	88.7	Confident	156 Å²	156	88.5 Å²	88.5	68%	0.684	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-58.7	130.3	171	177.5	-98.9	0	0	0	110.7	W57 N62	F55-W57 HydrophobicContact CE1-CD2 4.48Å; F55-N62 PolarHBondContact O-ND2 2.93Å
56	A	93.5	Very high	89.4	Confident	21 Å²	21	80.7 Å²	80.7	17%	0.174	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-103.9	124.4	-179	0	0	0	0	0	110.9	P54 R88	P54-A56 PolarHBondContact O-N 3.19Å; A56-R88 HydrophobicContact CB-CB 3.71Å; A56-R88 PolarHBondContact O-NH2 3.16Å
57	W	94.2	Very high	90.1	Very high	160 Å²	160	76.5 Å²	76.5	61%	0.606	45%	0.448	S	S	*	.	B	Isolated β-bridge	trans	-63.9	143.7	177.5	-67.4	88.9	0	0	0	111.3	F55 L59 I60 G61 R88	F55-W57 HydrophobicContact CE1-CD2 4.48Å; W57-L59 VanDerWaalsContact C-N 3.29Å; W57-L59 PolarHBondContact O-N 3.12Å; W57-L59 VanDerWaalsContact O-N 3.13Å; W57-I60 HydrophobicContact CB-CG1 3.83Å; W57-I60 HydrophobicContact CG-CG1 4.44Å; W57-G61 WeakPolarHBondContact CB-O 3.44Å; W57-G61 VanDerWaalsContact CD1-O 3.3Å; W57-G61 PolarHBondContact N-O 2.83Å; W57-G61 VanDerWaalsContact O-CA 3.24Å; W57-G61 WeakPolarHBondContact O-CA 3.39Å; W57-G61 PolarHBondContact O-N 2.81Å; W57-R88 PolarHBondContact O-NH2 3.44Å
58	P	87.5	Confident	90.9	Very high	109 Å²	109	80.1 Å²	80.1	71%	0.708	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-39	-171.7	-29.5	35.4	0	0	0	115.2
59	L	92.3	Very high	91.9	Very high	150 Å²	150	71.7 Å²	71.7	79%	0.785	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-49.5	-175.1	-174.3	60.6	0	0	0	113.9	W57 G90	W57-L59 VanDerWaalsContact C-N 3.29Å; W57-L59 PolarHBondContact O-N 3.12Å; W57-L59 VanDerWaalsContact O-N 3.13Å; L59-G90 CarbonylContact O-C 3.51Å; L59-G90 VanDerWaalsContact O-CA 3.23Å; L59-G90 WeakPolarHBondContact O-CA 3.31Å
60	I	94.4	Very high	92.6	Very high	82 Å²	82	68 Å²	68	42%	0.421	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-10.6	-174.4	61	171.6	0	0	0	113.6	W57 N62 A63 A64 G90	W57-I60 HydrophobicContact CB-CG1 3.83Å; W57-I60 HydrophobicContact CG-CG1 4.44Å; I60-N62 PolarHBondContact O-N 2.83Å; I60-A63 WeakPolarHBondContact O-CB 3.43Å; I60-A63 PolarHBondContact O-N 3.36Å; I60-A64 HydrophobicContact CD1-CB 4.08Å; I60-G90 PolarHBondContact O-N 2.84Å
61	G	94.6	Very high	93	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	43%	0.428	C	S	.	.	B	Isolated β-bridge	trans	63.6	-124	-172.5	0	0	0	0	0	111.9	W57 R88	W57-G61 WeakPolarHBondContact CB-O 3.44Å; W57-G61 VanDerWaalsContact CD1-O 3.3Å; W57-G61 PolarHBondContact N-O 2.83Å; W57-G61 VanDerWaalsContact O-CA 3.24Å; W57-G61 WeakPolarHBondContact O-CA 3.39Å; W57-G61 PolarHBondContact O-N 2.81Å; G61-R88 CarbonylContact C-O 3.49Å; G61-R88 WeakPolarHBondContact CA-O 3.33Å
62	N	95.6	Very high	93.2	Very high	7 Å²	7	75.6 Å²	75.6	4%	0.037	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	7	179.1	-57.6	111.8	0	0	0	112.5	F55 I60 A64 A65 V66 I87 R88	F55-N62 PolarHBondContact O-ND2 2.93Å; I60-N62 PolarHBondContact O-N 2.83Å; N62-A64 VanDerWaalsContact C-N 3.28Å; N62-A64 PolarHBondContact O-N 2.84Å; N62-A65 WeakPolarHBondContact O-CA 3.39Å; N62-A65 WeakPolarHBondContact O-CB 3.45Å; N62-A65 PolarHBondContact O-N 2.82Å; N62-V66 PolarHBondContact O-N 2.86Å; N62-V66 VanDerWaalsContact O-N 3.11Å; N62-I87 HydrophobicContact CB-CB 4.3Å; N62-I87 WeakPolarHBondContact OD1-CA 3.44Å; N62-R88 PolarHBondContact N-O 2.85Å; N62-R88 PolarHBondContact OD1-N 3.3Å
63	A	93.4	Very high	93.3	Very high	45 Å²	45	72.6 Å²	72.6	37%	0.372	42%	0.422	S	S	.	.	H	α-helix	trans	-52.5	-43.5	-173.4	0	0	0	0	0	113.1	I60 A65 V66 G67 L89	I60-A63 WeakPolarHBondContact O-CB 3.43Å; I60-A63 PolarHBondContact O-N 3.36Å; A63-A65 VanDerWaalsContact C-N 3.3Å; A63-A65 PolarHBondContact O-N 3.12Å; A63-V66 PolarHBondContact O-N 3.39Å; A63-G67 PolarHBondContact O-N 2.9Å; A63-L89 HydrophobicContact CB-CD2 4.07Å
64	A	91.3	Very high	93.4	Very high	80 Å²	80	73.3 Å²	73.3	66%	0.661	42%	0.417	S	S	*	.	H	α-helix	trans	-62.6	-34	177	0	0	0	0	0	113.4	I60 N62	I60-A64 HydrophobicContact CD1-CB 4.08Å; N62-A64 VanDerWaalsContact C-N 3.28Å; N62-A64 PolarHBondContact O-N 2.84Å
65	A	90.6	Very high	93.5	Very high	70 Å²	70	73.6 Å²	73.6	58%	0.579	42%	0.421	S	S	*	.	H	α-helix	trans	-78.8	-25.9	179.7	0	0	0	0	0	112.9	N62 A63	N62-A65 WeakPolarHBondContact O-CA 3.39Å; N62-A65 WeakPolarHBondContact O-CB 3.45Å; N62-A65 PolarHBondContact O-N 2.82Å; A63-A65 VanDerWaalsContact C-N 3.3Å; A63-A65 PolarHBondContact O-N 3.12Å
66	V	93.4	Very high	93.7	Very high	13 Å²	13	73.5 Å²	73.5	8%	0.079	42%	0.417	C	S	.	.	H	α-helix	trans	-70.4	-44.1	176.5	177.3	0	0	0	0	110.5	N62 A63 A70 S73 F74 I87 L89	N62-V66 PolarHBondContact O-N 2.86Å; N62-V66 VanDerWaalsContact O-N 3.11Å; A63-V66 PolarHBondContact O-N 3.39Å; V66-A70 HydrophobicContact CG1-CB 3.43Å; V66-A70 VanDerWaalsContact CG1-CB 3.43Å; V66-S73 WeakPolarHBondContact O-CB 3.24Å; V66-S73 PolarHBondContact O-OG 3.32Å; V66-F74 HydrophobicContact CB-CE1 4.47Å; V66-F74 HydrophobicContact CG1-CE1 3.89Å; V66-F74 HydrophobicContact CG1-CZ 3.92Å; V66-F74 HydrophobicContact CG2-CE1 3.74Å; V66-F74 HydrophobicContact CG2-CZ 4.36Å; V66-I87 HydrophobicContact CG2-CD1 4.22Å; V66-L89 HydrophobicContact CG2-CD2 4.19Å
67	G	88.8	Confident	93.8	Very high	48 Å²	48	74.1 Å²	74.1	50%	0.495	42%	0.417	S	S	.	.			trans	63.8	-163.1	178.1	0	0	0	0	0	113.5	A63	A63-G67 PolarHBondContact O-N 2.9Å
68	Q	90.3	Very high	93.9	Very high	210 Å²	210	67 Å²	67	98%	0.981	39%	0.392	S	S	*	.	S	Bend	trans	-72	-36.1	-178	-69.5	-179.8	-31.2	0	0	113	A70	Q68-A70 PolarHBondContact O-N 3Å
69	A	94.8	Very high	94.4	Very high	38 Å²	38	72 Å²	72	31%	0.314	40%	0.397	S	S	.	.			trans	-97.7	69	-179.3	0	0	0	0	0	111.4	H71 L72 S73	A69-H71 VanDerWaalsContact C-N 3.29Å; A69-H71 PolarHBondContact O-N 3.13Å; A69-L72 HydrophobicContact CB-CB 4.34Å; A69-L72 HydrophobicContact CB-CD1 3.95Å; A69-L72 HydrophobicContact CB-CG 4.2Å; A69-L72 PolarHBondContact O-N 2.95Å; A69-L72 VanDerWaalsContact O-N 3.13Å; A69-S73 PolarHBondContact O-N 3.34Å
70	A	94.4	Very high	94.6	Very high	32 Å²	32	74.2 Å²	74.2	26%	0.264	40%	0.395	S	S	.	.	H	α-helix	trans	-54.4	-42.2	-173.5	0	0	0	0	0	113.6	V66 Q68 L72 S73 F74	V66-A70 HydrophobicContact CG1-CB 3.43Å; V66-A70 VanDerWaalsContact CG1-CB 3.43Å; Q68-A70 PolarHBondContact O-N 3Å; A70-L72 VanDerWaalsContact C-N 3.35Å; A70-L72 PolarHBondContact O-N 2.77Å; A70-S73 WeakPolarHBondContact O-CB 3.38Å; A70-S73 PolarHBondContact O-N 2.89Å; A70-S73 VanDerWaalsContact O-N 3.16Å; A70-F74 HydrophobicContact CB-CE2 3.95Å; A70-F74 HydrophobicContact CB-CZ 4.07Å; A70-F74 WeakPolarHBondContact O-CD2 3.16Å; A70-F74 WeakPolarHBondContact O-CG 3.22Å; A70-F74 PolarHBondContact O-N 3.44Å
71	H	95.4	Very high	94.6	Very high	135 Å²	135	73.1 Å²	73.1	63%	0.625	39%	0.386	S	S	*	.	H	α-helix	trans	-60.6	-39.1	-179.9	61.7	-82.2	0	0	0	112.9	A69 F74 A75	A69-H71 VanDerWaalsContact C-N 3.29Å; A69-H71 PolarHBondContact O-N 3.13Å; H71-F74 PolarHBondContact O-N 3.46Å; H71-A75 WeakPolarHBondContact O-CB 3.15Å; H71-A75 PolarHBondContact O-N 3.36Å
72	L	96.6	Very high	94.7	Very high	101 Å²	101	74.6 Å²	74.6	53%	0.529	40%	0.401	S	S	.	.	H	α-helix	trans	-69.1	-39.6	175.3	-61.6	-178.5	0	0	0	111.6	A69 A70 A75 R76	A69-L72 HydrophobicContact CB-CB 4.34Å; A69-L72 HydrophobicContact CB-CD1 3.95Å; A69-L72 HydrophobicContact CB-CG 4.2Å; A69-L72 PolarHBondContact O-N 2.95Å; A69-L72 VanDerWaalsContact O-N 3.13Å; A70-L72 VanDerWaalsContact C-N 3.35Å; A70-L72 PolarHBondContact O-N 2.77Å; L72-A75 PolarHBondContact O-N 3.33Å; L72-R76 WeakPolarHBondContact O-CG 3.47Å; L72-R76 PolarHBondContact O-N 2.85Å
73	S	96.4	Very high	94.8	Very high	8 Å²	8	78.1 Å²	78.1	6%	0.056	42%	0.42	C	S	.	.	H	α-helix	trans	-64.5	-41.4	175.9	-63.2	0	0	0	0	111.6	V66 A69 A70 R76 L77	V66-S73 WeakPolarHBondContact O-CB 3.24Å; V66-S73 PolarHBondContact O-OG 3.32Å; A69-S73 PolarHBondContact O-N 3.34Å; A70-S73 WeakPolarHBondContact O-CB 3.38Å; A70-S73 PolarHBondContact O-N 2.89Å; A70-S73 VanDerWaalsContact O-N 3.16Å; S73-R76 PolarHBondContact O-N 3.16Å; S73-R76 PolarHBondContact OG-NH2 3.41Å; S73-L77 WeakPolarHBondContact O-CG 3.24Å; S73-L77 PolarHBondContact O-N 3.47Å
74	F	96.8	Very high	94.9	Very high	47 Å²	47	78.7 Å²	78.7	21%	0.206	42%	0.419	C	S	.	.	H	α-helix	trans	-67.3	-39.3	175.5	-60.9	-22.6	0	0	0	112.7	V66 A70 H71 R76 L77 A78 F85 I87 V96 N98	V66-F74 HydrophobicContact CB-CE1 4.47Å; V66-F74 HydrophobicContact CG1-CE1 3.89Å; V66-F74 HydrophobicContact CG1-CZ 3.92Å; V66-F74 HydrophobicContact CG2-CE1 3.74Å; V66-F74 HydrophobicContact CG2-CZ 4.36Å; A70-F74 HydrophobicContact CB-CE2 3.95Å; A70-F74 HydrophobicContact CB-CZ 4.07Å; A70-F74 WeakPolarHBondContact O-CD2 3.16Å; A70-F74 WeakPolarHBondContact O-CG 3.22Å; A70-F74 PolarHBondContact O-N 3.44Å; H71-F74 PolarHBondContact O-N 3.46Å; F74-R76 VanDerWaalsContact C-N 3.32Å; F74-R76 PolarHBondContact O-N 2.92Å; F74-L77 HydrophobicContact CD1-CD1 4.45Å; F74-L77 PolarHBondContact O-N 3.42Å; F74-A78 WeakPolarHBondContact O-CB 3.32Å; F74-A78 PolarHBondContact O-N 2.93Å; F74-F85 HydrophobicContact CB-CZ 4.22Å; F74-I87 HydrophobicContact CD1-CD1 4.39Å; F74-I87 HydrophobicContact CE1-CD1 3.43Å; F74-I87 VanDerWaalsContact CE1-CD1 3.43Å; F74-I87 HydrophobicContact CZ-CD1 3.82Å; F74-V96 HydrophobicContact CB-CG1 4.17Å; F74-V96 HydrophobicContact CD1-CG2 4.49Å; F74-V96 HydrophobicContact CD2-CG1 4.35Å; F74-V96 HydrophobicContact CG-CG1 4.18Å; F74-N98 PolarHBondContact O-ND2 3.2Å; F74-N98 VanDerWaalsContact O-ND2 3.17Å
75	A	96.6	Very high	95.2	Very high	33 Å²	33	74.9 Å²	74.9	27%	0.273	39%	0.388	S	S	.	.	H	α-helix	trans	-60.3	-41	172.5	0	0	0	0	0	112.1	H71 L72 R79 N98	H71-A75 WeakPolarHBondContact O-CB 3.15Å; H71-A75 PolarHBondContact O-N 3.36Å; L72-A75 PolarHBondContact O-N 3.33Å; A75-R79 PolarHBondContact O-N 3.43Å; A75-N98 WeakPolarHBondContact CA-ND2 3.34Å; A75-N98 PolarHBondContact N-ND2 3.02Å
76	R	96.3	Very high	95.5	Very high	155 Å²	155	74.4 Å²	74.4	59%	0.585	37%	0.373	S	S	*	.	H	α-helix	trans	-66	-41.3	174.9	-72.9	-177.8	-66.8	159	0.3	112.5	L72 S73 F74 R79	L72-R76 WeakPolarHBondContact O-CG 3.47Å; L72-R76 PolarHBondContact O-N 2.85Å; S73-R76 PolarHBondContact O-N 3.16Å; S73-R76 PolarHBondContact OG-NH2 3.41Å; F74-R76 VanDerWaalsContact C-N 3.32Å; F74-R76 PolarHBondContact O-N 2.92Å; R76-R79 PolarHBondContact O-N 2.97Å
77	L	96.4	Very high	95.6	Very high	34 Å²	34	74 Å²	74	18%	0.178	37%	0.37	C	S	.	.	H	α-helix	trans	-66.5	-38.8	177.3	-73.8	169.3	0	0	0	112	P54 S73 F74 R79 R80 Y81 F85 I87	P54-L77 HydrophobicContact CB-CD2 4.32Å; P54-L77 HydrophobicContact CG-CD1 4.47Å; P54-L77 HydrophobicContact CG-CD2 4.07Å; S73-L77 WeakPolarHBondContact O-CG 3.24Å; S73-L77 PolarHBondContact O-N 3.47Å; F74-L77 HydrophobicContact CD1-CD1 4.45Å; F74-L77 PolarHBondContact O-N 3.42Å; L77-R79 VanDerWaalsContact C-N 3.3Å; L77-R79 PolarHBondContact O-N 2.92Å; L77-R80 WeakPolarHBondContact O-CA 3.23Å; L77-R80 PolarHBondContact O-N 2.86Å; L77-Y81 HydrophobicContact CB-CD2 4.3Å; L77-Y81 HydrophobicContact CD2-CD2 3.89Å; L77-Y81 HydrophobicContact CD2-CE2 3.58Å; L77-Y81 WeakPolarHBondContact O-CD2 3.39Å; L77-Y81 PolarHBondContact O-N 2.9Å; L77-F85 HydrophobicContact CB-CD2 4.28Å; L77-F85 HydrophobicContact CB-CE1 4.34Å; L77-F85 HydrophobicContact CB-CE2 3.62Å; L77-F85 HydrophobicContact CB-CZ 3.65Å; L77-F85 HydrophobicContact CD1-CE2 3.84Å; L77-F85 HydrophobicContact CD1-CZ 4.41Å; L77-F85 HydrophobicContact CG-CE2 4.36Å; L77-I87 HydrophobicContact CD1-CG2 4.15Å
78	A	96.9	Very high	95.9	Very high	11 Å²	11	75.2 Å²	75.2	9%	0.091	36%	0.36	C	S	.	.	H	α-helix	trans	-59.8	-39.1	177.5	0	0	0	0	0	112.5	F74 R80 G82 F85 N98	F74-A78 WeakPolarHBondContact O-CB 3.32Å; F74-A78 PolarHBondContact O-N 2.93Å; A78-R80 PolarHBondContact O-N 3.4Å; A78-R80 VanDerWaalsContact O-N 3.12Å; A78-G82 WeakPolarHBondContact CA-O 3.39Å; A78-G82 CarbonylContact O-C 3.57Å; A78-G82 VanDerWaalsContact O-CA 3.24Å; A78-G82 WeakPolarHBondContact O-CA 3.47Å; A78-G82 PolarHBondContact O-N 2.86Å; A78-F85 HydrophobicContact CB-CE1 3.99Å; A78-N98 HydrophobicContact CB-CB 3.58Å; A78-N98 VanDerWaalsContact CB-ND2 3.35Å; A78-N98 WeakPolarHBondContact CB-ND2 3.48Å
79	R	96.7	Very high	96	Very high	213 Å²	213	68.4 Å²	68.4	80%	0.804	33%	0.33	S	S	*	.	H	α-helix	trans	-59.8	-23.9	173.5	-65.7	176.6	-168.6	164.4	2.4	113.4	A75 R76 L77	A75-R79 PolarHBondContact O-N 3.43Å; R76-R79 PolarHBondContact O-N 2.97Å; L77-R79 VanDerWaalsContact C-N 3.3Å; L77-R79 PolarHBondContact O-N 2.92Å
80	R	96.1	Very high	95.8	Very high	196 Å²	196	67.7 Å²	67.7	74%	0.74	33%	0.326	S	S	*	.	H	α-helix	trans	-99.5	-37.7	-177.9	-173.5	173.5	-173.6	174.8	2.9	113.5	L77 A78	L77-R80 WeakPolarHBondContact O-CA 3.23Å; L77-R80 PolarHBondContact O-N 2.86Å; A78-R80 PolarHBondContact O-N 3.4Å; A78-R80 VanDerWaalsContact O-N 3.12Å
81	Y	95.9	Very high	95.5	Very high	59 Å²	59	71.4 Å²	71.4	23%	0.231	35%	0.35	C	S	.	.	H	α-helix	trans	-110.7	-5.6	-171.8	-63.1	-73.8	0	0	0	113.6	P52 G53 P54 L77	P52-Y81 HydrophobicContact CB-CD1 4.25Å; P52-Y81 WeakPolarHBondContact CG-O 3.43Å; G53-Y81 VanDerWaalsContact C-CE1 3.5Å; G53-Y81 WeakPolarHBondContact O-CE1 3.46Å; P54-Y81 WeakPolarHBondContact CA-OH 3.42Å; P54-Y81 HydrophobicContact CB-CE2 4.17Å; P54-Y81 HydrophobicContact CG-CE2 4.48Å; L77-Y81 HydrophobicContact CB-CD2 4.3Å; L77-Y81 HydrophobicContact CD2-CD2 3.89Å; L77-Y81 HydrophobicContact CD2-CE2 3.58Å; L77-Y81 WeakPolarHBondContact O-CD2 3.39Å; L77-Y81 PolarHBondContact O-N 2.9Å
82	G	96.5	Very high	95.3	Very high	32 Å²	32	67.7 Å²	67.7	33%	0.33	34%	0.339	S	S	.	.			trans	90.2	-177.9	-176.9	0	0	0	0	0	113.5	A78 V84 F85	A78-G82 WeakPolarHBondContact CA-O 3.39Å; A78-G82 CarbonylContact O-C 3.57Å; A78-G82 VanDerWaalsContact O-CA 3.24Å; A78-G82 WeakPolarHBondContact O-CA 3.47Å; A78-G82 PolarHBondContact O-N 2.86Å; G82-V84 PolarHBondContact O-N 3.38Å; G82-F85 WeakPolarHBondContact O-CD1 3.45Å
83	D	96.7	Very high	95.1	Very high	81 Å²	81	66.8 Å²	66.8	43%	0.433	34%	0.339	S	S	.	.	S	Bend	trans	-68.5	-15.9	-173.6	-61.6	-5.6	0	0	0	113.8	L97 N98 A102	D83-L97 CarbonylContact O-C 3.46Å; D83-L97 WeakPolarHBondContact O-CA 3.39Å; D83-N98 PolarHBondContact O-N 3.24Å; D83-A102 HydrophobicContact CB-CB 4.14Å
84	V	97	Very high	95	Very high	57 Å²	57	68.5 Å²	68.5	35%	0.345	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	112.2	177.7	-175.3	0	0	0	0	108.8	P51 G82 V95 L97 A102	P51-V84 HydrophobicContact CB-CG1 4.21Å; P51-V84 HydrophobicContact CG-CG1 4.15Å; G82-V84 PolarHBondContact O-N 3.38Å; V84-V95 HydrophobicContact CG1-CG1 4Å; V84-L97 HydrophobicContact CB-CD2 4.39Å; V84-L97 HydrophobicContact CG1-CD2 3.99Å; V84-L97 HydrophobicContact CG2-CD2 3.83Å; V84-A102 HydrophobicContact CG2-CB 3.68Å
85	F	96.4	Very high	94.9	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	162.6	-180	67	-86	0	0	0	111.3	P52 F74 L77 A78 G82 I87 V95 V96 N98	P52-F85 CarbonylContact O-C 3.53Å; P52-F85 WeakPolarHBondContact O-CA 3.43Å; P52-F85 WeakPolarHBondContact O-CB 3.29Å; F74-F85 HydrophobicContact CB-CZ 4.22Å; L77-F85 HydrophobicContact CB-CD2 4.28Å; L77-F85 HydrophobicContact CB-CE1 4.34Å; L77-F85 HydrophobicContact CB-CE2 3.62Å; L77-F85 HydrophobicContact CB-CZ 3.65Å; L77-F85 HydrophobicContact CD1-CE2 3.84Å; L77-F85 HydrophobicContact CD1-CZ 4.41Å; L77-F85 HydrophobicContact CG-CE2 4.36Å; A78-F85 HydrophobicContact CB-CE1 3.99Å; G82-F85 WeakPolarHBondContact O-CD1 3.45Å; F85-I87 HydrophobicContact CD2-CG2 3.97Å; F85-I87 HydrophobicContact CE2-CG2 3.76Å; F85-V95 WeakPolarHBondContact O-CA 3.27Å; F85-V96 HydrophobicContact CD1-CB 4.22Å; F85-V96 HydrophobicContact CD2-CB 4.24Å; F85-V96 HydrophobicContact CD2-CG2 4.48Å; F85-V96 HydrophobicContact CE1-CB 3.75Å; F85-V96 HydrophobicContact CE1-CG1 3.66Å; F85-V96 HydrophobicContact CE2-CB 3.77Å; F85-V96 HydrophobicContact CE2-CG1 4.21Å; F85-V96 HydrophobicContact CE2-CG2 3.87Å; F85-V96 HydrophobicContact CG-CB 4.45Å; F85-V96 HydrophobicContact CZ-CB 3.51Å; F85-V96 HydrophobicContact CZ-CG1 3.47Å; F85-V96 VanDerWaalsContact CZ-CG1 3.47Å; F85-V96 HydrophobicContact CZ-CG2 3.99Å; F85-V96 PolarHBondContact N-O 3.35Å; F85-V96 VanDerWaalsContact N-O 3.17Å; F85-V96 PolarHBondContact O-N 3.02Å; F85-N98 HydrophobicContact CE1-CB 4.33Å
86	Q	95.9	Very high	95	Very high	60 Å²	60	69 Å²	69	28%	0.28	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	137.9	-179.2	-170.5	-178	-58.6	0	0	110.9	P51 P52 G53 P54 I94 V95	P51-Q86 HydrophobicContact CB-CB 4.17Å; P51-Q86 HydrophobicContact CG-CB 4.46Å; P52-Q86 PolarHBondContact O-N 2.86Å; G53-Q86 WeakPolarHBondContact CA-O 3.37Å; P54-Q86 WeakPolarHBondContact CD-O 3.39Å; Q86-I94 CarbonylContact C-O 3.11Å; Q86-I94 WeakPolarHBondContact CA-O 3.29Å; Q86-I94 WeakPolarHBondContact CG-O 3.39Å; Q86-V95 HydrophobicContact CG-CG2 4.48Å
87	I	95.9	Very high	95	Very high	3 Å²	3	64 Å²	64	2%	0.015	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	171.9	167.1	66.5	177.4	0	0	0	109.4	P54 N62 V66 F74 L77 F85 I94 V96	P54-I87 HydrophobicContact CG-CG2 4.09Å; N62-I87 HydrophobicContact CB-CB 4.3Å; N62-I87 WeakPolarHBondContact OD1-CA 3.44Å; V66-I87 HydrophobicContact CG2-CD1 4.22Å; F74-I87 HydrophobicContact CD1-CD1 4.39Å; F74-I87 HydrophobicContact CE1-CD1 3.43Å; F74-I87 VanDerWaalsContact CE1-CD1 3.43Å; F74-I87 HydrophobicContact CZ-CD1 3.82Å; L77-I87 HydrophobicContact CD1-CG2 4.15Å; F85-I87 HydrophobicContact CD2-CG2 3.97Å; F85-I87 HydrophobicContact CE2-CG2 3.76Å; I87-I94 HydrophobicContact CG1-CB 3.91Å; I87-I94 HydrophobicContact CG1-CG2 4.4Å; I87-I94 PolarHBondContact N-O 2.86Å; I87-I94 PolarHBondContact O-N 3.3Å; I87-V96 HydrophobicContact CD1-CG2 4.12Å; I87-V96 HydrophobicContact CG1-CG2 4.23Å
88	R	94.9	Very high	94.9	Very high	75 Å²	75	65 Å²	65	28%	0.283	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	130.9	170	-157	169.9	67.6	-158.6	-4.4	109.7	A56 W57 G61 N62 G90 C92	A56-R88 HydrophobicContact CB-CB 3.71Å; A56-R88 PolarHBondContact O-NH2 3.16Å; W57-R88 PolarHBondContact O-NH2 3.44Å; G61-R88 CarbonylContact C-O 3.49Å; G61-R88 WeakPolarHBondContact CA-O 3.33Å; N62-R88 PolarHBondContact N-O 2.85Å; N62-R88 PolarHBondContact OD1-N 3.3Å; R88-G90 WeakPolarHBondContact CG-O 3.5Å; R88-G90 PolarHBondContact NE-O 2.93Å; R88-G90 VanDerWaalsContact NE-O 3.12Å; R88-C92 CarbonylContact C-O 3.52Å; R88-C92 VanDerWaalsContact CA-O 3.31Å; R88-C92 WeakPolarHBondContact CA-O 3.49Å; R88-C92 WeakPolarHBondContact CG-O 3.49Å
89	L	92.8	Very high	94.8	Very high	67 Å²	67	65.1 Å²	65.1	35%	0.351	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	109.7	167.6	-65.8	-175.4	0	0	0	108	A63 V66 S91 C92 I94	A63-L89 HydrophobicContact CB-CD2 4.07Å; V66-L89 HydrophobicContact CG2-CD2 4.19Å; L89-S91 PolarHBondContact O-N 2.89Å; L89-C92 PolarHBondContact N-O 3.47Å; L89-C92 WeakPolarHBondContact O-CB 3.31Å; L89-C92 PolarHBondContact O-N 3.42Å; L89-I94 HydrophobicContact CB-CD1 4.09Å; L89-I94 HydrophobicContact CD1-CD1 3.46Å; L89-I94 VanDerWaalsContact CD1-CD1 3.46Å; L89-I94 HydrophobicContact CG-CD1 3.69Å
90	G	90.9	Very high	94.9	Very high	22 Å²	22	63.2 Å²	63.2	23%	0.227	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	-117.4	-167.6	0	0	0	0	0	111.5	L59 I60 R88	L59-G90 CarbonylContact O-C 3.51Å; L59-G90 VanDerWaalsContact O-CA 3.23Å; L59-G90 WeakPolarHBondContact O-CA 3.31Å; I60-G90 PolarHBondContact O-N 2.84Å; R88-G90 WeakPolarHBondContact CG-O 3.5Å; R88-G90 PolarHBondContact NE-O 2.93Å; R88-G90 VanDerWaalsContact NE-O 3.12Å
91	S	88.6	Confident	94.9	Very high	111 Å²	111	63.6 Å²	63.6	78%	0.776	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-5.4	172.2	57.2	0	0	0	0	114	L89 P93	L89-S91 PolarHBondContact O-N 2.89Å; S91-P93 WeakPolarHBondContact O-CD 3.4Å
92	C	90.8	Very high	94.9	Very high	56 Å²	56	61.7 Å²	61.7	38%	0.378	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	115.2	-174.8	-175	0	0	0	0	111.3	R88 L89	R88-C92 CarbonylContact C-O 3.52Å; R88-C92 VanDerWaalsContact CA-O 3.31Å; R88-C92 WeakPolarHBondContact CA-O 3.49Å; R88-C92 WeakPolarHBondContact CG-O 3.49Å; L89-C92 PolarHBondContact N-O 3.47Å; L89-C92 WeakPolarHBondContact O-CB 3.31Å; L89-C92 PolarHBondContact O-N 3.42Å
93	P	92.6	Very high	95	Very high	82 Å²	82	63.4 Å²	63.4	53%	0.532	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	136.8	172	31.3	-33	0	0	0	110.6	S91	S91-P93 WeakPolarHBondContact O-CD 3.4Å
94	I	94.1	Very high	95	Very high	44 Å²	44	64 Å²	64	23%	0.226	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	125.8	-179.8	-59.3	-179.7	0	0	0	108.6	Q86 I87 L89 V96	Q86-I94 CarbonylContact C-O 3.11Å; Q86-I94 WeakPolarHBondContact CA-O 3.29Å; Q86-I94 WeakPolarHBondContact CG-O 3.39Å; I87-I94 HydrophobicContact CG1-CB 3.91Å; I87-I94 HydrophobicContact CG1-CG2 4.4Å; I87-I94 PolarHBondContact N-O 2.86Å; I87-I94 PolarHBondContact O-N 3.3Å; L89-I94 HydrophobicContact CB-CD1 4.09Å; L89-I94 HydrophobicContact CD1-CD1 3.46Å; L89-I94 VanDerWaalsContact CD1-CD1 3.46Å; L89-I94 HydrophobicContact CG-CD1 3.69Å; I94-V96 HydrophobicContact CG2-CG2 4.42Å
95	V	95.9	Very high	95.1	Very high	75 Å²	75	65 Å²	65	46%	0.455	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	131.6	169.9	179.8	0	0	0	0	108.6	P51 V84 F85 Q86 L97	P51-V95 HydrophobicContact CG-CG1 4.26Å; P51-V95 HydrophobicContact CG-CG2 4.2Å; V84-V95 HydrophobicContact CG1-CG1 4Å; F85-V95 WeakPolarHBondContact O-CA 3.27Å; Q86-V95 HydrophobicContact CG-CG2 4.48Å; V95-L97 HydrophobicContact CG1-CD2 4.26Å
96	V	96.7	Very high	95.1	Very high	15 Å²	15	65.3 Å²	65.3	9%	0.091	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	130.5	178.2	-176.2	0	0	0	0	108.6	F74 F85 I87 I94	F74-V96 HydrophobicContact CB-CG1 4.17Å; F74-V96 HydrophobicContact CD1-CG2 4.49Å; F74-V96 HydrophobicContact CD2-CG1 4.35Å; F74-V96 HydrophobicContact CG-CG1 4.18Å; F85-V96 HydrophobicContact CD1-CB 4.22Å; F85-V96 HydrophobicContact CD2-CB 4.24Å; F85-V96 HydrophobicContact CD2-CG2 4.48Å; F85-V96 HydrophobicContact CE1-CB 3.75Å; F85-V96 HydrophobicContact CE1-CG1 3.66Å; F85-V96 HydrophobicContact CE2-CB 3.77Å; F85-V96 HydrophobicContact CE2-CG1 4.21Å; F85-V96 HydrophobicContact CE2-CG2 3.87Å; F85-V96 HydrophobicContact CG-CB 4.45Å; F85-V96 HydrophobicContact CZ-CB 3.51Å; F85-V96 HydrophobicContact CZ-CG1 3.47Å; F85-V96 VanDerWaalsContact CZ-CG1 3.47Å; F85-V96 HydrophobicContact CZ-CG2 3.99Å; F85-V96 PolarHBondContact N-O 3.35Å; F85-V96 VanDerWaalsContact N-O 3.17Å; F85-V96 PolarHBondContact O-N 3.02Å; I87-V96 HydrophobicContact CD1-CG2 4.12Å; I87-V96 HydrophobicContact CG1-CG2 4.23Å; I94-V96 HydrophobicContact CG2-CG2 4.42Å
97	L	97.6	Very high	95.1	Very high	51 Å²	51	67.4 Å²	67.4	27%	0.267	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.1	174.5	-53.7	179.1	0	0	0	108.7	D83 V84 V95 I103 A106	D83-L97 CarbonylContact O-C 3.46Å; D83-L97 WeakPolarHBondContact O-CA 3.39Å; V84-L97 HydrophobicContact CB-CD2 4.39Å; V84-L97 HydrophobicContact CG1-CD2 3.99Å; V84-L97 HydrophobicContact CG2-CD2 3.83Å; V95-L97 HydrophobicContact CG1-CD2 4.26Å; L97-I103 HydrophobicContact CB-CG1 3.94Å; L97-A106 HydrophobicContact CD1-CB 3.47Å; L97-A106 VanDerWaalsContact CD1-CB 3.47Å
98	N	95	Very high	95.1	Very high	54 Å²	54	71.9 Å²	71.9	29%	0.289	39%	0.385	S	S	.	.			trans	-143	54.7	-172.6	-158.7	-21.7	0	0	0	112.3	F74 A75 A78 D83 F85	F74-N98 PolarHBondContact O-ND2 3.2Å; F74-N98 VanDerWaalsContact O-ND2 3.17Å; A75-N98 WeakPolarHBondContact CA-ND2 3.34Å; A75-N98 PolarHBondContact N-ND2 3.02Å; A78-N98 HydrophobicContact CB-CB 3.58Å; A78-N98 VanDerWaalsContact CB-ND2 3.35Å; A78-N98 WeakPolarHBondContact CB-ND2 3.48Å; D83-N98 PolarHBondContact O-N 3.24Å; F85-N98 HydrophobicContact CE1-CB 4.33Å
99	G	94.7	Very high	95.2	Very high	14 Å²	14	74.5 Å²	74.5	14%	0.144	40%	0.4	C	S	.	.	S	Bend	trans	-172.9	144.6	176.8	0	0	0	0	0	110.6	R101 A102 I103	G99-R101 VanDerWaalsContact C-N 3.34Å; G99-R101 PolarHBondContact O-N 2.82Å; G99-A102 PolarHBondContact O-N 3.45Å; G99-I103 WeakPolarHBondContact O-CB 3.31Å; G99-I103 WeakPolarHBondContact O-CD1 3.12Å; G99-I103 WeakPolarHBondContact O-CG1 3.31Å; G99-I103 PolarHBondContact O-N 3.37Å
100	E	96.9	Very high	95.4	Very high	173 Å²	173	75.4 Å²	75.4	81%	0.808	40%	0.403	S	S	*	.	H	α-helix	trans	-56.2	-48.1	-173.7	-175.7	-173.5	165.2	0	0	111.8	A102 I103 H104	E100-A102 PolarHBondContact O-N 3.03Å; E100-I103 PolarHBondContact O-N 2.96Å; E100-H104 WeakPolarHBondContact O-CB 3.2Å; E100-H104 PolarHBondContact O-N 3.37Å
101	R	97.1	Very high	95.5	Very high	205 Å²	205	75.4 Å²	75.4	77%	0.774	40%	0.403	S	S	*	.	H	α-helix	trans	-61.1	-45.4	-179.5	-177.5	176.9	171.9	152.3	-0.8	112.3	G99 Q105	G99-R101 VanDerWaalsContact C-N 3.34Å; G99-R101 PolarHBondContact O-N 2.82Å; R101-Q105 VanDerWaalsContact O-CB 3.27Å; R101-Q105 WeakPolarHBondContact O-CB 3.44Å; R101-Q105 PolarHBondContact O-N 3.28Å
102	A	96.4	Very high	95.7	Very high	18 Å²	18	74.5 Å²	74.5	15%	0.149	40%	0.396	C	S	.	.	H	α-helix	trans	-66.4	-42.5	179.7	0	0	0	0	0	111.6	D83 V84 G99 E100 Q105 A106	D83-A102 HydrophobicContact CB-CB 4.14Å; V84-A102 HydrophobicContact CG2-CB 3.68Å; G99-A102 PolarHBondContact O-N 3.45Å; E100-A102 PolarHBondContact O-N 3.03Å; A102-Q105 PolarHBondContact O-N 2.82Å; A102-A106 WeakPolarHBondContact O-CB 3.25Å; A102-A106 PolarHBondContact O-N 3.2Å
103	I	97.4	Very high	95.8	Very high	69 Å²	69	75.6 Å²	75.6	35%	0.354	41%	0.409	S	S	.	.	H	α-helix	trans	-65.5	-47.1	177.8	-68.3	167.6	0	0	0	110.4	L97 G99 E100 Q105 A106 L107	L97-I103 HydrophobicContact CB-CG1 3.94Å; G99-I103 WeakPolarHBondContact O-CB 3.31Å; G99-I103 WeakPolarHBondContact O-CD1 3.12Å; G99-I103 WeakPolarHBondContact O-CG1 3.31Å; G99-I103 PolarHBondContact O-N 3.37Å; E100-I103 PolarHBondContact O-N 2.96Å; I103-Q105 VanDerWaalsContact C-N 3.35Å; I103-Q105 PolarHBondContact O-N 3.5Å; I103-A106 PolarHBondContact O-N 2.96Å; I103-L107 HydrophobicContact CG2-CD1 3.83Å; I103-L107 HydrophobicContact CG2-CG 4.31Å; I103-L107 WeakPolarHBondContact O-CB 3.27Å; I103-L107 PolarHBondContact O-N 3.48Å
104	H	98	Very high	95.9	Very high	92 Å²	92	76.3 Å²	76.3	43%	0.426	40%	0.404	S	S	.	.	H	α-helix	trans	-61.5	-43.7	177.6	-176.7	-83.4	0	0	0	111.3	E100 V108 Q109	E100-H104 WeakPolarHBondContact O-CB 3.2Å; E100-H104 PolarHBondContact O-N 3.37Å; H104-V108 WeakPolarHBondContact O-CA 3.29Å; H104-V108 WeakPolarHBondContact O-CB 3.44Å; H104-V108 PolarHBondContact O-N 2.86Å; H104-Q109 PolarHBondContact O-N 2.89Å; H104-Q109 VanDerWaalsContact O-N 3.14Å
105	Q	97.6	Very high	95.8	Very high	80 Å²	80	75 Å²	75	37%	0.374	40%	0.4	S	S	.	.	I	π-helix	trans	-63.7	-44.3	177.8	-176.1	159.9	-11.6	0	0	112.2	R101 A102 I103 Q109 Q110	R101-Q105 VanDerWaalsContact O-CB 3.27Å; R101-Q105 WeakPolarHBondContact O-CB 3.44Å; R101-Q105 PolarHBondContact O-N 3.28Å; A102-Q105 PolarHBondContact O-N 2.82Å; I103-Q105 VanDerWaalsContact C-N 3.35Å; I103-Q105 PolarHBondContact O-N 3.5Å; Q105-Q109 WeakPolarHBondContact O-CB 3.33Å; Q105-Q109 PolarHBondContact O-N 3.39Å; Q105-Q110 WeakPolarHBondContact O-CB 3.38Å; Q105-Q110 PolarHBondContact O-N 3.44Å
106	A	96.8	Very high	95.7	Very high	6 Å²	6	75.4 Å²	75.4	5%	0.05	40%	0.4	C	S	.	.	I	π-helix	trans	-72.5	-49.5	-179.3	0	0	0	0	0	112.8	L97 A102 I103 Q110 G111 F114	L97-A106 HydrophobicContact CD1-CB 3.47Å; L97-A106 VanDerWaalsContact CD1-CB 3.47Å; A102-A106 WeakPolarHBondContact O-CB 3.25Å; A102-A106 PolarHBondContact O-N 3.2Å; I103-A106 PolarHBondContact O-N 2.96Å; A106-Q110 CarbonylContact O-C 3.46Å; A106-G111 PolarHBondContact O-N 2.93Å; A106-F114 HydrophobicContact CB-CD1 4.24Å; A106-F114 HydrophobicContact CB-CD2 3.95Å; A106-F114 HydrophobicContact CB-CE1 4.2Å; A106-F114 HydrophobicContact CB-CE2 3.91Å; A106-F114 HydrophobicContact CB-CG 4.12Å; A106-F114 HydrophobicContact CB-CZ 4.04Å; A106-F114 WeakPolarHBondContact O-CD2 3.42Å
107	L	96.3	Very high	95.5	Very high	103 Å²	103	78.9 Å²	78.9	54%	0.539	41%	0.411	S	S	.	.	I	π-helix	trans	-89.2	-23.9	-169.4	-57.5	-172.5	0	0	0	113.8	I103 G111 F114	I103-L107 HydrophobicContact CG2-CD1 3.83Å; I103-L107 HydrophobicContact CG2-CG 4.31Å; I103-L107 WeakPolarHBondContact O-CB 3.27Å; I103-L107 PolarHBondContact O-N 3.48Å; L107-G111 VanDerWaalsContact O-CA 3.27Å; L107-G111 WeakPolarHBondContact O-CA 3.17Å; L107-F114 HydrophobicContact CD2-CB 4.09Å
108	V	96.5	Very high	95.1	Very high	98 Å²	98	79.5 Å²	79.5	59%	0.594	42%	0.418	S	S	*	.	I	π-helix	trans	-104.2	-62.7	179.2	-175.2	0	0	0	0	110.2	H104 Q110 G111	H104-V108 WeakPolarHBondContact O-CA 3.29Å; H104-V108 WeakPolarHBondContact O-CB 3.44Å; H104-V108 PolarHBondContact O-N 2.86Å; V108-Q110 VanDerWaalsContact C-N 3.32Å; V108-Q110 PolarHBondContact O-N 3.41Å; V108-G111 PolarHBondContact O-N 3.38Å
109	Q	97.4	Very high	94.8	Very high	129 Å²	129	80.9 Å²	80.9	60%	0.603	44%	0.437	S	S	*	.	I	π-helix	trans	-68.4	-33	-174.7	-60.4	177.9	-2	0	0	112.6	H104 Q105	H104-Q109 PolarHBondContact O-N 2.89Å; H104-Q109 VanDerWaalsContact O-N 3.14Å; Q105-Q109 WeakPolarHBondContact O-CB 3.33Å; Q105-Q109 PolarHBondContact O-N 3.39Å
110	Q	96.1	Very high	94.5	Very high	87 Å²	87	84.4 Å²	84.4	41%	0.407	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	25.4	179.6	-59.5	-177	-2.6	0	0	112	Q105 A106 V108 S112 A113 F114	Q105-Q110 WeakPolarHBondContact O-CB 3.38Å; Q105-Q110 PolarHBondContact O-N 3.44Å; A106-Q110 CarbonylContact O-C 3.46Å; V108-Q110 VanDerWaalsContact C-N 3.32Å; V108-Q110 PolarHBondContact O-N 3.41Å; Q110-S112 VanDerWaalsContact C-N 3.25Å; Q110-S112 PolarHBondContact O-N 3.4Å; Q110-A113 WeakPolarHBondContact O-CB 3.2Å; Q110-A113 PolarHBondContact O-N 3.32Å; Q110-F114 HydrophobicContact CB-CD2 4.03Å; Q110-F114 HydrophobicContact CB-CE2 4.08Å; Q110-F114 PolarHBondContact O-N 2.76Å
111	G	93.6	Very high	94.2	Very high	22 Å²	22	79.8 Å²	79.8	23%	0.227	44%	0.441	C	S	.	.	G	3₁₀ helix	trans	-51.8	-39	-168.7	0	0	0	0	0	114.4	A106 L107 V108 A113 F114 A115	A106-G111 PolarHBondContact O-N 2.93Å; L107-G111 VanDerWaalsContact O-CA 3.27Å; L107-G111 WeakPolarHBondContact O-CA 3.17Å; V108-G111 PolarHBondContact O-N 3.38Å; G111-A113 VanDerWaalsContact C-N 3.33Å; G111-A113 PolarHBondContact O-N 3.39Å; G111-F114 CarbonylContact O-C 3.51Å; G111-F114 PolarHBondContact O-N 2.72Å; G111-A115 WeakPolarHBondContact O-CA 3.3Å; G111-A115 VanDerWaalsContact O-CB 3.32Å; G111-A115 WeakPolarHBondContact O-CB 3.41Å; G111-A115 PolarHBondContact O-N 2.86Å
112	S	91.9	Very high	93.9	Very high	91 Å²	91	73.5 Å²	73.5	64%	0.636	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-63.3	-34.5	177.1	57.2	0	0	0	0	113.7	Q110 F114	Q110-S112 VanDerWaalsContact C-N 3.25Å; Q110-S112 PolarHBondContact O-N 3.4Å; S112-F114 VanDerWaalsContact C-N 3.32Å
113	A	92.6	Very high	93.7	Very high	79 Å²	79	74.6 Å²	74.6	65%	0.653	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-73.7	-24.3	177.5	0	0	0	0	0	112.6	Q110 G111	Q110-A113 WeakPolarHBondContact O-CB 3.2Å; Q110-A113 PolarHBondContact O-N 3.32Å; G111-A113 VanDerWaalsContact C-N 3.33Å; G111-A113 PolarHBondContact O-N 3.39Å
114	F	94.5	Very high	93.3	Very high	97 Å²	97	80.4 Å²	80.4	43%	0.425	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-108.6	9	-179.9	-70.1	-91	0	0	0	113.4	A106 L107 Q110 G111 S112 D116	A106-F114 HydrophobicContact CB-CD1 4.24Å; A106-F114 HydrophobicContact CB-CD2 3.95Å; A106-F114 HydrophobicContact CB-CE1 4.2Å; A106-F114 HydrophobicContact CB-CE2 3.91Å; A106-F114 HydrophobicContact CB-CG 4.12Å; A106-F114 HydrophobicContact CB-CZ 4.04Å; A106-F114 WeakPolarHBondContact O-CD2 3.42Å; L107-F114 HydrophobicContact CD2-CB 4.09Å; Q110-F114 HydrophobicContact CB-CD2 4.03Å; Q110-F114 HydrophobicContact CB-CE2 4.08Å; Q110-F114 PolarHBondContact O-N 2.76Å; G111-F114 CarbonylContact O-C 3.51Å; G111-F114 PolarHBondContact O-N 2.72Å; S112-F114 VanDerWaalsContact C-N 3.32Å; F114-D116 VanDerWaalsContact C-N 3.33Å; F114-D116 PolarHBondContact O-N 3.17Å
115	A	92.8	Very high	93.1	Very high	16 Å²	16	81.6 Å²	81.6	13%	0.132	46%	0.46	C	S	.	.			trans	-75.2	-20.4	-174.2	0	0	0	0	0	113.7	G111 R117 Y137	G111-A115 WeakPolarHBondContact O-CA 3.3Å; G111-A115 VanDerWaalsContact O-CB 3.32Å; G111-A115 WeakPolarHBondContact O-CB 3.41Å; G111-A115 PolarHBondContact O-N 2.86Å; A115-R117 PolarHBondContact O-NH1 2.95Å; A115-Y137 HydrophobicContact CB-CD2 3.4Å; A115-Y137 HydrophobicContact CB-CE2 3.49Å; A115-Y137 VanDerWaalsContact CB-CE2 3.49Å; A115-Y137 HydrophobicContact CB-CG 3.94Å
116	D	93.5	Very high	92.8	Very high	84 Å²	84	80.2 Å²	80.2	45%	0.449	46%	0.457	S	S	.	.			trans	-70.8	166.3	-174	-157.3	11.6	0	0	0	113.4	F114 H136 Y137	F114-D116 VanDerWaalsContact C-N 3.33Å; F114-D116 PolarHBondContact O-N 3.17Å; D116-H136 WeakPolarHBondContact OD1-CA 3.45Å; D116-H136 IonicContact OD1-CG 3.95Å; D116-H136 IonicContact OD1-ND1 3.35Å; D116-H136 PolarHBondContact OD1-ND1 3.42Å; D116-H136 IonicContact OD2-ND1 3.78Å; D116-Y137 PolarHBondContact OD1-N 3.03Å
117	R	92.7	Very high	92.5	Very high	88 Å²	88	84 Å²	84	33%	0.332	48%	0.483	S	S	.	.			trans	-117.7	137.9	177.2	-64.3	-67.4	175.6	-88	-3.9	110.6	A115 F123 A133 G135	A115-R117 PolarHBondContact O-NH1 2.95Å; R117-F123 HydrophobicContact CB-CE2 4.29Å; R117-A133 PolarHBondContact NE-O 3.49Å; R117-G135 WeakPolarHBondContact CB-O 3.49Å; R117-G135 WeakPolarHBondContact CG-O 3.36Å
118	P	89.8	Confident	92.1	Very high	64 Å²	64	82 Å²	82	42%	0.416	49%	0.488	S	S	.	.			trans	-64.2	142.3	174.5	27.2	-34	0	0	0	110.4	F120 F123	P118-F120 HydrophobicContact CB-CD1 4.11Å; P118-F120 HydrophobicContact CB-CD2 4.27Å; P118-F120 HydrophobicContact CB-CE1 3.83Å; P118-F120 HydrophobicContact CB-CE2 4.01Å; P118-F120 HydrophobicContact CB-CG 4.32Å; P118-F120 HydrophobicContact CB-CZ 3.78Å; P118-F120 HydrophobicContact CG-CD1 4.45Å; P118-F120 HydrophobicContact CG-CD2 3.74Å; P118-F120 HydrophobicContact CG-CE1 4.15Å; P118-F120 HydrophobicContact CG-CE2 3.39Å; P118-F120 HydrophobicContact CG-CG 4.27Å; P118-F120 HydrophobicContact CG-CZ 3.61Å; P118-F120 PolarHBondContact O-N 2.97Å; P118-F123 HydrophobicContact CG-CE2 4.06Å; P118-F123 WeakPolarHBondContact O-CD2 3.38Å; P118-F123 WeakPolarHBondContact O-CE2 3.38Å
119	A	87.8	Confident	91.6	Very high	84 Å²	84	79.3 Å²	79.3	69%	0.694	48%	0.48	S	S	*	.			trans	-76.5	57.1	178.5	0	0	0	0	0	112.3
120	F	89.2	Confident	91.1	Very high	87 Å²	87	83.6 Å²	83.6	38%	0.382	49%	0.491	S	S	.	.			trans	-68.1	141.1	176.4	-65.6	-31.7	0	0	0	111.1	P118 S122 F123	P118-F120 HydrophobicContact CB-CD1 4.11Å; P118-F120 HydrophobicContact CB-CD2 4.27Å; P118-F120 HydrophobicContact CB-CE1 3.83Å; P118-F120 HydrophobicContact CB-CE2 4.01Å; P118-F120 HydrophobicContact CB-CG 4.32Å; P118-F120 HydrophobicContact CB-CZ 3.78Å; P118-F120 HydrophobicContact CG-CD1 4.45Å; P118-F120 HydrophobicContact CG-CD2 3.74Å; P118-F120 HydrophobicContact CG-CE1 4.15Å; P118-F120 HydrophobicContact CG-CE2 3.39Å; P118-F120 HydrophobicContact CG-CG 4.27Å; P118-F120 HydrophobicContact CG-CZ 3.61Å; P118-F120 PolarHBondContact O-N 2.97Å; F120-S122 PolarHBondContact O-N 3.48Å; F120-F123 HydrophobicContact CB-CD1 4.24Å; F120-F123 HydrophobicContact CB-CD2 4.37Å; F120-F123 HydrophobicContact CB-CG 4.15Å; F120-F123 HydrophobicContact CD2-CE1 4.05Å; F120-F123 HydrophobicContact CD2-CE2 4.03Å; F120-F123 AromaticContact CD2-CZ 3.75Å; F120-F123 HydrophobicContact CD2-CZ 3.75Å; F120-F123 HydrophobicContact CE2-CZ 4.43Å; F120-F123 WeakPolarHBondContact O-CB 3.45Å; F120-F123 PolarHBondContact O-N 2.91Å
121	A	90.3	Very high	90.8	Very high	77 Å²	77	80.3 Å²	80.3	64%	0.636	48%	0.477	S	S	*	.	H	α-helix	trans	-58	-33.8	178.2	0	0	0	0	0	112.2	F123 R124	A121-F123 VanDerWaalsContact C-N 3.27Å; A121-F123 PolarHBondContact O-N 3.39Å; A121-R124 PolarHBondContact O-N 2.91Å
122	S	90.8	Very high	90.6	Very high	72 Å²	72	87.2 Å²	87.2	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-64.2	-27.9	174.3	53.4	0	0	0	0	113.3	F120 R124 V125	F120-S122 PolarHBondContact O-N 3.48Å; S122-R124 VanDerWaalsContact C-N 3.33Å; S122-V125 WeakPolarHBondContact O-CG2 3.4Å
123	F	92.3	Very high	90.5	Very high	42 Å²	42	85.6 Å²	85.6	18%	0.184	50%	0.498	C	S	.	.	H	α-helix	trans	-73.8	-29.6	178.3	-69.7	3.2	0	0	0	111.6	R117 P118 F120 A121 V125 V126 F134	R117-F123 HydrophobicContact CB-CE2 4.29Å; P118-F123 HydrophobicContact CG-CE2 4.06Å; P118-F123 WeakPolarHBondContact O-CD2 3.38Å; P118-F123 WeakPolarHBondContact O-CE2 3.38Å; F120-F123 HydrophobicContact CB-CD1 4.24Å; F120-F123 HydrophobicContact CB-CD2 4.37Å; F120-F123 HydrophobicContact CB-CG 4.15Å; F120-F123 HydrophobicContact CD2-CE1 4.05Å; F120-F123 HydrophobicContact CD2-CE2 4.03Å; F120-F123 AromaticContact CD2-CZ 3.75Å; F120-F123 HydrophobicContact CD2-CZ 3.75Å; F120-F123 HydrophobicContact CE2-CZ 4.43Å; F120-F123 WeakPolarHBondContact O-CB 3.45Å; F120-F123 PolarHBondContact O-N 2.91Å; A121-F123 VanDerWaalsContact C-N 3.27Å; A121-F123 PolarHBondContact O-N 3.39Å; F123-V125 VanDerWaalsContact C-N 3.27Å; F123-V125 PolarHBondContact O-N 3.41Å; F123-V126 PolarHBondContact O-N 2.97Å; F123-F134 HydrophobicContact CB-CB 3.91Å; F123-F134 HydrophobicContact CD1-CB 4.23Å; F123-F134 AromaticContact CD1-CD1 3.71Å; F123-F134 HydrophobicContact CD1-CD1 3.71Å; F123-F134 HydrophobicContact CD1-CE1 4.34Å; F123-F134 HydrophobicContact CD1-CG 4.11Å; F123-F134 HydrophobicContact CD2-CB 3.89Å; F123-F134 HydrophobicContact CD2-CD1 4.12Å; F123-F134 HydrophobicContact CD2-CG 4.44Å; F123-F134 AromaticContact CE1-CD1 3.52Å; F123-F134 HydrophobicContact CE1-CD1 3.52Å; F123-F134 AromaticContact CE1-CE1 3.89Å; F123-F134 HydrophobicContact CE1-CE1 3.89Å; F123-F134 HydrophobicContact CE1-CG 4.37Å; F123-F134 HydrophobicContact CE2-CB 4.47Å; F123-F134 AromaticContact CE2-CD1 3.95Å; F123-F134 HydrophobicContact CE2-CD1 3.95Å; F123-F134 HydrophobicContact CG-CB 3.76Å; F123-F134 HydrophobicContact CG-CD1 4.02Å; F123-F134 HydrophobicContact CG-CG 4.16Å; F123-F134 AromaticContact CZ-CD1 3.66Å; F123-F134 HydrophobicContact CZ-CD1 3.66Å; F123-F134 HydrophobicContact CZ-CE1 4.17Å
124	R	89.7	Confident	90.4	Very high	190 Å²	190	85.9 Å²	85.9	72%	0.717	49%	0.485	S	S	*	.	H	α-helix	trans	-67.3	-24.3	177.8	-69.3	-178.9	57.6	-130.5	-5.6	113.8	A121 S122 G128 G129	A121-R124 PolarHBondContact O-N 2.91Å; S122-R124 VanDerWaalsContact C-N 3.33Å; R124-G128 CarbonylContact O-C 3.51Å; R124-G129 WeakPolarHBondContact O-CA 3.38Å; R124-G129 PolarHBondContact O-N 3.41Å
125	V	92.8	Very high	90.1	Very high	118 Å²	118	82.4 Å²	82.4	72%	0.715	48%	0.476	S	S	*	.	H	α-helix	trans	-83	-20.8	178.2	-60.6	0	0	0	0	112.3	S122 F123 S127	S122-V125 WeakPolarHBondContact O-CG2 3.4Å; F123-V125 VanDerWaalsContact C-N 3.27Å; F123-V125 PolarHBondContact O-N 3.41Å; V125-S127 PolarHBondContact O-N 3.19Å
126	V	91.2	Very high	90	Very high	50 Å²	50	87.2 Å²	87.2	30%	0.303	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-75.1	124.6	178.6	-173.2	0	0	0	0	109.6	F123 G128 G129 F134	F123-V126 PolarHBondContact O-N 2.97Å; V126-G128 PolarHBondContact O-N 3.02Å; V126-G128 VanDerWaalsContact O-N 3.12Å; V126-G129 PolarHBondContact O-N 3.5Å; V126-F134 HydrophobicContact CB-CD2 4.02Å; V126-F134 HydrophobicContact CG1-CD2 3.77Å; V126-F134 HydrophobicContact CG1-CE2 4.03Å; V126-F134 HydrophobicContact CG2-CD2 4.07Å; V126-F134 HydrophobicContact CG2-CE2 4.25Å
127	S	90.1	Very high	89.7	Confident	85 Å²	85	86.7 Å²	86.7	59%	0.594	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	52	34.1	-179.7	-51.4	0	0	0	0	113.6	V125 G129 R130	V125-S127 PolarHBondContact O-N 3.19Å; S127-G129 PolarHBondContact O-N 3.44Å; S127-R130 PolarHBondContact O-N 2.97Å; S127-R130 VanDerWaalsContact O-N 3.11Å
128	G	87.8	Confident	89.4	Confident	63 Å²	63	84.9 Å²	84.9	65%	0.649	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	59.4	27.9	-176.1	0	0	0	0	0	113.9	R124 V126	R124-G128 CarbonylContact O-C 3.51Å; V126-G128 PolarHBondContact O-N 3.02Å; V126-G128 VanDerWaalsContact O-N 3.12Å
129	G	86	Confident	89.2	Confident	41 Å²	41	87.9 Å²	87.9	42%	0.423	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	83.7	7.9	-179.3	0	0	0	0	0	114.6	R124 V126 S127	R124-G129 WeakPolarHBondContact O-CA 3.38Å; R124-G129 PolarHBondContact O-N 3.41Å; V126-G129 PolarHBondContact O-N 3.5Å; S127-G129 PolarHBondContact O-N 3.44Å
130	R	87.5	Confident	88.9	Confident	219 Å²	219	91.9 Å²	91.9	83%	0.826	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	24.8	-179.8	-58.4	-176.4	-179.9	115.5	-2.6	113.1	S127	S127-R130 PolarHBondContact O-N 2.97Å; S127-R130 VanDerWaalsContact O-N 3.11Å
131	S	89.7	Confident	88.6	Confident	17 Å²	17	93.4 Å²	93.4	12%	0.119	50%	0.504	C	S	.	.			trans	-69.4	131	178.9	176.1	0	0	0	0	111.2	A133 F134 G135	S131-A133 VanDerWaalsContact C-N 3.28Å; S131-A133 PolarHBondContact O-N 3.34Å; S131-A133 PolarHBondContact OG-N 3.01Å; S131-F134 WeakPolarHBondContact OG-CD2 3.11Å; S131-F134 PolarHBondContact OG-N 2.99Å; S131-G135 WeakPolarHBondContact O-CA 3.32Å; S131-G135 PolarHBondContact O-N 3.42Å
132	M	89.8	Confident	88.1	Confident	167 Å²	167	94.7 Å²	94.7	82%	0.823	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-31.1	172.1	-64.8	-172.8	-65	0	0	112.4	W141	M132-W141 PolarHBondContact O-NE1 2.98Å
133	A	90.2	Very high	87.2	Confident	58 Å²	58	99.9 Å²	99.9	48%	0.479	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-30.5	-176.9	0	0	0	0	0	113.5	R117 S131	R117-A133 PolarHBondContact NE-O 3.49Å; S131-A133 VanDerWaalsContact C-N 3.28Å; S131-A133 PolarHBondContact O-N 3.34Å; S131-A133 PolarHBondContact OG-N 3.01Å
134	F	90.7	Very high	86.9	Confident	85 Å²	85	102.8 Å²	102.8	37%	0.373	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-1.6	-175.3	-59.5	-66.4	0	0	0	114	F123 V126 S131	F123-F134 HydrophobicContact CB-CB 3.91Å; F123-F134 HydrophobicContact CD1-CB 4.23Å; F123-F134 AromaticContact CD1-CD1 3.71Å; F123-F134 HydrophobicContact CD1-CD1 3.71Å; F123-F134 HydrophobicContact CD1-CE1 4.34Å; F123-F134 HydrophobicContact CD1-CG 4.11Å; F123-F134 HydrophobicContact CD2-CB 3.89Å; F123-F134 HydrophobicContact CD2-CD1 4.12Å; F123-F134 HydrophobicContact CD2-CG 4.44Å; F123-F134 AromaticContact CE1-CD1 3.52Å; F123-F134 HydrophobicContact CE1-CD1 3.52Å; F123-F134 AromaticContact CE1-CE1 3.89Å; F123-F134 HydrophobicContact CE1-CE1 3.89Å; F123-F134 HydrophobicContact CE1-CG 4.37Å; F123-F134 HydrophobicContact CE2-CB 4.47Å; F123-F134 AromaticContact CE2-CD1 3.95Å; F123-F134 HydrophobicContact CE2-CD1 3.95Å; F123-F134 HydrophobicContact CG-CB 3.76Å; F123-F134 HydrophobicContact CG-CD1 4.02Å; F123-F134 HydrophobicContact CG-CG 4.16Å; F123-F134 AromaticContact CZ-CD1 3.66Å; F123-F134 HydrophobicContact CZ-CD1 3.66Å; F123-F134 HydrophobicContact CZ-CE1 4.17Å; V126-F134 HydrophobicContact CB-CD2 4.02Å; V126-F134 HydrophobicContact CG1-CD2 3.77Å; V126-F134 HydrophobicContact CG1-CE2 4.03Å; V126-F134 HydrophobicContact CG2-CD2 4.07Å; V126-F134 HydrophobicContact CG2-CE2 4.25Å; S131-F134 WeakPolarHBondContact OG-CD2 3.11Å; S131-F134 PolarHBondContact OG-N 2.99Å
135	G	88.4	Confident	86.8	Confident	23 Å²	23	98.2 Å²	98.2	24%	0.237	53%	0.531	C	S	.	.	S	Bend	trans	-78.9	170	175.9	0	0	0	0	0	112.9	R117 S131	R117-G135 WeakPolarHBondContact CB-O 3.49Å; R117-G135 WeakPolarHBondContact CG-O 3.36Å; S131-G135 WeakPolarHBondContact O-CA 3.32Å; S131-G135 PolarHBondContact O-N 3.42Å
136	H	88.9	Confident	86.5	Confident	117 Å²	117	97.1 Å²	97.1	54%	0.542	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-66.7	149.1	175.8	-71.8	-67.8	0	0	0	112	D116 S138	D116-H136 WeakPolarHBondContact OD1-CA 3.45Å; D116-H136 IonicContact OD1-CG 3.95Å; D116-H136 IonicContact OD1-ND1 3.35Å; D116-H136 PolarHBondContact OD1-ND1 3.42Å; D116-H136 IonicContact OD2-ND1 3.78Å; H136-S138 PolarHBondContact O-N 3.34Å
137	Y	87.6	Confident	86.2	Confident	74 Å²	74	99.9 Å²	99.9	29%	0.29	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-60	127.1	170	-173.9	-107.9	0	0	0	110.4	A115 D116 W141 K142	A115-Y137 HydrophobicContact CB-CD2 3.4Å; A115-Y137 HydrophobicContact CB-CE2 3.49Å; A115-Y137 VanDerWaalsContact CB-CE2 3.49Å; A115-Y137 HydrophobicContact CB-CG 3.94Å; D116-Y137 PolarHBondContact OD1-N 3.03Å; Y137-W141 HydrophobicContact CD2-CD2 4.11Å; Y137-W141 AromaticContact CD2-CE3 3.67Å; Y137-W141 HydrophobicContact CD2-CE3 3.67Å; Y137-W141 HydrophobicContact CD2-CZ3 4.14Å; Y137-W141 HydrophobicContact CE2-CD2 4.28Å; Y137-W141 AromaticContact CE2-CE3 3.38Å; Y137-W141 HydrophobicContact CE2-CE3 3.38Å; Y137-W141 AromaticContact CE2-CZ3 3.63Å; Y137-W141 HydrophobicContact CE2-CZ3 3.63Å; Y137-K142 HydrophobicContact CE2-CG 4.24Å; Y137-K142 VanDerWaalsContact CZ-CE 3.44Å; Y137-K142 WeakPolarHBondContact OH-CE 3.42Å
138	S	86.3	Confident	85.9	Confident	49 Å²	49	100.8 Å²	100.8	34%	0.343	53%	0.53	S	S	.	.			trans	-149.5	165.9	-179.1	65.7	0	0	0	0	110.5	H136 H140 W141	H136-S138 PolarHBondContact O-N 3.34Å; S138-H140 PolarHBondContact O-N 2.85Å; S138-W141 WeakPolarHBondContact O-CB 3.25Å; S138-W141 PolarHBondContact O-N 3.39Å
139	E	85.4	Confident	85.8	Confident	127 Å²	127	103.3 Å²	103.3	59%	0.593	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-56.4	-35.8	176.7	-64.1	-54	130.3	0	0	112.3	W141 K142	E139-W141 PolarHBondContact O-N 3.16Å; E139-K142 WeakPolarHBondContact O-CB 3.35Å; E139-K142 PolarHBondContact O-N 3.09Å; E139-K142 IonicContact OE1-NZ 2.67Å; E139-K142 PolarHBondContact OE1-NZ 2.75Å; E139-K142 WeakPolarHBondContact OE2-CD 3.4Å; E139-K142 IonicContact OE2-NZ 3Å; E139-K142 PolarHBondContact OE2-NZ 3.02Å
140	H	81.4	Confident	85.8	Confident	168 Å²	168	107.8 Å²	107.8	78%	0.778	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-63.8	-23.1	176.6	-62.1	89.8	0	0	0	113.6	S138	S138-H140 PolarHBondContact O-N 2.85Å
141	W	84.2	Confident	85.7	Confident	119 Å²	119	99.2 Å²	99.2	45%	0.451	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-78.9	-21.9	176.2	-175.7	94.1	0	0	0	112.3	M132 Y137 S138 E139	M132-W141 PolarHBondContact O-NE1 2.98Å; Y137-W141 HydrophobicContact CD2-CD2 4.11Å; Y137-W141 AromaticContact CD2-CE3 3.67Å; Y137-W141 HydrophobicContact CD2-CE3 3.67Å; Y137-W141 HydrophobicContact CD2-CZ3 4.14Å; Y137-W141 HydrophobicContact CE2-CD2 4.28Å; Y137-W141 AromaticContact CE2-CE3 3.38Å; Y137-W141 HydrophobicContact CE2-CE3 3.38Å; Y137-W141 AromaticContact CE2-CZ3 3.63Å; Y137-W141 HydrophobicContact CE2-CZ3 3.63Å; S138-W141 WeakPolarHBondContact O-CB 3.25Å; S138-W141 PolarHBondContact O-N 3.39Å; E139-W141 PolarHBondContact O-N 3.16Å
142	K	80.3	Confident	85.3	Confident	104 Å²	104	106.1 Å²	106.1	45%	0.452	54%	0.539	S	S	.	.			trans	-82.5	-14.5	-177.4	-63.9	175.8	-179	165.9	0	113.9	Y137 E139	Y137-K142 HydrophobicContact CE2-CG 4.24Å; Y137-K142 VanDerWaalsContact CZ-CE 3.44Å; Y137-K142 WeakPolarHBondContact OH-CE 3.42Å; E139-K142 WeakPolarHBondContact O-CB 3.35Å; E139-K142 PolarHBondContact O-N 3.09Å; E139-K142 IonicContact OE1-NZ 2.67Å; E139-K142 PolarHBondContact OE1-NZ 2.75Å; E139-K142 WeakPolarHBondContact OE2-CD 3.4Å; E139-K142 IonicContact OE2-NZ 3Å; E139-K142 PolarHBondContact OE2-NZ 3.02Å
143	V	70.8	Confident	84.9	Confident	182 Å²	182	100.5 Å²	100.5	100%	1.103	51%	0.513	S	S	*	.			trans	-85.4	0	-177.2	-170.5	0	0	0	0	109.8

Retrieved 143 of 143 residues in 107.4 ms (Link to these results)

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