X2JLB5_DROME Loading...

Ribonuclease P protein subunit p20, isoform B

AlphaFold DB (Q2MGL3), UniProt , Accession X2JLB5, Species DROME (Drosophila melanogaster, Fruit fly), Gene Rpp20, Length 167 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	55.2	Low	52	Low	246 Å²	246	151.2 Å²	151.2	100%	1.212	84%	0.841	S	S	*	*				0	102.2	0	-65.8	-171.9	176.6	0	0	107.5
2	M	52.4	Low	52.1	Low	198 Å²	198	154.6 Å²	154.6	98%	0.975	84%	0.84	S	S	*	*			trans	-91.4	105.4	-178.9	-75.1	-94.9	-165.3	0	0	108.2
3	G	51.2	Low	51.8	Low	73 Å²	73	151.8 Å²	151.8	75%	0.753	84%	0.835	S	S	*	*			trans	-76.2	119.4	175.2	0	0	0	0	0	110.7	N5	G3-N5 PolarHBondContact O-N 3.34Å
4	S	56.8	Low	51.9	Low	81 Å²	81	158.9 Å²	158.9	57%	0.566	84%	0.843	S	S	*	*			trans	-70.9	111.5	171.2	51.4	0	0	0	0	110.2	Y6	S4-Y6 PolarHBondContact O-N 3.36Å
5	N	53.9	Low	52.2	Low	164 Å²	164	154.7 Å²	154.7	88%	0.877	83%	0.831	S	S	*	*			trans	-73.8	110.8	166.8	-83.3	-33.6	0	0	0	109.2	G3	G3-N5 PolarHBondContact O-N 3.34Å
6	Y	53.7	Low	52.1	Low	197 Å²	197	150.9 Å²	150.9	77%	0.773	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-73.4	131.7	168.3	-60.5	-86.2	0	0	0	109.3	S4 E8	S4-Y6 PolarHBondContact O-N 3.36Å; Y6-E8 PolarHBondContact O-N 2.88Å
7	P	53.5	Low	52.1	Low	116 Å²	116	153.1 Å²	153.1	75%	0.753	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-71.2	123.9	173.8	27.1	-30	0	0	0	110.1	H9	P7-H9 PolarHBondContact O-N 3.05Å
8	E	49.2	Very low	51.9	Low	185 Å²	185	157.2 Å²	157.2	86%	0.864	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-52.1	130.9	173.3	-86.9	-167.3	138.4	0	0	111.5	Y6 G10	Y6-E8 PolarHBondContact O-N 2.88Å; E8-G10 PolarHBondContact O-N 2.98Å
9	H	47.6	Very low	52.1	Low	199 Å²	199	158.4 Å²	158.4	92%	0.921	83%	0.831	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	127.4	175	-79.7	38.3	0	0	0	111.7	P7	P7-H9 PolarHBondContact O-N 3.05Å
10	G	46	Very low	52.5	Low	72 Å²	72	159.6 Å²	159.6	74%	0.742	83%	0.829	S	S	*	*	T	Hydrogen-bonded Turn	trans	136.9	-11.5	153.3	0	0	0	0	0	117.8	E8 K12	E8-G10 PolarHBondContact O-N 2.98Å; G10-K12 PolarHBondContact O-N 2.92Å; G10-K12 VanDerWaalsContact O-N 3.1Å
11	T	52.3	Low	53	Low	132 Å²	132	160.2 Å²	160.2	81%	0.81	83%	0.828	S	S	*	*			trans	-78.4	101.6	172.8	49.3	0	0	0	0	109.7
12	K	53.3	Low	53.7	Low	192 Å²	192	154.5 Å²	154.5	84%	0.835	80%	0.798	S	S	*	*			trans	-45.8	134.6	165	-64.3	-174.7	-179.2	-173.7	0	108.2	G10 R14	G10-K12 PolarHBondContact O-N 2.92Å; G10-K12 VanDerWaalsContact O-N 3.1Å; K12-R14 PolarHBondContact O-N 2.9Å
13	P	47.9	Very low	55.3	Low	119 Å²	119	150.2 Å²	150.2	77%	0.773	78%	0.779	S	S	*	*			trans	-52.8	131.9	177.4	21.2	-30.9	0	0	0	108.3	S15	P13-S15 PolarHBondContact O-N 3.1Å
14	R	53.4	Low	57.1	Low	251 Å²	251	149.6 Å²	149.6	95%	0.947	76%	0.757	S	S	*	*			trans	-57.1	94.5	168.1	-107	173.7	78.4	162.3	1.2	105.5	K12 A16	K12-R14 PolarHBondContact O-N 2.9Å; R14-A16 PolarHBondContact O-N 2.92Å; R14-A16 VanDerWaalsContact O-N 3.16Å
15	S	57.1	Low	58.8	Low	95 Å²	95	154.1 Å²	154.1	66%	0.664	76%	0.761	S	S	*	*			trans	-54.3	127.8	169.6	55.2	0	0	0	0	106.2	P13 K17	P13-S15 PolarHBondContact O-N 3.1Å; S15-K17 VanDerWaalsContact C-N 3.26Å; S15-K17 PolarHBondContact O-N 2.92Å
16	A	50.4	Low	60.6	Low	95 Å²	95	148.7 Å²	148.7	79%	0.785	73%	0.734	S	S	*	*			trans	-52.7	98.5	173.1	0	0	0	0	0	106.8	R14 Y18	R14-A16 PolarHBondContact O-N 2.92Å; R14-A16 VanDerWaalsContact O-N 3.16Å; A16-Y18 PolarHBondContact O-N 3.34Å
17	K	52.7	Low	62.5	Low	187 Å²	187	141.9 Å²	141.9	81%	0.813	71%	0.713	S	S	*	*			trans	-65.5	106.3	179.3	-74.9	-176.3	-179.7	177	0	105.1	S15 H19	S15-K17 VanDerWaalsContact C-N 3.26Å; S15-K17 PolarHBondContact O-N 2.92Å; K17-H19 PolarHBondContact O-N 2.92Å
18	Y	48.5	Very low	64.3	Low	228 Å²	228	144.7 Å²	144.7	89%	0.894	71%	0.708	S	S	*	*			trans	-40.3	111.6	153.5	-90.9	-96	0	0	0	106.5	A16 K20	A16-Y18 PolarHBondContact O-N 3.34Å; Y18-K20 PolarHBondContact O-N 3.03Å
19	H	55.9	Low	66.3	Low	180 Å²	180	140.2 Å²	140.2	83%	0.833	69%	0.686	S	S	*	*			trans	-70.9	74.3	172.6	-124.5	-16.8	0	0	0	105.7	K17 Q21	K17-H19 PolarHBondContact O-N 2.92Å; H19-Q21 PolarHBondContact O-N 3.35Å
20	K	59.6	Low	68.3	Low	182 Å²	182	137.8 Å²	137.8	79%	0.791	68%	0.675	S	S	*	*			trans	-59.6	111.2	163.7	-156.2	176.3	-173	-178.1	0	103.6	Y18 Q22	Y18-K20 PolarHBondContact O-N 3.03Å; K20-Q22 PolarHBondContact O-N 3.43Å
21	Q	62.3	Low	70.3	Confident	172 Å²	172	135.4 Å²	135.4	80%	0.804	65%	0.647	S	S	*	*			trans	-48.7	110.9	176.2	-74.6	173.5	-6.8	0	0	106.3	H19 N23	H19-Q21 PolarHBondContact O-N 3.35Å; Q21-N23 PolarHBondContact O-N 3.38Å; Q21-N23 PolarHBondContact O-OD1 2.94Å
22	Q	70.9	Confident	71.9	Confident	126 Å²	126	134.1 Å²	134.1	59%	0.589	64%	0.641	S	S	*	*			trans	-79.6	108.6	178.9	-71.5	-175.7	39.9	0	0	105.7	K20 H24 L113	K20-Q22 PolarHBondContact O-N 3.43Å; Q22-H24 PolarHBondContact O-N 2.91Å; Q22-L113 WeakPolarHBondContact O-CD1 3.46Å
23	N	84.6	Confident	73.5	Confident	108 Å²	108	130.6 Å²	130.6	58%	0.578	62%	0.622	S	S	*	*	S	Bend	trans	-71.8	-3.5	177.4	-64.3	-3	0	0	0	112.8	Q21 L113	Q21-N23 PolarHBondContact O-N 3.38Å; Q21-N23 PolarHBondContact O-OD1 2.94Å; N23-L113 WeakPolarHBondContact O-CG 3.4Å; N23-L113 PolarHBondContact O-N 3.02Å
24	H	89.8	Confident	75	Confident	61 Å²	61	128.7 Å²	128.7	28%	0.282	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-134.7	146.2	-178.5	60.1	49.8	0	0	0	112	Q22 L110 H111	Q22-H24 PolarHBondContact O-N 2.91Å; H24-L110 HydrophobicContact CB-CB 4.14Å; H24-H111 CarbonylContact C-O 3.55Å; H24-H111 WeakPolarHBondContact CA-O 3.18Å; H24-H111 WeakPolarHBondContact CB-O 3.28Å
25	R	91.5	Very high	75.9	Confident	175 Å²	175	122 Å²	122	66%	0.66	61%	0.609	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.4	127.4	162.8	177	180	175.5	176.5	-1.8	109.6	H111 L113	R25-H111 HydrophobicContact CB-CB 4.34Å; R25-H111 PolarHBondContact N-O 2.82Å; R25-H111 PolarHBondContact O-N 2.7Å; R25-L113 HydrophobicContact CB-CD2 4.34Å
26	V	92.7	Very high	76.6	Confident	51 Å²	51	123.1 Å²	123.1	31%	0.309	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.4	119.4	179.1	-173	0	0	0	0	110.7	R28 D108 L110	V26-R28 HydrophobicContact CG1-CG 4.36Å; V26-D108 HydrophobicContact CG1-CB 3.86Å; V26-L110 HydrophobicContact CB-CD2 4.35Å; V26-L110 HydrophobicContact CG1-CD2 4.13Å; V26-L110 HydrophobicContact CG2-CD2 3.79Å
27	V	92.8	Very high	77.5	Confident	53 Å²	53	122.7 Å²	122.7	32%	0.321	60%	0.602	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.8	115.1	172	179.5	0	0	0	0	108.6	D108 E109	V27-D108 CarbonylContact O-C 3.41Å; V27-D108 WeakPolarHBondContact O-CA 3.25Å; V27-E109 HydrophobicContact CB-CB 4.25Å; V27-E109 PolarHBondContact N-O 3.48Å; V27-E109 PolarHBondContact O-N 3.38Å
28	R	92.8	Very high	78.8	Confident	175 Å²	175	117 Å²	117	66%	0.66	58%	0.58	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.5	120.7	-176.8	-59	-175	173.5	166.1	1.1	110.3	V26 D108	V26-R28 HydrophobicContact CG1-CG 4.36Å; R28-D108 WeakPolarHBondContact CG-OD1 3.38Å
29	K	90.8	Very high	80.5	Confident	92 Å²	92	116.3 Å²	116.3	40%	0.4	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-71.3	158.4	173.8	-60	-163.2	178.6	-161.5	0	111	V107 E109	K29-V107 WeakPolarHBondContact CB-O 3.49Å; K29-V107 HydrophobicContact CD-CB 4.34Å; K29-V107 HydrophobicContact CD-CG1 4.46Å; K29-V107 WeakPolarHBondContact CG-O 3.16Å; K29-V107 PolarHBondContact N-O 3.11Å; K29-E109 HydrophobicContact CD-CG 4.44Å; K29-E109 WeakPolarHBondContact CE-OE1 3.41Å; K29-E109 HydrophobicContact CG-CG 4.29Å; K29-E109 IonicContact NZ-OE1 2.72Å; K29-E109 PolarHBondContact NZ-OE1 2.9Å
30	Q	89.1	Confident	82.2	Confident	147 Å²	147	110.8 Å²	110.8	69%	0.687	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-65.5	142.3	171.1	-67.3	-62.7	-30.3	0	0	109.8
31	P	88.9	Confident	83.8	Confident	23 Å²	23	103.4 Å²	103.4	15%	0.149	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-56.4	148.8	171.6	-20.6	29.9	0	0	0	111.2	R33 M73 V104 L106	P31-R33 PolarHBondContact O-N 3.32Å; P31-M73 HydrophobicContact CB-CE 3.94Å; P31-M73 HydrophobicContact CB-SD 4.13Å; P31-M73 HydrophobicContact CG-CE 3.43Å; P31-M73 VanDerWaalsContact CG-CE 3.43Å; P31-M73 HydrophobicContact CG-SD 4.12Å; P31-V104 HydrophobicContact CB-CG1 4.3Å; P31-L106 HydrophobicContact CB-CD2 3.67Å; P31-L106 HydrophobicContact CG-CD2 3.71Å
32	P	85.4	Confident	85.4	Confident	104 Å²	104	95.3 Å²	95.3	68%	0.675	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-54.6	135.7	170.7	-22.8	32.9	0	0	0	110.8
33	R	85.7	Confident	86.5	Confident	118 Å²	118	92 Å²	92	45%	0.445	47%	0.465	S	S	.	.			trans	-125.5	145.9	174.6	-65	173.2	-169.5	-92.5	-3.3	108.4	P31 A35 Y43	P31-R33 PolarHBondContact O-N 3.32Å; R33-A35 PolarHBondContact O-N 3.42Å; R33-Y43 HydrophobicContact CG-CE1 4.32Å; R33-Y43 VanDerWaalsContact NH1-CE2 3.3Å
34	P	80	Confident	87	Confident	79 Å²	79	87.3 Å²	87.3	51%	0.513	44%	0.44	S	S	.	.			trans	-55.5	138.3	169.3	24.7	-32.6	0	0	0	109.4	V36 Y43	P34-V36 PolarHBondContact O-N 3.18Å; P34-Y43 WeakPolarHBondContact CD-OH 3.12Å
35	A	72.1	Confident	87.2	Confident	112 Å²	112	86.9 Å²	86.9	93%	0.926	44%	0.441	S	S	*	.	S	Bend	trans	-59.2	-35.2	-177.8	0	0	0	0	0	111.8	R33 S37	R33-A35 PolarHBondContact O-N 3.42Å; A35-S37 PolarHBondContact O-N 2.95Å
36	V	72.1	Confident	87.1	Confident	118 Å²	118	81.2 Å²	81.2	72%	0.715	43%	0.428	S	S	*	.	S	Bend	trans	-88.6	100.3	171	-173.6	0	0	0	0	107.8	P34 D38	P34-V36 PolarHBondContact O-N 3.18Å; V36-D38 VanDerWaalsContact C-N 3.33Å; V36-D38 PolarHBondContact O-N 3.38Å
37	S	69.3	Low	87.1	Confident	86 Å²	86	88 Å²	88	60%	0.601	45%	0.454	S	S	*	.			trans	-74.1	92.6	167	-175.8	0	0	0	0	108	A35 R39	A35-S37 PolarHBondContact O-N 2.95Å; S37-R39 PolarHBondContact O-N 3.45Å
38	D	80	Confident	87.1	Confident	66 Å²	66	88.5 Å²	88.5	35%	0.353	46%	0.457	S	S	.	.			trans	-63	135.2	168.6	167.3	32.5	0	0	0	109.1	V36 H40 N41	V36-D38 VanDerWaalsContact C-N 3.33Å; V36-D38 PolarHBondContact O-N 3.38Å; D38-H40 PolarHBondContact O-N 2.94Å; D38-H40 VanDerWaalsContact O-N 3.07Å; D38-H40 IonicContact OD1-CE1 2.75Å; D38-H40 IonicContact OD1-CG 3.64Å; D38-H40 IonicContact OD1-ND1 3.92Å; D38-H40 PolarHBondContact OD1-ND1 3.07Å; D38-H40 IonicContact OD2-CG 2.67Å; D38-H40 IonicContact OD2-ND1 3.94Å; D38-H40 PolarHBondContact OD2-ND1 3.48Å; D38-N41 VanDerWaalsContact CB-ND2 3.28Å; D38-N41 WeakPolarHBondContact CB-ND2 3.41Å; D38-N41 WeakPolarHBondContact O-CB 3.27Å; D38-N41 PolarHBondContact O-N 3.4Å; D38-N41 PolarHBondContact O-ND2 3.21Å; D38-N41 VanDerWaalsContact O-ND2 3.1Å
39	R	84.5	Confident	87.2	Confident	214 Å²	214	84.8 Å²	84.8	81%	0.808	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-22.4	-172	-70.4	-179.5	175.5	166.2	-1	112.2	S37 N41	S37-R39 PolarHBondContact O-N 3.45Å; R39-N41 VanDerWaalsContact C-N 3.31Å; R39-N41 PolarHBondContact O-N 3.49Å
40	H	91.9	Very high	87.4	Confident	64 Å²	64	82.3 Å²	82.3	30%	0.296	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-5.3	178.2	-51.6	127.9	0	0	0	114.2	D38 E67 F69	D38-H40 PolarHBondContact O-N 2.94Å; D38-H40 VanDerWaalsContact O-N 3.07Å; D38-H40 IonicContact OD1-CE1 2.75Å; D38-H40 IonicContact OD1-CG 3.64Å; D38-H40 IonicContact OD1-ND1 3.92Å; D38-H40 PolarHBondContact OD1-ND1 3.07Å; D38-H40 IonicContact OD2-CG 2.67Å; D38-H40 IonicContact OD2-ND1 3.94Å; D38-H40 PolarHBondContact OD2-ND1 3.48Å; H40-E67 WeakPolarHBondContact CB-O 3.18Å; H40-F69 PolarHBondContact O-N 3.3Å
41	N	93.5	Very high	87.7	Confident	27 Å²	27	82.7 Å²	82.7	14%	0.144	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	119.1	178.1	-62.6	-87.9	0	0	0	111.5	D38 R39 Y43 H71	D38-N41 VanDerWaalsContact CB-ND2 3.28Å; D38-N41 WeakPolarHBondContact CB-ND2 3.41Å; D38-N41 WeakPolarHBondContact O-CB 3.27Å; D38-N41 PolarHBondContact O-N 3.4Å; D38-N41 PolarHBondContact O-ND2 3.21Å; D38-N41 VanDerWaalsContact O-ND2 3.1Å; R39-N41 VanDerWaalsContact C-N 3.31Å; R39-N41 PolarHBondContact O-N 3.49Å; N41-Y43 HydrophobicContact CB-CE2 4.17Å; N41-H71 PolarHBondContact OD1-NE2 3.29Å
42	I	94.3	Very high	88.1	Confident	2 Å²	2	84 Å²	84	1%	0.01	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.8	-178.3	-50.4	176	0	0	0	109	I44 C57 L60 I68 F69 L70 H71	I42-I44 HydrophobicContact CG2-CD1 4.03Å; I42-C57 HydrophobicContact CD1-CB 4.12Å; I42-C57 VanDerWaalsContact CD1-SG 3.51Å; I42-L60 HydrophobicContact CD1-CD1 3.5Å; I42-L60 VanDerWaalsContact CD1-CD1 3.5Å; I42-L60 HydrophobicContact CG1-CD1 3.85Å; I42-I68 HydrophobicContact CD1-CD1 4.06Å; I42-F69 PolarHBondContact N-O 3.47Å; I42-L70 HydrophobicContact CB-CD2 3.82Å; I42-L70 HydrophobicContact CD1-CD2 3.8Å; I42-L70 HydrophobicContact CG1-CD2 4.26Å; I42-L70 HydrophobicContact CG2-CD2 4.29Å; I42-L70 CarbonylContact O-C 3.58Å; I42-L70 WeakPolarHBondContact O-CA 3.18Å; I42-H71 PolarHBondContact O-N 2.84Å
43	Y	94.5	Very high	88.6	Confident	58 Å²	58	79.6 Å²	79.6	23%	0.227	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	115	180	-66.1	-98.1	0	0	0	110.8	R33 P34 N41 T45 H71	R33-Y43 HydrophobicContact CG-CE1 4.32Å; R33-Y43 VanDerWaalsContact NH1-CE2 3.3Å; P34-Y43 WeakPolarHBondContact CD-OH 3.12Å; N41-Y43 HydrophobicContact CB-CE2 4.17Å; Y43-T45 PolarHBondContact O-N 3.12Å; Y43-H71 HydrophobicContact CD1-CB 3.63Å; Y43-H71 HydrophobicContact CE1-CB 3.93Å; Y43-H71 HydrophobicContact CG-CB 4.26Å
44	I	95.7	Very high	89.1	Confident	9 Å²	9	75 Å²	75	5%	0.046	41%	0.406	C	S	.	.			trans	-81.3	118.7	-175.7	-54.4	-54.8	0	0	0	109.9	I42 L70 H71 S76 R79 I83	I42-I44 HydrophobicContact CG2-CD1 4.03Å; I44-L70 HydrophobicContact CD1-CD2 4.44Å; I44-L70 HydrophobicContact CG1-CB 4.32Å; I44-H71 PolarHBondContact N-O 3.24Å; I44-S76 VanDerWaalsContact O-CB 3.25Å; I44-S76 WeakPolarHBondContact O-CB 3.31Å; I44-S76 PolarHBondContact O-OG 2.9Å; I44-R79 HydrophobicContact CG2-CB 4.33Å; I44-R79 HydrophobicContact CG2-CG 3.98Å; I44-I83 HydrophobicContact CD1-CD1 4.01Å; I44-I83 HydrophobicContact CG2-CD1 4.34Å
45	T	93.4	Very high	89.8	Confident	52 Å²	52	78.8 Å²	78.8	32%	0.319	41%	0.41	S	S	.	.			trans	-116.9	148.5	175.2	174.3	0	0	0	0	110.9	Y43 K47 T48 Q53 R79	Y43-T45 PolarHBondContact O-N 3.12Å; T45-K47 PolarHBondContact O-N 3.47Å; T45-K47 PolarHBondContact OG1-N 2.89Å; T45-T48 WeakPolarHBondContact CG2-OG1 3.29Å; T45-Q53 VanDerWaalsContact CG2-NE2 3.33Å; T45-Q53 PolarHBondContact O-NE2 2.79Å; T45-R79 PolarHBondContact O-NH1 3.43Å
46	S	90.3	Very high	90.9	Very high	56 Å²	56	80 Å²	80	39%	0.392	39%	0.391	S	S	.	.	S	Bend	trans	-72.6	-16.5	173.7	52.2	0	0	0	0	113.5	R79	S46-R79 PolarHBondContact O-NH1 3.22Å; S46-R79 PolarHBondContact O-NH2 3.33Å
47	K	91.4	Very high	92.1	Very high	192 Å²	192	74.4 Å²	74.4	84%	0.835	36%	0.357	S	S	*	.	S	Bend	trans	-79.2	-33.9	-175.7	-64.1	-173.2	178.7	-175.4	0	114	T45	T45-K47 PolarHBondContact O-N 3.47Å; T45-K47 PolarHBondContact OG1-N 2.89Å
48	T	92.9	Very high	93.3	Very high	64 Å²	64	73 Å²	73	39%	0.393	34%	0.341	S	S	.	.	S	Bend	trans	-76	152.2	178.1	-47.9	0	0	0	0	109.5	T45 A52 Q53 R79	T45-T48 WeakPolarHBondContact CG2-OG1 3.29Å; T48-A52 HydrophobicContact CG2-CB 4.41Å; T48-Q53 VanDerWaalsContact CB-NE2 3.31Å; T48-Q53 HydrophobicContact CG2-CG 3.78Å; T48-Q53 PolarHBondContact OG1-NE2 2.69Å; T48-R79 PolarHBondContact O-NH1 3.42Å
49	D	95.2	Very high	94	Very high	97 Å²	97	74.5 Å²	74.5	52%	0.519	35%	0.345	S	S	.	.			trans	-58.7	144.2	171.3	176.2	60	0	0	0	111.8	K51 A52 Q53	D49-K51 WeakPolarHBondContact OD2-CA 3.46Å; D49-K51 WeakPolarHBondContact OD2-CB 3.35Å; D49-K51 PolarHBondContact OD2-N 3.14Å; D49-A52 HydrophobicContact CB-CB 3.94Å; D49-A52 PolarHBondContact OD2-N 2.81Å; D49-Q53 PolarHBondContact O-N 3.1Å
50	F	95.3	Very high	94.5	Very high	40 Å²	40	65.8 Å²	65.8	18%	0.175	32%	0.315	C	S	.	.	H	α-helix	trans	-65.4	-48.6	-178	179.7	-84	0	0	0	111.6	A52 Q53 Q54 R79 N82 I83	F50-A52 VanDerWaalsContact C-N 3.32Å; F50-A52 PolarHBondContact O-N 3.47Å; F50-Q53 PolarHBondContact O-N 2.93Å; F50-Q54 PolarHBondContact O-N 3.43Å; F50-R79 HydrophobicContact CD2-CG 4.01Å; F50-R79 HydrophobicContact CE2-CG 4.28Å; F50-N82 HydrophobicContact CE2-CB 4.05Å; F50-N82 HydrophobicContact CZ-CB 4.26Å; F50-I83 HydrophobicContact CD2-CD1 4.5Å; F50-I83 HydrophobicContact CD2-CG1 4.17Å; F50-I83 HydrophobicContact CE1-CG1 4.48Å; F50-I83 HydrophobicContact CE2-CD1 4.29Å; F50-I83 HydrophobicContact CE2-CG1 3.52Å; F50-I83 HydrophobicContact CZ-CG1 3.7Å
51	K	95.7	Very high	94.5	Very high	155 Å²	155	63.5 Å²	63.5	67%	0.674	31%	0.305	S	S	*	.	H	α-helix	trans	-67	-37.7	-178.1	-67.6	-176.6	175.5	-177.7	0	110.7	D49 Q53 Q54 R55	D49-K51 WeakPolarHBondContact OD2-CA 3.46Å; D49-K51 WeakPolarHBondContact OD2-CB 3.35Å; D49-K51 PolarHBondContact OD2-N 3.14Å; K51-Q53 PolarHBondContact O-N 3.01Å; K51-Q54 PolarHBondContact O-N 3.23Å; K51-R55 WeakPolarHBondContact O-CB 3.36Å; K51-R55 PolarHBondContact O-N 3.26Å
52	A	96.4	Very high	94.5	Very high	52 Å²	52	68.7 Å²	68.7	43%	0.43	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-42.7	175.2	0	0	0	0	0	112.6	T48 D49 F50 R56	T48-A52 HydrophobicContact CG2-CB 4.41Å; D49-A52 HydrophobicContact CB-CB 3.94Å; D49-A52 PolarHBondContact OD2-N 2.81Å; F50-A52 VanDerWaalsContact C-N 3.32Å; F50-A52 PolarHBondContact O-N 3.47Å; A52-R56 PolarHBondContact O-N 2.93Å; A52-R56 VanDerWaalsContact O-N 3.1Å
53	Q	95.6	Very high	94.4	Very high	11 Å²	11	72.8 Å²	72.8	5%	0.051	36%	0.361	C	S	.	.	H	α-helix	trans	-67.8	-41.8	175.2	-79	-179.7	-7.3	0	0	112.3	T45 T48 D49 F50 K51 R56 C57 I83	T45-Q53 VanDerWaalsContact CG2-NE2 3.33Å; T45-Q53 PolarHBondContact O-NE2 2.79Å; T48-Q53 VanDerWaalsContact CB-NE2 3.31Å; T48-Q53 HydrophobicContact CG2-CG 3.78Å; T48-Q53 PolarHBondContact OG1-NE2 2.69Å; D49-Q53 PolarHBondContact O-N 3.1Å; F50-Q53 PolarHBondContact O-N 2.93Å; K51-Q53 PolarHBondContact O-N 3.01Å; Q53-R56 PolarHBondContact O-N 3.28Å; Q53-C57 PolarHBondContact O-N 3Å; Q53-C57 VanDerWaalsContact O-N 3.17Å; Q53-C57 PolarHBondContact O-SG 3.47Å; Q53-I83 HydrophobicContact CB-CD1 3.89Å
54	Q	96.4	Very high	94.2	Very high	21 Å²	21	72.3 Å²	72.3	10%	0.098	37%	0.374	C	S	.	.	H	α-helix	trans	-59.3	-51.3	176.6	-174.4	-173.8	-38.5	0	0	110.7	F50 K51 R56 C57 E58 L87	F50-Q54 PolarHBondContact O-N 3.43Å; K51-Q54 PolarHBondContact O-N 3.23Å; Q54-R56 VanDerWaalsContact C-N 3.28Å; Q54-R56 PolarHBondContact O-N 3.5Å; Q54-C57 WeakPolarHBondContact O-CA 3.3Å; Q54-C57 WeakPolarHBondContact O-CB 3.45Å; Q54-C57 PolarHBondContact O-N 3.32Å; Q54-E58 WeakPolarHBondContact CG-OE1 3.26Å; Q54-E58 PolarHBondContact NE2-OE1 2.99Å; Q54-E58 PolarHBondContact O-N 3.25Å; Q54-L87 HydrophobicContact CG-CD2 4.45Å
55	R	95.9	Very high	94	Very high	158 Å²	158	72.2 Å²	72.2	60%	0.596	37%	0.374	S	S	*	.	H	α-helix	trans	-56.3	-41.4	177.8	-179.4	179	167.3	175.2	1.7	112.2	K51 C57 E58 E59	K51-R55 WeakPolarHBondContact O-CB 3.36Å; K51-R55 PolarHBondContact O-N 3.26Å; R55-C57 VanDerWaalsContact C-N 3.29Å; R55-C57 PolarHBondContact O-N 3.05Å; R55-E58 PolarHBondContact O-N 2.94Å; R55-E59 HydrophobicContact CG-CG 4.34Å; R55-E59 IonicContact CZ-OE1 3.29Å; R55-E59 IonicContact NE-OE1 3.4Å; R55-E59 PolarHBondContact NE-OE1 2.86Å; R55-E59 IonicContact NH2-OE1 2.63Å; R55-E59 PolarHBondContact NH2-OE1 2.85Å; R55-E59 WeakPolarHBondContact O-CB 3.36Å; R55-E59 WeakPolarHBondContact O-CG 3.31Å; R55-E59 PolarHBondContact O-N 3.28Å
56	R	95.5	Very high	93.9	Very high	138 Å²	138	73.2 Å²	73.2	52%	0.521	38%	0.375	S	S	.	.	H	α-helix	trans	-60.5	-37.6	175.2	178.7	178.5	174.9	177.5	-0.1	112.6	A52 Q53 Q54 L60	A52-R56 PolarHBondContact O-N 2.93Å; A52-R56 VanDerWaalsContact O-N 3.1Å; Q53-R56 PolarHBondContact O-N 3.28Å; Q54-R56 VanDerWaalsContact C-N 3.28Å; Q54-R56 PolarHBondContact O-N 3.5Å; R56-L60 PolarHBondContact O-N 3.39Å
57	C	96.1	Very high	94.1	Very high	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-68.1	-44.2	176.4	-57.2	0	0	0	0	110.7	I42 Q53 Q54 R55 L60 I61 I68 L87	I42-C57 HydrophobicContact CD1-CB 4.12Å; I42-C57 VanDerWaalsContact CD1-SG 3.51Å; Q53-C57 PolarHBondContact O-N 3Å; Q53-C57 VanDerWaalsContact O-N 3.17Å; Q53-C57 PolarHBondContact O-SG 3.47Å; Q54-C57 WeakPolarHBondContact O-CA 3.3Å; Q54-C57 WeakPolarHBondContact O-CB 3.45Å; Q54-C57 PolarHBondContact O-N 3.32Å; R55-C57 VanDerWaalsContact C-N 3.29Å; R55-C57 PolarHBondContact O-N 3.05Å; C57-L60 PolarHBondContact O-N 3.1Å; C57-I61 WeakPolarHBondContact O-CG1 3.48Å; C57-I61 PolarHBondContact O-N 2.87Å; C57-I61 VanDerWaalsContact O-N 3.09Å; C57-I68 HydrophobicContact CB-CD1 3.87Å; C57-L87 HydrophobicContact CB-CD1 3.61Å; C57-L87 HydrophobicContact CB-CD2 4Å; C57-L87 HydrophobicContact CB-CG 4.41Å
58	E	94.8	Very high	94.3	Very high	58 Å²	58	63.8 Å²	63.8	27%	0.271	33%	0.328	S	S	.	.	H	α-helix	trans	-60.7	-44.6	176.4	-66.1	167.2	178	0	0	111.4	Q54 R55 L60 I61 N62 L87	Q54-E58 WeakPolarHBondContact CG-OE1 3.26Å; Q54-E58 PolarHBondContact NE2-OE1 2.99Å; Q54-E58 PolarHBondContact O-N 3.25Å; R55-E58 PolarHBondContact O-N 2.94Å; E58-L60 VanDerWaalsContact C-N 3.32Å; E58-L60 PolarHBondContact O-N 2.88Å; E58-I61 PolarHBondContact O-N 3.39Å; E58-N62 VanDerWaalsContact O-CB 3.26Å; E58-N62 WeakPolarHBondContact O-CB 3.43Å; E58-N62 PolarHBondContact O-N 3.26Å; E58-N62 PolarHBondContact O-ND2 2.75Å; E58-L87 HydrophobicContact CG-CD2 3.43Å; E58-L87 VanDerWaalsContact CG-CD2 3.43Å
59	E	94.9	Very high	94.5	Very high	96 Å²	96	63.1 Å²	63.1	45%	0.449	32%	0.32	S	S	.	.	H	α-helix	trans	-59.1	-40.8	176.9	-76.2	171.5	179.7	0	0	112.3	R55 S63	R55-E59 HydrophobicContact CG-CG 4.34Å; R55-E59 IonicContact CZ-OE1 3.29Å; R55-E59 IonicContact NE-OE1 3.4Å; R55-E59 PolarHBondContact NE-OE1 2.86Å; R55-E59 IonicContact NH2-OE1 2.63Å; R55-E59 PolarHBondContact NH2-OE1 2.85Å; R55-E59 WeakPolarHBondContact O-CB 3.36Å; R55-E59 WeakPolarHBondContact O-CG 3.31Å; R55-E59 PolarHBondContact O-N 3.28Å; E59-S63 VanDerWaalsContact O-CB 3.31Å; E59-S63 WeakPolarHBondContact O-CB 3.35Å; E59-S63 PolarHBondContact O-N 3.04Å
60	L	94.1	Very high	94.5	Very high	31 Å²	31	58.5 Å²	58.5	16%	0.162	30%	0.295	C	S	.	.	H	α-helix	trans	-66.7	-44.4	176.7	-76.8	167.4	0	0	0	111.8	I42 R56 C57 E58 S63 A65 I68	I42-L60 HydrophobicContact CD1-CD1 3.5Å; I42-L60 VanDerWaalsContact CD1-CD1 3.5Å; I42-L60 HydrophobicContact CG1-CD1 3.85Å; R56-L60 PolarHBondContact O-N 3.39Å; C57-L60 PolarHBondContact O-N 3.1Å; E58-L60 VanDerWaalsContact C-N 3.32Å; E58-L60 PolarHBondContact O-N 2.88Å; L60-S63 PolarHBondContact O-N 3.47Å; L60-S63 PolarHBondContact O-OG 2.92Å; L60-A65 WeakPolarHBondContact O-CB 3.01Å; L60-A65 PolarHBondContact O-N 2.81Å; L60-I68 HydrophobicContact CB-CG2 3.97Å
61	I	93.6	Very high	94.6	Very high	16 Å²	16	58 Å²	58	8%	0.082	29%	0.293	C	S	.	.	H	α-helix	trans	-62.2	-47.2	176.4	-68.6	163.5	0	0	0	110.4	C57 E58 S63 G64 I68 L87 L95 I133	C57-I61 WeakPolarHBondContact O-CG1 3.48Å; C57-I61 PolarHBondContact O-N 2.87Å; C57-I61 VanDerWaalsContact O-N 3.09Å; E58-I61 PolarHBondContact O-N 3.39Å; I61-S63 PolarHBondContact O-N 2.94Å; I61-G64 PolarHBondContact O-N 3.01Å; I61-I68 HydrophobicContact CD1-CD1 3.71Å; I61-I68 HydrophobicContact CD1-CG1 4.32Å; I61-I68 HydrophobicContact CG1-CD1 3.91Å; I61-I68 HydrophobicContact CG1-CG1 4.27Å; I61-I68 HydrophobicContact CG1-CG2 4.36Å; I61-L87 HydrophobicContact CD1-CD1 4.46Å; I61-L87 HydrophobicContact CD1-CD2 4.42Å; I61-L95 HydrophobicContact CD1-CD1 3.8Å; I61-L95 HydrophobicContact CD1-CD2 4.49Å; I61-L95 HydrophobicContact CG2-CD2 3.99Å; I61-I133 HydrophobicContact CD1-CG2 4.27Å
62	N	92.2	Very high	94.6	Very high	136 Å²	136	50.7 Å²	50.7	73%	0.727	26%	0.262	S	S	*	.	H	α-helix	trans	-67.4	-23.1	179.6	-67.7	-20.9	0	0	0	112.9	E58 G64	E58-N62 VanDerWaalsContact O-CB 3.26Å; E58-N62 WeakPolarHBondContact O-CB 3.43Å; E58-N62 PolarHBondContact O-N 3.26Å; E58-N62 PolarHBondContact O-ND2 2.75Å; N62-G64 PolarHBondContact O-N 3.3Å
63	S	91.8	Very high	94.5	Very high	88 Å²	88	50.5 Å²	50.5	62%	0.615	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-1.5	172.4	76	0	0	0	0	113.8	E59 L60 I61	E59-S63 VanDerWaalsContact O-CB 3.31Å; E59-S63 WeakPolarHBondContact O-CB 3.35Å; E59-S63 PolarHBondContact O-N 3.04Å; L60-S63 PolarHBondContact O-N 3.47Å; L60-S63 PolarHBondContact O-OG 2.92Å; I61-S63 PolarHBondContact O-N 2.94Å
64	G	90.6	Very high	94.5	Very high	49 Å²	49	51.1 Å²	51.1	51%	0.505	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.7	14.5	179.9	0	0	0	0	0	113.9	I61 N62 H66	I61-G64 PolarHBondContact O-N 3.01Å; N62-G64 PolarHBondContact O-N 3.3Å; G64-H66 PolarHBondContact O-N 3.18Å
65	A	92.1	Very high	94.4	Very high	6 Å²	6	58.8 Å²	58.8	5%	0.05	30%	0.295	C	S	.	.			trans	-63.9	123.7	173.4	0	0	0	0	0	109.9	L60 E67 I68	L60-A65 WeakPolarHBondContact O-CB 3.01Å; L60-A65 PolarHBondContact O-N 2.81Å; A65-E67 VanDerWaalsContact C-N 3.29Å; A65-I68 HydrophobicContact CB-CG2 4.14Å
66	H	92.4	Very high	94.3	Very high	73 Å²	73	51.8 Å²	51.8	34%	0.338	27%	0.271	S	S	.	.	S	Bend	trans	-64.1	-38.2	174	169.5	-121.1	0	0	0	111.8	G64 N135 L138 F139	G64-H66 PolarHBondContact O-N 3.18Å; H66-N135 PolarHBondContact O-N 2.9Å; H66-L138 HydrophobicContact CB-CD1 4.44Å; H66-F139 HydrophobicContact CB-CE2 4.43Å; H66-F139 AromaticContact CD2-CD2 3.58Å; H66-F139 AromaticContact CD2-CE2 3.01Å; H66-F139 WeakPolarHBondContact CD2-CE2 3.38Å; H66-F139 AromaticContact CD2-CZ 3.92Å; H66-F139 AromaticContact CG-CE2 3.77Å; H66-F139 AromaticContact NE2-CD2 3.67Å; H66-F139 AromaticContact NE2-CE2 3.43Å; H66-F139 WeakPolarHBondContact NE2-CE2 3.45Å
67	E	93.7	Very high	94.4	Very high	50 Å²	50	46.6 Å²	46.6	23%	0.234	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	149.1	-178.9	60.8	-173.2	-137.7	0	0	111.6	H40 A65 F69 K132 I133 L134	H40-E67 WeakPolarHBondContact CB-O 3.18Å; A65-E67 VanDerWaalsContact C-N 3.29Å; E67-F69 HydrophobicContact CG-CE2 4.05Å; E67-F69 HydrophobicContact CG-CZ 4.4Å; E67-F69 VanDerWaalsContact OE1-CE2 3.28Å; E67-F69 WeakPolarHBondContact OE1-CE2 3.33Å; E67-F69 WeakPolarHBondContact OE1-CZ 3.43Å; E67-K132 IonicContact OE1-NZ 3.26Å; E67-K132 WeakPolarHBondContact OE2-CE 3.18Å; E67-K132 IonicContact OE2-NZ 3.41Å; E67-K132 PolarHBondContact OE2-NZ 2.75Å; E67-I133 CarbonylContact C-O 3.51Å; E67-I133 WeakPolarHBondContact CA-O 3.49Å; E67-L134 HydrophobicContact CB-CD2 4.13Å
68	I	95.8	Very high	94.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	150.6	169.1	63.7	167.1	0	0	0	109.9	I42 C57 L60 I61 A65 L70 L87 I133	I42-I68 HydrophobicContact CD1-CD1 4.06Å; C57-I68 HydrophobicContact CB-CD1 3.87Å; L60-I68 HydrophobicContact CB-CG2 3.97Å; I61-I68 HydrophobicContact CD1-CD1 3.71Å; I61-I68 HydrophobicContact CD1-CG1 4.32Å; I61-I68 HydrophobicContact CG1-CD1 3.91Å; I61-I68 HydrophobicContact CG1-CG1 4.27Å; I61-I68 HydrophobicContact CG1-CG2 4.36Å; A65-I68 HydrophobicContact CB-CG2 4.14Å; I68-L70 HydrophobicContact CD1-CD2 4.19Å; I68-L87 HydrophobicContact CD1-CD1 4.43Å; I68-I133 HydrophobicContact CD1-CB 4.42Å; I68-I133 HydrophobicContact CG1-CB 3.75Å; I68-I133 HydrophobicContact CG1-CG1 4.2Å; I68-I133 HydrophobicContact CG1-CG2 4.44Å; I68-I133 PolarHBondContact N-O 2.8Å; I68-I133 PolarHBondContact O-N 2.86Å
69	F	96	Very high	94.5	Very high	50 Å²	50	51.7 Å²	51.7	22%	0.219	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	117.6	-179.4	-64.7	-85.5	0	0	0	110.4	H40 I42 E67 I131 K132	H40-F69 PolarHBondContact O-N 3.3Å; I42-F69 PolarHBondContact N-O 3.47Å; E67-F69 HydrophobicContact CG-CE2 4.05Å; E67-F69 HydrophobicContact CG-CZ 4.4Å; E67-F69 VanDerWaalsContact OE1-CE2 3.28Å; E67-F69 WeakPolarHBondContact OE1-CE2 3.33Å; E67-F69 WeakPolarHBondContact OE1-CZ 3.43Å; F69-I131 CarbonylContact C-O 3.54Å; F69-I131 WeakPolarHBondContact CA-O 3.4Å; F69-K132 HydrophobicContact CD1-CB 4.09Å; F69-K132 HydrophobicContact CD1-CG 4.14Å; F69-K132 HydrophobicContact CE1-CB 3.94Å; F69-K132 HydrophobicContact CE1-CD 3.85Å; F69-K132 HydrophobicContact CE1-CG 3.63Å; F69-K132 HydrophobicContact CZ-CD 4.19Å; F69-K132 HydrophobicContact CZ-CG 4.16Å
70	L	96.7	Very high	94.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118.1	172.8	-47.3	-177.6	0	0	0	109.7	I42 I44 I68 I83 A84 L87 H130 I131 I133	I42-L70 HydrophobicContact CB-CD2 3.82Å; I42-L70 HydrophobicContact CD1-CD2 3.8Å; I42-L70 HydrophobicContact CG1-CD2 4.26Å; I42-L70 HydrophobicContact CG2-CD2 4.29Å; I42-L70 CarbonylContact O-C 3.58Å; I42-L70 WeakPolarHBondContact O-CA 3.18Å; I44-L70 HydrophobicContact CD1-CD2 4.44Å; I44-L70 HydrophobicContact CG1-CB 4.32Å; I68-L70 HydrophobicContact CD1-CD2 4.19Å; L70-I83 HydrophobicContact CD1-CG2 4.22Å; L70-A84 HydrophobicContact CD1-CB 4.09Å; L70-L87 HydrophobicContact CD1-CD1 4.46Å; L70-H130 WeakPolarHBondContact O-CA 3.2Å; L70-I131 HydrophobicContact CB-CB 4.1Å; L70-I131 PolarHBondContact N-O 3.1Å; L70-I131 PolarHBondContact O-N 3.43Å; L70-I133 HydrophobicContact CD1-CG1 4.44Å
71	H	96.1	Very high	94.7	Very high	30 Å²	30	48.2 Å²	48.2	14%	0.139	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	120.5	177.8	-61.5	-67.7	0	0	0	110.8	N41 I42 Y43 I44 H130	N41-H71 PolarHBondContact OD1-NE2 3.29Å; I42-H71 PolarHBondContact O-N 2.84Å; Y43-H71 HydrophobicContact CD1-CB 3.63Å; Y43-H71 HydrophobicContact CE1-CB 3.93Å; Y43-H71 HydrophobicContact CG-CB 4.26Å; I44-H71 PolarHBondContact N-O 3.24Å; H71-H130 AromaticContact CE1-ND1 3.48Å; H71-H130 PolarHBondContact CE1-ND1 3.25Å; H71-H130 AromaticContact ND1-CE1 3.74Å; H71-H130 AromaticContact ND1-CG 3.89Å; H71-H130 AromaticContact ND1-ND1 2.96Å; H71-H130 PolarHBondContact ND1-ND1 3.02Å
72	C	95.7	Very high	94.9	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.014	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	143.2	-175.9	-42	0	0	0	0	109.5	V77 G80 A128 L129	C72-V77 HydrophobicContact CB-CG2 4.16Å; C72-G80 VanDerWaalsContact SG-CA 3.59Å; C72-A128 CarbonylContact O-C 3.6Å; C72-A128 VanDerWaalsContact O-CA 3.24Å; C72-A128 WeakPolarHBondContact O-CA 3.34Å; C72-L129 PolarHBondContact N-O 3.41Å; C72-L129 PolarHBondContact O-N 3.34Å
73	M	95.3	Very high	95.1	Very high	48 Å²	48	44.7 Å²	44.7	24%	0.236	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	136.7	-179.7	-65	177.3	-68.4	0	0	111.1	P31 F75 S76 V104 S127 A128	P31-M73 HydrophobicContact CB-CE 3.94Å; P31-M73 HydrophobicContact CB-SD 4.13Å; P31-M73 HydrophobicContact CG-CE 3.43Å; P31-M73 VanDerWaalsContact CG-CE 3.43Å; P31-M73 HydrophobicContact CG-SD 4.12Å; M73-F75 PolarHBondContact O-N 2.81Å; M73-F75 VanDerWaalsContact O-N 3.11Å; M73-S76 PolarHBondContact N-OG 3.26Å; M73-S76 PolarHBondContact O-N 3.38Å; M73-S76 PolarHBondContact O-OG 3.24Å; M73-S76 VanDerWaalsContact O-OG 3.12Å; M73-V104 HydrophobicContact CG-CG2 4.32Å; M73-V104 HydrophobicContact SD-CB 3.96Å; M73-V104 HydrophobicContact SD-CG1 3.84Å; M73-V104 HydrophobicContact SD-CG2 3.88Å; M73-S127 WeakPolarHBondContact CA-O 3.46Å; M73-A128 HydrophobicContact CG-CB 3.77Å
74	G	94.9	Very high	95.4	Very high	24 Å²	24	40.9 Å²	40.9	25%	0.247	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	46.3	-115.9	179.3	0	0	0	0	0	112.3	S76 V77 N126 S127	G74-S76 PolarHBondContact O-N 3.3Å; G74-S76 VanDerWaalsContact O-N 3.13Å; G74-V77 WeakPolarHBondContact O-CB 3.46Å; G74-V77 VanDerWaalsContact O-CG2 3.26Å; G74-V77 WeakPolarHBondContact O-CG2 3.47Å; G74-V77 PolarHBondContact O-N 3.04Å; G74-V77 VanDerWaalsContact O-N 3.11Å; G74-N126 WeakPolarHBondContact CA-OD1 3.33Å; G74-N126 PolarHBondContact N-ND2 3.38Å; G74-S127 PolarHBondContact N-O 2.96Å
75	F	93.4	Very high	95.7	Very high	182 Å²	182	42.3 Å²	42.3	80%	0.798	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-60.5	-24	-176.5	-171.5	-102.9	0	0	0	114.5	M73 V77	M73-F75 PolarHBondContact O-N 2.81Å; M73-F75 VanDerWaalsContact O-N 3.11Å; F75-V77 VanDerWaalsContact C-N 3.32Å
76	S	95.4	Very high	95.9	Very high	11 Å²	11	47.5 Å²	47.5	8%	0.077	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-83	-5	179.2	70.5	0	0	0	0	114.3	I44 M73 G74 R79 G80	I44-S76 VanDerWaalsContact O-CB 3.25Å; I44-S76 WeakPolarHBondContact O-CB 3.31Å; I44-S76 PolarHBondContact O-OG 2.9Å; M73-S76 PolarHBondContact N-OG 3.26Å; M73-S76 PolarHBondContact O-N 3.38Å; M73-S76 PolarHBondContact O-OG 3.24Å; M73-S76 VanDerWaalsContact O-OG 3.12Å; G74-S76 PolarHBondContact O-N 3.3Å; G74-S76 VanDerWaalsContact O-N 3.13Å; S76-R79 PolarHBondContact O-N 3.3Å; S76-G80 PolarHBondContact O-N 3.15Å
77	V	96.6	Very high	96.1	Very high	29 Å²	29	44.2 Å²	44.2	18%	0.176	22%	0.22	C	C	.	.	H	α-helix	trans	-59.5	-50.6	-178.8	171.9	0	0	0	0	111.9	C72 G74 F75 R79 G80 L81 L129	C72-V77 HydrophobicContact CB-CG2 4.16Å; G74-V77 WeakPolarHBondContact O-CB 3.46Å; G74-V77 VanDerWaalsContact O-CG2 3.26Å; G74-V77 WeakPolarHBondContact O-CG2 3.47Å; G74-V77 PolarHBondContact O-N 3.04Å; G74-V77 VanDerWaalsContact O-N 3.11Å; F75-V77 VanDerWaalsContact C-N 3.32Å; V77-R79 VanDerWaalsContact C-N 3.26Å; V77-R79 PolarHBondContact O-N 3.29Å; V77-G80 PolarHBondContact O-N 3.17Å; V77-G80 VanDerWaalsContact O-N 3.16Å; V77-L81 HydrophobicContact CG1-CD1 4.08Å; V77-L81 PolarHBondContact O-N 3.09Å; V77-L129 HydrophobicContact CG1-CB 4.09Å; V77-L129 HydrophobicContact CG1-CD1 3.71Å; V77-L129 HydrophobicContact CG2-CB 4.15Å
78	T	96.4	Very high	96.1	Very high	96 Å²	96	43.3 Å²	43.3	59%	0.589	22%	0.218	S	C	*	.	H	α-helix	trans	-59.2	-40.2	178.4	-51.1	0	0	0	0	111.7	N82	T78-N82 VanDerWaalsContact O-CG 3.26Å; T78-N82 PolarHBondContact O-N 3.32Å
79	R	96.3	Very high	96.1	Very high	69 Å²	69	50 Å²	50	26%	0.26	25%	0.249	S	C	.	.	H	α-helix	trans	-64	-45.7	176.9	178.2	176.3	-74.1	-151.4	-1.8	111.6	I44 T45 S46 T48 F50 S76 V77 N82 I83	I44-R79 HydrophobicContact CG2-CB 4.33Å; I44-R79 HydrophobicContact CG2-CG 3.98Å; T45-R79 PolarHBondContact O-NH1 3.43Å; S46-R79 PolarHBondContact O-NH1 3.22Å; S46-R79 PolarHBondContact O-NH2 3.33Å; T48-R79 PolarHBondContact O-NH1 3.42Å; F50-R79 HydrophobicContact CD2-CG 4.01Å; F50-R79 HydrophobicContact CE2-CG 4.28Å; S76-R79 PolarHBondContact O-N 3.3Å; V77-R79 VanDerWaalsContact C-N 3.26Å; V77-R79 PolarHBondContact O-N 3.29Å; R79-N82 PolarHBondContact O-N 3.26Å; R79-I83 HydrophobicContact CG-CD1 4.23Å; R79-I83 WeakPolarHBondContact O-CG1 3.15Å; R79-I83 PolarHBondContact O-N 2.92Å
80	G	96.9	Very high	96	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.7	-40.5	179.7	0	0	0	0	0	113.2	C72 S76 V77 N82 I83 A84	C72-G80 VanDerWaalsContact SG-CA 3.59Å; S76-G80 PolarHBondContact O-N 3.15Å; V77-G80 PolarHBondContact O-N 3.17Å; V77-G80 VanDerWaalsContact O-N 3.16Å; G80-N82 VanDerWaalsContact C-N 3.35Å; G80-N82 PolarHBondContact O-N 2.94Å; G80-I83 PolarHBondContact O-N 3.16Å; G80-A84 PolarHBondContact O-N 3.31Å
81	L	97.1	Very high	95.7	Very high	54 Å²	54	53.5 Å²	53.5	28%	0.283	27%	0.272	S	S	.	.	H	α-helix	trans	-59.5	-45.2	172.1	-75.1	171.4	0	0	0	111.6	V77 I83 A84 L85 I99 L129 I131	V77-L81 HydrophobicContact CG1-CD1 4.08Å; V77-L81 PolarHBondContact O-N 3.09Å; L81-I83 VanDerWaalsContact C-N 3.31Å; L81-I83 PolarHBondContact O-N 3.25Å; L81-A84 PolarHBondContact O-N 2.98Å; L81-L85 WeakPolarHBondContact O-CB 3.18Å; L81-L85 VanDerWaalsContact O-CG 3.31Å; L81-L85 WeakPolarHBondContact O-CG 3.43Å; L81-L85 PolarHBondContact O-N 2.87Å; L81-I99 HydrophobicContact CD2-CD1 4.12Å; L81-L129 HydrophobicContact CD1-CD1 4.18Å; L81-L129 HydrophobicContact CD2-CD1 4.02Å; L81-L129 HydrophobicContact CD2-CD2 4.32Å; L81-L129 HydrophobicContact CG-CD1 4.19Å; L81-I131 HydrophobicContact CD2-CD1 4.04Å
82	N	97.2	Very high	95.4	Very high	78 Å²	78	59.9 Å²	59.9	42%	0.417	31%	0.307	S	S	.	.	H	α-helix	trans	-62.3	-38.2	177.7	-72.4	-8.9	0	0	0	112.6	F50 T78 R79 G80 R86	F50-N82 HydrophobicContact CE2-CB 4.05Å; F50-N82 HydrophobicContact CZ-CB 4.26Å; T78-N82 VanDerWaalsContact O-CG 3.26Å; T78-N82 PolarHBondContact O-N 3.32Å; R79-N82 PolarHBondContact O-N 3.26Å; G80-N82 VanDerWaalsContact C-N 3.35Å; G80-N82 PolarHBondContact O-N 2.94Å; N82-R86 WeakPolarHBondContact O-CG 3.43Å; N82-R86 PolarHBondContact O-N 2.81Å; N82-R86 VanDerWaalsContact O-N 3.12Å
83	I	97.3	Very high	95.2	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-64.1	-50.6	174.2	-68.1	168.6	0	0	0	109.9	I44 F50 Q53 L70 R79 G80 L81 L85 R86 L87	I44-I83 HydrophobicContact CD1-CD1 4.01Å; I44-I83 HydrophobicContact CG2-CD1 4.34Å; F50-I83 HydrophobicContact CD2-CD1 4.5Å; F50-I83 HydrophobicContact CD2-CG1 4.17Å; F50-I83 HydrophobicContact CE1-CG1 4.48Å; F50-I83 HydrophobicContact CE2-CD1 4.29Å; F50-I83 HydrophobicContact CE2-CG1 3.52Å; F50-I83 HydrophobicContact CZ-CG1 3.7Å; Q53-I83 HydrophobicContact CB-CD1 3.89Å; L70-I83 HydrophobicContact CD1-CG2 4.22Å; R79-I83 HydrophobicContact CG-CD1 4.23Å; R79-I83 WeakPolarHBondContact O-CG1 3.15Å; R79-I83 PolarHBondContact O-N 2.92Å; G80-I83 PolarHBondContact O-N 3.16Å; L81-I83 VanDerWaalsContact C-N 3.31Å; L81-I83 PolarHBondContact O-N 3.25Å; I83-L85 VanDerWaalsContact C-N 3.35Å; I83-L85 PolarHBondContact O-N 3.22Å; I83-R86 PolarHBondContact O-N 2.88Å; I83-L87 HydrophobicContact CG2-CD1 4.02Å; I83-L87 HydrophobicContact CG2-CG 4.39Å; I83-L87 WeakPolarHBondContact O-CG 2.82Å; I83-L87 PolarHBondContact O-N 2.68Å
84	A	97.3	Very high	95	Very high	7 Å²	7	61.4 Å²	61.4	6%	0.058	33%	0.333	C	S	.	.	H	α-helix	trans	-56.6	-46.7	179.5	0	0	0	0	0	112.5	L70 G80 L81 R86 L87 V88 I131 I133	L70-A84 HydrophobicContact CD1-CB 4.09Å; G80-A84 PolarHBondContact O-N 3.31Å; L81-A84 PolarHBondContact O-N 2.98Å; A84-R86 PolarHBondContact O-N 2.67Å; A84-L87 PolarHBondContact O-N 2.65Å; A84-V88 WeakPolarHBondContact O-CG2 3.48Å; A84-V88 PolarHBondContact O-N 3.21Å; A84-V88 VanDerWaalsContact O-N 3.1Å; A84-I131 HydrophobicContact CB-CD1 3.62Å; A84-I131 HydrophobicContact CB-CG2 4Å; A84-I133 HydrophobicContact CB-CD1 4.08Å
85	L	96.8	Very high	95.1	Very high	79 Å²	79	61.1 Å²	61.1	41%	0.414	33%	0.326	S	S	.	.	H	α-helix	trans	-63	-41.4	179	-70.6	173.3	0	0	0	111.9	L81 I83 V88 Q89	L81-L85 WeakPolarHBondContact O-CB 3.18Å; L81-L85 VanDerWaalsContact O-CG 3.31Å; L81-L85 WeakPolarHBondContact O-CG 3.43Å; L81-L85 PolarHBondContact O-N 2.87Å; I83-L85 VanDerWaalsContact C-N 3.35Å; I83-L85 PolarHBondContact O-N 3.22Å; L85-V88 PolarHBondContact O-N 2.73Å; L85-Q89 VanDerWaalsContact O-CB 3.29Å; L85-Q89 WeakPolarHBondContact O-CB 3.13Å; L85-Q89 WeakPolarHBondContact O-CG 3.25Å; L85-Q89 PolarHBondContact O-N 3.11Å
86	R	96.2	Very high	95.1	Very high	115 Å²	115	54.2 Å²	54.2	43%	0.434	30%	0.3	S	S	.	.	H	α-helix	trans	-64.8	-41.1	176.4	-77.1	-172.2	179.9	-172.1	0.5	112.7	N82 I83 A84 V88 Q89 N90	N82-R86 WeakPolarHBondContact O-CG 3.43Å; N82-R86 PolarHBondContact O-N 2.81Å; N82-R86 VanDerWaalsContact O-N 3.12Å; I83-R86 PolarHBondContact O-N 2.88Å; A84-R86 PolarHBondContact O-N 2.67Å; R86-V88 VanDerWaalsContact C-N 3.34Å; R86-V88 PolarHBondContact O-N 2.9Å; R86-Q89 PolarHBondContact O-N 3.48Å; R86-N90 VanDerWaalsContact O-CB 3.27Å; R86-N90 WeakPolarHBondContact O-CB 3.43Å; R86-N90 PolarHBondContact O-N 3.43Å; R86-N90 PolarHBondContact O-ND2 3.12Å; R86-N90 PolarHBondContact O-OD1 2.85Å
87	L	96.2	Very high	95.2	Very high	5 Å²	5	59.6 Å²	59.6	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-58.3	-49.3	176.2	-69	170.3	0	0	0	110.7	Q54 C57 E58 I61 I68 L70 I83 A84 N90 S91 L95	Q54-L87 HydrophobicContact CG-CD2 4.45Å; C57-L87 HydrophobicContact CB-CD1 3.61Å; C57-L87 HydrophobicContact CB-CD2 4Å; C57-L87 HydrophobicContact CB-CG 4.41Å; E58-L87 HydrophobicContact CG-CD2 3.43Å; E58-L87 VanDerWaalsContact CG-CD2 3.43Å; I61-L87 HydrophobicContact CD1-CD1 4.46Å; I61-L87 HydrophobicContact CD1-CD2 4.42Å; I68-L87 HydrophobicContact CD1-CD1 4.43Å; L70-L87 HydrophobicContact CD1-CD1 4.46Å; I83-L87 HydrophobicContact CG2-CD1 4.02Å; I83-L87 HydrophobicContact CG2-CG 4.39Å; I83-L87 WeakPolarHBondContact O-CG 2.82Å; I83-L87 PolarHBondContact O-N 2.68Å; A84-L87 PolarHBondContact O-N 2.65Å; L87-N90 PolarHBondContact O-N 2.9Å; L87-S91 WeakPolarHBondContact O-CB 3.37Å; L87-S91 PolarHBondContact O-N 2.82Å; L87-L95 HydrophobicContact CB-CD1 4.24Å
88	V	95.2	Very high	95.2	Very high	31 Å²	31	60.4 Å²	60.4	19%	0.188	33%	0.329	C	S	.	.	H	α-helix	trans	-65.4	-45.7	-179.3	175	0	0	0	0	111	A84 L85 R86 N90 S91 L95 Y97 I133	A84-V88 WeakPolarHBondContact O-CG2 3.48Å; A84-V88 PolarHBondContact O-N 3.21Å; A84-V88 VanDerWaalsContact O-N 3.1Å; L85-V88 PolarHBondContact O-N 2.73Å; R86-V88 VanDerWaalsContact C-N 3.34Å; R86-V88 PolarHBondContact O-N 2.9Å; V88-N90 VanDerWaalsContact C-N 3.32Å; V88-N90 PolarHBondContact O-N 3.03Å; V88-S91 PolarHBondContact O-N 2.78Å; V88-S91 PolarHBondContact O-OG 3.46Å; V88-L95 HydrophobicContact CG2-CB 4.35Å; V88-Y97 HydrophobicContact CG1-CD1 4.35Å; V88-Y97 HydrophobicContact CG2-CD1 3.83Å; V88-I133 HydrophobicContact CG2-CD1 4.41Å
89	Q	94.6	Very high	95.3	Very high	141 Å²	141	59.2 Å²	59.2	66%	0.659	32%	0.319	S	S	*	.	H	α-helix	trans	-60.8	-37.6	178	-76.2	173.2	-14	0	0	113.1	L85 R86 S91	L85-Q89 VanDerWaalsContact O-CB 3.29Å; L85-Q89 WeakPolarHBondContact O-CB 3.13Å; L85-Q89 WeakPolarHBondContact O-CG 3.25Å; L85-Q89 PolarHBondContact O-N 3.11Å; R86-Q89 PolarHBondContact O-N 3.48Å; Q89-S91 VanDerWaalsContact C-N 3.26Å; Q89-S91 PolarHBondContact O-N 2.98Å
90	N	93.6	Very high	95.3	Very high	102 Å²	102	61.5 Å²	61.5	55%	0.545	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-3.3	-179.1	-66.7	-9.1	0	0	0	113.5	R86 L87 V88	R86-N90 VanDerWaalsContact O-CB 3.27Å; R86-N90 WeakPolarHBondContact O-CB 3.43Å; R86-N90 PolarHBondContact O-N 3.43Å; R86-N90 PolarHBondContact O-ND2 3.12Å; R86-N90 PolarHBondContact O-OD1 2.85Å; L87-N90 PolarHBondContact O-N 2.9Å; V88-N90 VanDerWaalsContact C-N 3.32Å; V88-N90 PolarHBondContact O-N 3.03Å
91	S	91.8	Very high	95.4	Very high	21 Å²	21	67.2 Å²	67.2	15%	0.147	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	1.3	-172.5	72.8	0	0	0	0	114.8	L87 V88 Q89 G93 A94 L95	L87-S91 WeakPolarHBondContact O-CB 3.37Å; L87-S91 PolarHBondContact O-N 2.82Å; V88-S91 PolarHBondContact O-N 2.78Å; V88-S91 PolarHBondContact O-OG 3.46Å; Q89-S91 VanDerWaalsContact C-N 3.26Å; Q89-S91 PolarHBondContact O-N 2.98Å; S91-G93 PolarHBondContact O-N 2.77Å; S91-A94 WeakPolarHBondContact O-CB 3.39Å; S91-A94 PolarHBondContact O-N 2.86Å; S91-L95 WeakPolarHBondContact OG-CB 3.5Å; S91-L95 PolarHBondContact OG-N 3.43Å; S91-L95 VanDerWaalsContact OG-N 3.14Å
92	D	89.7	Confident	95.3	Very high	163 Å²	163	66.8 Å²	66.8	87%	0.872	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	34.8	-176.6	-63.4	-31.8	0	0	0	113.7
93	G	90.3	Very high	95.3	Very high	59 Å²	59	67.6 Å²	67.6	61%	0.608	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	-0.6	179.6	0	0	0	0	0	115.4	S91 L95	S91-G93 PolarHBondContact O-N 2.77Å; G93-L95 VanDerWaalsContact C-N 3.3Å; G93-L95 PolarHBondContact O-N 3.16Å
94	A	92.6	Very high	95.2	Very high	24 Å²	24	68.8 Å²	68.8	20%	0.198	39%	0.388	C	S	.	.			trans	-68.1	-26.6	177.2	0	0	0	0	0	113.6	S91 N136 S137	S91-A94 WeakPolarHBondContact O-CB 3.39Å; S91-A94 PolarHBondContact O-N 2.86Å; A94-N136 WeakPolarHBondContact O-CB 3.47Å; A94-N136 PolarHBondContact O-N 3.26Å; A94-S137 WeakPolarHBondContact CB-OG 2.74Å
95	L	95.4	Very high	95.1	Very high	17 Å²	17	74.7 Å²	74.7	9%	0.089	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	138.3	-177.9	-57.6	179.3	0	0	0	112.4	I61 L87 V88 S91 G93 I133 L134 N135	I61-L95 HydrophobicContact CD1-CD1 3.8Å; I61-L95 HydrophobicContact CD1-CD2 4.49Å; I61-L95 HydrophobicContact CG2-CD2 3.99Å; L87-L95 HydrophobicContact CB-CD1 4.24Å; V88-L95 HydrophobicContact CG2-CB 4.35Å; S91-L95 WeakPolarHBondContact OG-CB 3.5Å; S91-L95 PolarHBondContact OG-N 3.43Å; S91-L95 VanDerWaalsContact OG-N 3.14Å; G93-L95 VanDerWaalsContact C-N 3.3Å; G93-L95 PolarHBondContact O-N 3.16Å; L95-I133 HydrophobicContact CB-CG2 4.23Å; L95-I133 HydrophobicContact CD1-CG2 4.12Å; L95-I133 HydrophobicContact CD2-CG2 4.38Å; L95-I133 HydrophobicContact CG-CG2 4.48Å; L95-L134 VanDerWaalsContact CA-O 3.3Å; L95-L134 WeakPolarHBondContact CA-O 3.26Å; L95-N135 HydrophobicContact CD2-CB 3.86Å
96	S	95.1	Very high	95	Very high	37 Å²	37	71.6 Å²	71.6	26%	0.259	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	167.1	168.3	67.4	0	0	0	0	111.1	I133 L134 N136	S96-I133 WeakPolarHBondContact O-CA 3.47Å; S96-L134 PolarHBondContact N-O 2.74Å; S96-L134 PolarHBondContact O-N 2.81Å; S96-L134 WeakPolarHBondContact OG-CB 3.45Å; S96-N136 PolarHBondContact OG-OD1 3.13Å
97	Y	96.4	Very high	94.9	Very high	125 Å²	125	68.2 Å²	68.2	49%	0.49	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	150.8	-178.6	66.4	-91.2	0	0	0	113.3	V88 I99 K132	V88-Y97 HydrophobicContact CG1-CD1 4.35Å; V88-Y97 HydrophobicContact CG2-CD1 3.83Å; Y97-I99 HydrophobicContact CD2-CD1 3.98Å; Y97-I99 HydrophobicContact CD2-CG1 4.06Å; Y97-I99 HydrophobicContact CE2-CD1 4Å; Y97-K132 CarbonylContact C-O 3.55Å; Y97-K132 WeakPolarHBondContact CA-O 3.47Å
98	A	97	Very high	94.9	Very high	46 Å²	46	68.1 Å²	68.1	38%	0.38	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.7	168.8	0	0	0	0	0	109.7	K132	A98-K132 HydrophobicContact CB-CB 4.35Å; A98-K132 PolarHBondContact N-O 3.05Å; A98-K132 PolarHBondContact O-N 2.74Å
99	I	97.3	Very high	94.9	Very high	71 Å²	71	68.7 Å²	68.7	36%	0.364	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	129.6	-173.8	-64.6	171.3	0	0	0	109.9	L81 Y97 L129 H130 I131	L81-I99 HydrophobicContact CD2-CD1 4.12Å; Y97-I99 HydrophobicContact CD2-CD1 3.98Å; Y97-I99 HydrophobicContact CD2-CG1 4.06Å; Y97-I99 HydrophobicContact CE2-CD1 4Å; I99-L129 HydrophobicContact CG2-CD1 4.1Å; I99-L129 HydrophobicContact CG2-CD2 3.61Å; I99-L129 HydrophobicContact CG2-CG 3.78Å; I99-H130 WeakPolarHBondContact CA-O 3.46Å; I99-I131 HydrophobicContact CG1-CG1 4.38Å; I99-I131 HydrophobicContact CG1-CG2 4.22Å
100	N	97.6	Very high	94.8	Very high	116 Å²	116	62.9 Å²	62.9	62%	0.62	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	141.7	170.4	-69.7	-31.2	0	0	0	110.5	H130	N100-H130 HydrophobicContact CB-CB 4.36Å; N100-H130 PolarHBondContact N-O 2.74Å; N100-H130 PolarHBondContact O-N 2.98Å
101	T	97.7	Very high	94.8	Very high	120 Å²	120	60.7 Å²	60.7	74%	0.736	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	145.4	173.3	57.7	0	0	0	0	110.4	A128	T101-A128 WeakPolarHBondContact CA-O 3.44Å
102	S	96.6	Very high	94.9	Very high	46 Å²	46	61 Å²	61	32%	0.322	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	175.9	172.2	81.1	0	0	0	0	111.5	A128 H130	S102-A128 PolarHBondContact N-O 3.04Å; S102-A128 PolarHBondContact O-N 3.27Å; S102-H130 PolarHBondContact OG-NE2 3.29Å
103	T	96.4	Very high	94.9	Very high	94 Å²	94	59.1 Å²	59.1	58%	0.577	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.3	170.1	-61.9	0	0	0	0	108.9	N125	T103-N125 HydrophobicContact CG2-CB 3.77Å
104	V	95	Very high	94.8	Very high	26 Å²	26	59.8 Å²	59.8	16%	0.158	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124	176.8	178.3	0	0	0	0	109.2	P31 M73 L106 N126 A128	P31-V104 HydrophobicContact CB-CG1 4.3Å; M73-V104 HydrophobicContact CG-CG2 4.32Å; M73-V104 HydrophobicContact SD-CB 3.96Å; M73-V104 HydrophobicContact SD-CG1 3.84Å; M73-V104 HydrophobicContact SD-CG2 3.88Å; V104-L106 HydrophobicContact CG1-CD2 3.81Å; V104-L106 HydrophobicContact CG1-CG 4.45Å; V104-N126 PolarHBondContact N-O 2.86Å; V104-N126 PolarHBondContact O-N 2.96Å; V104-A128 HydrophobicContact CG2-CB 3.6Å
105	Q	95.3	Very high	94.6	Very high	131 Å²	131	66.9 Å²	66.9	61%	0.612	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	130	172.4	-61.3	-175.9	-0.3	0	0	109.5
106	L	95	Very high	94.3	Very high	14 Å²	14	70.6 Å²	70.6	7%	0.073	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	140.5	-176.7	-58.8	177.6	0	0	0	109.6	P31 V104 Q123 R124 N126	P31-L106 HydrophobicContact CB-CD2 3.67Å; P31-L106 HydrophobicContact CG-CD2 3.71Å; V104-L106 HydrophobicContact CG1-CD2 3.81Å; V104-L106 HydrophobicContact CG1-CG 4.45Å; L106-Q123 CarbonylContact O-C 3.54Å; L106-Q123 WeakPolarHBondContact O-CA 3.24Å; L106-Q123 PolarHBondContact O-OE1 2.97Å; L106-R124 HydrophobicContact CB-CB 4.45Å; L106-R124 PolarHBondContact N-O 2.96Å; L106-R124 PolarHBondContact O-N 2.91Å; L106-N126 HydrophobicContact CD1-CB 3.86Å
107	V	94.8	Very high	94.1	Very high	43 Å²	43	74.4 Å²	74.4	26%	0.261	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127.9	176.4	-167.4	0	0	0	0	109.3	K29 F121	K29-V107 WeakPolarHBondContact CB-O 3.49Å; K29-V107 HydrophobicContact CD-CB 4.34Å; K29-V107 HydrophobicContact CD-CG1 4.46Å; K29-V107 WeakPolarHBondContact CG-O 3.16Å; K29-V107 PolarHBondContact N-O 3.11Å; V107-F121 HydrophobicContact CG1-CB 4.28Å; V107-F121 HydrophobicContact CG1-CD1 3.93Å
108	D	94.5	Very high	93.9	Very high	3 Å²	3	75.3 Å²	75.3	2%	0.016	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	144.1	165.3	-59.1	-20.7	0	0	0	109.6	V26 V27 R28 F121 R122 R124	V26-D108 HydrophobicContact CG1-CB 3.86Å; V27-D108 CarbonylContact O-C 3.41Å; V27-D108 WeakPolarHBondContact O-CA 3.25Å; R28-D108 WeakPolarHBondContact CG-OD1 3.38Å; D108-F121 CarbonylContact O-C 3.59Å; D108-F121 WeakPolarHBondContact O-CA 3.21Å; D108-R122 HydrophobicContact CB-CB 4.44Å; D108-R122 PolarHBondContact N-O 3.48Å; D108-R122 PolarHBondContact O-N 3.1Å; D108-R124 VanDerWaalsContact CG-NE 3.33Å; D108-R124 IonicContact OD1-CZ 3.26Å; D108-R124 IonicContact OD1-NE 3.92Å; D108-R124 PolarHBondContact OD1-NE 2.83Å; D108-R124 IonicContact OD1-NH2 3.43Å; D108-R124 PolarHBondContact OD1-NH2 3.48Å; D108-R124 WeakPolarHBondContact OD2-CD 3.28Å; D108-R124 IonicContact OD2-CZ 3.84Å; D108-R124 VanDerWaalsContact OD2-CZ 3.28Å; D108-R124 IonicContact OD2-NE 2.86Å; D108-R124 PolarHBondContact OD2-NE 2.85Å; D108-R124 IonicContact OD2-NH2 3.28Å; D108-R124 PolarHBondContact OD2-NH2 2.92Å
109	E	95.2	Very high	93.7	Very high	43 Å²	43	76.9 Å²	76.9	20%	0.201	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	135.7	164.5	-50.8	-174.6	157.6	0	0	109	V27 K29 H111 I119 F121	V27-E109 HydrophobicContact CB-CB 4.25Å; V27-E109 PolarHBondContact N-O 3.48Å; V27-E109 PolarHBondContact O-N 3.38Å; K29-E109 HydrophobicContact CD-CG 4.44Å; K29-E109 WeakPolarHBondContact CE-OE1 3.41Å; K29-E109 HydrophobicContact CG-CG 4.29Å; K29-E109 IonicContact NZ-OE1 2.72Å; K29-E109 PolarHBondContact NZ-OE1 2.9Å; E109-H111 IonicContact OE2-CD2 2.74Å; E109-H111 IonicContact OE2-CE1 3.72Å; E109-H111 IonicContact OE2-NE2 3.49Å; E109-H111 PolarHBondContact OE2-NE2 2.94Å; E109-I119 HydrophobicContact CB-CG2 4.01Å; E109-F121 HydrophobicContact CG-CD1 4.03Å; E109-F121 HydrophobicContact CG-CE1 3.75Å
110	L	93.8	Very high	93.6	Very high	20 Å²	20	77.3 Å²	77.3	11%	0.105	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	101.5	174.6	-54.5	-177.6	0	0	0	106.8	H24 V26 I119 T120 R122	H24-L110 HydrophobicContact CB-CB 4.14Å; V26-L110 HydrophobicContact CB-CD2 4.35Å; V26-L110 HydrophobicContact CG1-CD2 4.13Å; V26-L110 HydrophobicContact CG2-CD2 3.79Å; L110-I119 WeakPolarHBondContact O-CA 3.49Å; L110-T120 WeakPolarHBondContact CB-OG1 3.43Å; L110-T120 PolarHBondContact N-O 2.96Å; L110-T120 PolarHBondContact O-N 2.83Å; L110-R122 HydrophobicContact CD1-CB 4.07Å; L110-R122 HydrophobicContact CD2-CB 4.38Å; L110-R122 HydrophobicContact CG-CB 4.21Å
111	H	93.7	Very high	93.4	Very high	56 Å²	56	77.9 Å²	77.9	26%	0.259	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	116.6	178.1	-71.9	-116.4	0	0	0	108.1	H24 R25 E109 I119	H24-H111 CarbonylContact C-O 3.55Å; H24-H111 WeakPolarHBondContact CA-O 3.18Å; H24-H111 WeakPolarHBondContact CB-O 3.28Å; R25-H111 HydrophobicContact CB-CB 4.34Å; R25-H111 PolarHBondContact N-O 2.82Å; R25-H111 PolarHBondContact O-N 2.7Å; E109-H111 IonicContact OE2-CD2 2.74Å; E109-H111 IonicContact OE2-CE1 3.72Å; E109-H111 IonicContact OE2-NE2 3.49Å; E109-H111 PolarHBondContact OE2-NE2 2.94Å; H111-I119 VanDerWaalsContact CE1-CD1 3.45Å; H111-I119 WeakPolarHBondContact CE1-CD1 3.42Å
112	P	92.7	Very high	93.2	Very high	28 Å²	28	78.5 Å²	78.5	18%	0.182	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	154.9	-179.9	24.9	-30	0	0	0	111.2	C114 E117	P112-C114 VanDerWaalsContact C-N 3.29Å; P112-E117 HydrophobicContact CB-CB 3.6Å; P112-E117 HydrophobicContact CG-CB 3.69Å; P112-E117 WeakPolarHBondContact CG-O 3.45Å
113	L	90.6	Very high	93.1	Very high	122 Å²	122	81.8 Å²	81.8	64%	0.639	43%	0.433	S	S	*	.	S	Bend	trans	-86.7	-1.5	175.2	-61.5	-177.9	0	0	0	113.1	Q22 N23 R25	Q22-L113 WeakPolarHBondContact O-CD1 3.46Å; N23-L113 WeakPolarHBondContact O-CG 3.4Å; N23-L113 PolarHBondContact O-N 3.02Å; R25-L113 HydrophobicContact CB-CD2 4.34Å
114	C	88.6	Confident	93.1	Very high	73 Å²	73	80.4 Å²	80.4	49%	0.493	42%	0.418	S	S	.	.	S	Bend	trans	-123.8	140.5	178.2	-179.8	0	0	0	0	108.9	P112 A116 E117	P112-C114 VanDerWaalsContact C-N 3.29Å; C114-A116 PolarHBondContact O-N 3.07Å; C114-E117 PolarHBondContact O-N 3.5Å
115	D	87.6	Confident	93.1	Very high	174 Å²	174	84.5 Å²	84.5	93%	0.93	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-8.1	-177.9	-59.9	-28.8	0	0	0	113.6	E117	D115-E117 VanDerWaalsContact C-N 3.33Å
116	A	89.9	Confident	93.1	Very high	94 Å²	94	80.7 Å²	80.7	78%	0.777	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-11.5	179.8	0	0	0	0	0	114	C114	C114-A116 PolarHBondContact O-N 3.07Å
117	E	89.4	Confident	93.2	Very high	117 Å²	117	84 Å²	84	55%	0.547	45%	0.447	S	S	.	.	S	Bend	trans	-112.6	151.1	-178.4	-68.6	-179.9	-170.5	0	0	110.7	P112 C114 D115	P112-E117 HydrophobicContact CB-CB 3.6Å; P112-E117 HydrophobicContact CG-CB 3.69Å; P112-E117 WeakPolarHBondContact CG-O 3.45Å; C114-E117 PolarHBondContact O-N 3.5Å; D115-E117 VanDerWaalsContact C-N 3.33Å
118	D	92.8	Very high	93.3	Very high	144 Å²	144	82.2 Å²	82.2	77%	0.77	44%	0.436	S	S	*	.			trans	-89.3	159.6	175.5	-72.4	-40.9	0	0	0	112.5	T120	D118-T120 PolarHBondContact O-N 3.46Å
119	I	93.5	Very high	93.4	Very high	80 Å²	80	83 Å²	83	41%	0.41	44%	0.44	S	S	.	.			trans	-62.8	125.4	171.8	-61.2	166.8	0	0	0	109.4	E109 L110 H111	E109-I119 HydrophobicContact CB-CG2 4.01Å; L110-I119 WeakPolarHBondContact O-CA 3.49Å; H111-I119 VanDerWaalsContact CE1-CD1 3.45Å; H111-I119 WeakPolarHBondContact CE1-CD1 3.42Å
120	T	93.9	Very high	93.5	Very high	79 Å²	79	83.6 Å²	83.6	49%	0.485	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	163.4	174.9	58.2	0	0	0	0	111.6	L110 D118	L110-T120 WeakPolarHBondContact CB-OG1 3.43Å; L110-T120 PolarHBondContact N-O 2.96Å; L110-T120 PolarHBondContact O-N 2.83Å; D118-T120 PolarHBondContact O-N 3.46Å
121	F	94.4	Very high	93.6	Very high	128 Å²	128	82.7 Å²	82.7	56%	0.561	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	139.6	-178.2	-60.8	-85.5	0	0	0	111.6	V107 D108 E109	V107-F121 HydrophobicContact CG1-CB 4.28Å; V107-F121 HydrophobicContact CG1-CD1 3.93Å; D108-F121 CarbonylContact O-C 3.59Å; D108-F121 WeakPolarHBondContact O-CA 3.21Å; E109-F121 HydrophobicContact CG-CD1 4.03Å; E109-F121 HydrophobicContact CG-CE1 3.75Å
122	R	94.2	Very high	93.8	Very high	133 Å²	133	83 Å²	83	50%	0.502	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.5	174.3	179.2	-178.2	177	176.6	2.3	110.6	D108 L110 R124	D108-R122 HydrophobicContact CB-CB 4.44Å; D108-R122 PolarHBondContact N-O 3.48Å; D108-R122 PolarHBondContact O-N 3.1Å; L110-R122 HydrophobicContact CD1-CB 4.07Å; L110-R122 HydrophobicContact CD2-CB 4.38Å; L110-R122 HydrophobicContact CG-CB 4.21Å; R122-R124 HydrophobicContact CG-CG 4.34Å
123	Q	94.8	Very high	93.9	Very high	116 Å²	116	81.7 Å²	81.7	54%	0.542	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	140.2	170.5	-63.6	-66	-16.1	0	0	110.9	L106	L106-Q123 CarbonylContact O-C 3.54Å; L106-Q123 WeakPolarHBondContact O-CA 3.24Å; L106-Q123 PolarHBondContact O-OE1 2.97Å
124	R	94.6	Very high	94.1	Very high	65 Å²	65	77.6 Å²	77.6	25%	0.245	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	143.4	174.5	-64.9	-171.3	-64.9	124.4	2.1	110.3	L106 D108 R122	L106-R124 HydrophobicContact CB-CB 4.45Å; L106-R124 PolarHBondContact N-O 2.96Å; L106-R124 PolarHBondContact O-N 2.91Å; D108-R124 VanDerWaalsContact CG-NE 3.33Å; D108-R124 IonicContact OD1-CZ 3.26Å; D108-R124 IonicContact OD1-NE 3.92Å; D108-R124 PolarHBondContact OD1-NE 2.83Å; D108-R124 IonicContact OD1-NH2 3.43Å; D108-R124 PolarHBondContact OD1-NH2 3.48Å; D108-R124 WeakPolarHBondContact OD2-CD 3.28Å; D108-R124 IonicContact OD2-CZ 3.84Å; D108-R124 VanDerWaalsContact OD2-CZ 3.28Å; D108-R124 IonicContact OD2-NE 2.86Å; D108-R124 PolarHBondContact OD2-NE 2.85Å; D108-R124 IonicContact OD2-NH2 3.28Å; D108-R124 PolarHBondContact OD2-NH2 2.92Å; R122-R124 HydrophobicContact CG-CG 4.34Å
125	N	95.4	Very high	94.3	Very high	112 Å²	112	75.1 Å²	75.1	60%	0.599	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	137.6	172.2	-66.7	-18.9	0	0	0	109.7	T103	T103-N125 HydrophobicContact CG2-CB 3.77Å
126	N	95.4	Very high	94.4	Very high	51 Å²	51	69.6 Å²	69.6	27%	0.273	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	137.2	174.1	-154	16.8	0	0	0	109.7	G74 V104 L106	G74-N126 WeakPolarHBondContact CA-OD1 3.33Å; G74-N126 PolarHBondContact N-ND2 3.38Å; V104-N126 PolarHBondContact N-O 2.86Å; V104-N126 PolarHBondContact O-N 2.96Å; L106-N126 HydrophobicContact CD1-CB 3.86Å
127	S	96.7	Very high	93.8	Very high	83 Å²	83	68.9 Å²	68.9	58%	0.58	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	140.2	174.1	-46.5	0	0	0	0	109.7	M73 G74	M73-S127 WeakPolarHBondContact CA-O 3.46Å; G74-S127 PolarHBondContact N-O 2.96Å
128	A	97.1	Very high	92.7	Very high	5 Å²	5	67.5 Å²	67.5	4%	0.041	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	151.9	179.8	0	0	0	0	0	111.1	C72 M73 T101 S102 V104	C72-A128 CarbonylContact O-C 3.6Å; C72-A128 VanDerWaalsContact O-CA 3.24Å; C72-A128 WeakPolarHBondContact O-CA 3.34Å; M73-A128 HydrophobicContact CG-CB 3.77Å; T101-A128 WeakPolarHBondContact CA-O 3.44Å; S102-A128 PolarHBondContact N-O 3.04Å; S102-A128 PolarHBondContact O-N 3.27Å; V104-A128 HydrophobicContact CG2-CB 3.6Å
129	L	97	Very high	91.1	Very high	19 Å²	19	66.9 Å²	66.9	10%	0.099	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	126.7	179.5	-162.4	158.4	0	0	0	107.9	C72 V77 L81 I99 I131	C72-L129 PolarHBondContact N-O 3.41Å; C72-L129 PolarHBondContact O-N 3.34Å; V77-L129 HydrophobicContact CG1-CB 4.09Å; V77-L129 HydrophobicContact CG1-CD1 3.71Å; V77-L129 HydrophobicContact CG2-CB 4.15Å; L81-L129 HydrophobicContact CD1-CD1 4.18Å; L81-L129 HydrophobicContact CD2-CD1 4.02Å; L81-L129 HydrophobicContact CD2-CD2 4.32Å; L81-L129 HydrophobicContact CG-CD1 4.19Å; I99-L129 HydrophobicContact CG2-CD1 4.1Å; I99-L129 HydrophobicContact CG2-CD2 3.61Å; I99-L129 HydrophobicContact CG2-CG 3.78Å; L129-I131 HydrophobicContact CD2-CB 4.42Å; L129-I131 HydrophobicContact CD2-CD1 3.69Å; L129-I131 HydrophobicContact CD2-CG1 3.09Å
130	H	96.7	Very high	89.3	Confident	57 Å²	57	69.7 Å²	69.7	26%	0.264	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	110.8	-179.8	-55	-101.8	0	0	0	107.3	L70 H71 I99 N100 S102	L70-H130 WeakPolarHBondContact O-CA 3.2Å; H71-H130 AromaticContact CE1-ND1 3.48Å; H71-H130 PolarHBondContact CE1-ND1 3.25Å; H71-H130 AromaticContact ND1-CE1 3.74Å; H71-H130 AromaticContact ND1-CG 3.89Å; H71-H130 AromaticContact ND1-ND1 2.96Å; H71-H130 PolarHBondContact ND1-ND1 3.02Å; I99-H130 WeakPolarHBondContact CA-O 3.46Å; N100-H130 HydrophobicContact CB-CB 4.36Å; N100-H130 PolarHBondContact N-O 2.74Å; N100-H130 PolarHBondContact O-N 2.98Å; S102-H130 PolarHBondContact OG-NE2 3.29Å
131	I	97.4	Very high	87.3	Confident	1 Å²	1	73 Å²	73	1%	0.005	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	117.6	178.8	-46.7	175.4	0	0	0	107.4	F69 L70 L81 A84 I99 L129 I133	F69-I131 CarbonylContact C-O 3.54Å; F69-I131 WeakPolarHBondContact CA-O 3.4Å; L70-I131 HydrophobicContact CB-CB 4.1Å; L70-I131 PolarHBondContact N-O 3.1Å; L70-I131 PolarHBondContact O-N 3.43Å; L81-I131 HydrophobicContact CD2-CD1 4.04Å; A84-I131 HydrophobicContact CB-CD1 3.62Å; A84-I131 HydrophobicContact CB-CG2 4Å; I99-I131 HydrophobicContact CG1-CG1 4.38Å; I99-I131 HydrophobicContact CG1-CG2 4.22Å; L129-I131 HydrophobicContact CD2-CB 4.42Å; L129-I131 HydrophobicContact CD2-CD1 3.69Å; L129-I131 HydrophobicContact CD2-CG1 3.09Å; I131-I133 HydrophobicContact CG2-CD1 3.64Å; I131-I133 HydrophobicContact CG2-CG1 4.29Å
132	K	96.6	Very high	85.5	Confident	61 Å²	61	71.2 Å²	71.2	27%	0.265	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	122.6	166.5	-174.3	179.8	-171	-179	0	107.7	E67 F69 Y97 A98 L134	E67-K132 IonicContact OE1-NZ 3.26Å; E67-K132 WeakPolarHBondContact OE2-CE 3.18Å; E67-K132 IonicContact OE2-NZ 3.41Å; E67-K132 PolarHBondContact OE2-NZ 2.75Å; F69-K132 HydrophobicContact CD1-CB 4.09Å; F69-K132 HydrophobicContact CD1-CG 4.14Å; F69-K132 HydrophobicContact CE1-CB 3.94Å; F69-K132 HydrophobicContact CE1-CD 3.85Å; F69-K132 HydrophobicContact CE1-CG 3.63Å; F69-K132 HydrophobicContact CZ-CD 4.19Å; F69-K132 HydrophobicContact CZ-CG 4.16Å; Y97-K132 CarbonylContact C-O 3.55Å; Y97-K132 WeakPolarHBondContact CA-O 3.47Å; A98-K132 HydrophobicContact CB-CB 4.35Å; A98-K132 PolarHBondContact N-O 3.05Å; A98-K132 PolarHBondContact O-N 2.74Å; K132-L134 HydrophobicContact CD-CD2 4.32Å; K132-L134 HydrophobicContact CD-CG 4.3Å; K132-L134 HydrophobicContact CG-CG 4.29Å
133	I	96.2	Very high	83.6	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.005	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	127.4	169.7	-54.2	-62.3	0	0	0	107.3	I61 E67 I68 L70 A84 V88 L95 S96 I131	I61-I133 HydrophobicContact CD1-CG2 4.27Å; E67-I133 CarbonylContact C-O 3.51Å; E67-I133 WeakPolarHBondContact CA-O 3.49Å; I68-I133 HydrophobicContact CD1-CB 4.42Å; I68-I133 HydrophobicContact CG1-CB 3.75Å; I68-I133 HydrophobicContact CG1-CG1 4.2Å; I68-I133 HydrophobicContact CG1-CG2 4.44Å; I68-I133 PolarHBondContact N-O 2.8Å; I68-I133 PolarHBondContact O-N 2.86Å; L70-I133 HydrophobicContact CD1-CG1 4.44Å; A84-I133 HydrophobicContact CB-CD1 4.08Å; V88-I133 HydrophobicContact CG2-CD1 4.41Å; L95-I133 HydrophobicContact CB-CG2 4.23Å; L95-I133 HydrophobicContact CD1-CG2 4.12Å; L95-I133 HydrophobicContact CD2-CG2 4.38Å; L95-I133 HydrophobicContact CG-CG2 4.48Å; S96-I133 WeakPolarHBondContact O-CA 3.47Å; I131-I133 HydrophobicContact CG2-CD1 3.64Å; I131-I133 HydrophobicContact CG2-CG1 4.29Å
134	L	94.9	Very high	81.8	Confident	37 Å²	37	70.3 Å²	70.3	19%	0.194	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	137.3	-178	-72.8	158.4	0	0	0	109	E67 L95 S96 K132	E67-L134 HydrophobicContact CB-CD2 4.13Å; L95-L134 VanDerWaalsContact CA-O 3.3Å; L95-L134 WeakPolarHBondContact CA-O 3.26Å; S96-L134 PolarHBondContact N-O 2.74Å; S96-L134 PolarHBondContact O-N 2.81Å; S96-L134 WeakPolarHBondContact OG-CB 3.45Å; K132-L134 HydrophobicContact CD-CD2 4.32Å; K132-L134 HydrophobicContact CD-CG 4.3Å; K132-L134 HydrophobicContact CG-CG 4.29Å
135	N	92.9	Very high	80.2	Confident	20 Å²	20	75.6 Å²	75.6	11%	0.107	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	100.8	173.5	-173.2	-5.7	0	0	0	110.3	H66 L95 S137 L138	H66-N135 PolarHBondContact O-N 2.9Å; L95-N135 HydrophobicContact CD2-CB 3.86Å; N135-S137 VanDerWaalsContact C-N 3.34Å; N135-S137 PolarHBondContact OD1-N 2.63Å; N135-L138 HydrophobicContact CB-CD1 4.21Å
136	N	88.7	Confident	78.2	Confident	58 Å²	58	75.4 Å²	75.4	31%	0.31	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-73.6	-26.5	-176.7	-63	-1	0	0	0	112.2	A94 S96 L138 F139 D140	A94-N136 WeakPolarHBondContact O-CB 3.47Å; A94-N136 PolarHBondContact O-N 3.26Å; S96-N136 PolarHBondContact OG-OD1 3.13Å; N136-L138 PolarHBondContact O-N 2.78Å; N136-F139 PolarHBondContact O-N 3.4Å; N136-D140 PolarHBondContact O-N 2.85Å
137	S	76.6	Confident	76.5	Confident	80 Å²	80	78.2 Å²	78.2	56%	0.559	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-62.7	-14.9	-179	-63.7	0	0	0	0	114	A94 N135 F139	A94-S137 WeakPolarHBondContact CB-OG 2.74Å; N135-S137 VanDerWaalsContact C-N 3.34Å; N135-S137 PolarHBondContact OD1-N 2.63Å; S137-F139 VanDerWaalsContact C-N 3.33Å
138	L	66.7	Low	74.7	Confident	88 Å²	88	83.1 Å²	83.1	46%	0.461	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-81.9	-9.6	175.1	-67.9	169.6	0	0	0	113.2	H66 N135 N136	H66-L138 HydrophobicContact CB-CD1 4.44Å; N135-L138 HydrophobicContact CB-CD1 4.21Å; N136-L138 PolarHBondContact O-N 2.78Å
139	F	60.6	Low	72.6	Confident	131 Å²	131	87.9 Å²	87.9	58%	0.575	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.7	0.6	-168.2	-65.7	-77.6	0	0	0	116.3	H66 N136 S137 I141	H66-F139 HydrophobicContact CB-CE2 4.43Å; H66-F139 AromaticContact CD2-CD2 3.58Å; H66-F139 AromaticContact CD2-CE2 3.01Å; H66-F139 WeakPolarHBondContact CD2-CE2 3.38Å; H66-F139 AromaticContact CD2-CZ 3.92Å; H66-F139 AromaticContact CG-CE2 3.77Å; H66-F139 AromaticContact NE2-CD2 3.67Å; H66-F139 AromaticContact NE2-CE2 3.43Å; H66-F139 WeakPolarHBondContact NE2-CE2 3.45Å; N136-F139 PolarHBondContact O-N 3.4Å; S137-F139 VanDerWaalsContact C-N 3.33Å; F139-I141 VanDerWaalsContact C-N 3.25Å; F139-I141 PolarHBondContact O-N 3.43Å
140	D	55.5	Low	70.8	Confident	139 Å²	139	95.2 Å²	95.2	74%	0.743	53%	0.531	S	S	*	.			trans	-83.8	63.3	173.1	-73.3	-29.5	0	0	0	112.3	N136 A142	N136-D140 PolarHBondContact O-N 2.85Å; D140-A142 PolarHBondContact O-N 3.02Å
141	I	51.5	Low	68.7	Low	149 Å²	149	98.6 Å²	98.6	76%	0.764	56%	0.555	S	S	*	*			trans	-88.7	88.5	149.8	-56.6	174.3	0	0	0	105.6	F139 V143	F139-I141 VanDerWaalsContact C-N 3.25Å; F139-I141 PolarHBondContact O-N 3.43Å; I141-V143 VanDerWaalsContact C-N 3.34Å; I141-V143 PolarHBondContact O-N 3.46Å
142	A	55.9	Low	66.8	Low	89 Å²	89	106.8 Å²	106.8	74%	0.736	59%	0.594	S	S	*	*			trans	-62.7	98.7	165.9	0	0	0	0	0	108	D140 P144	D140-A142 PolarHBondContact O-N 3.02Å; A142-P144 VanDerWaalsContact O-CD 3.25Å; A142-P144 WeakPolarHBondContact O-CD 3.12Å
143	V	55.3	Low	64.9	Low	118 Å²	118	108.2 Å²	108.2	72%	0.715	62%	0.617	S	S	*	*			trans	-60	118.8	167.3	178.5	0	0	0	0	106.4	I141 Q145	I141-V143 VanDerWaalsContact C-N 3.34Å; I141-V143 PolarHBondContact O-N 3.46Å; V143-Q145 PolarHBondContact O-N 3.31Å
144	P	57.2	Low	63.3	Low	113 Å²	113	116.9 Å²	116.9	73%	0.734	66%	0.657	S	S	*	*			trans	-60.1	115.8	175.7	-18.3	30.4	0	0	0	108.1	A142	A142-P144 VanDerWaalsContact O-CD 3.25Å; A142-P144 WeakPolarHBondContact O-CD 3.12Å
145	Q	59.2	Low	61.4	Low	175 Å²	175	120.5 Å²	120.5	82%	0.818	69%	0.685	S	S	*	*			trans	-58.5	125.1	164.7	-73.5	-80.5	-3.9	0	0	106.7	V143 S147	V143-Q145 PolarHBondContact O-N 3.31Å; Q145-S147 PolarHBondContact O-N 2.86Å
146	P	55.3	Low	59.6	Low	108 Å²	108	128.1 Å²	128.1	70%	0.701	73%	0.725	S	S	*	*			trans	-59.7	118.5	173.8	23.7	-30.5	0	0	0	107.3	Q148	P146-Q148 PolarHBondContact O-N 3.2Å
147	S	58.1	Low	58	Low	111 Å²	111	128.3 Å²	128.3	78%	0.776	74%	0.741	S	S	*	*			trans	-52.1	111.6	171	52.1	0	0	0	0	107.5	Q145 S149	Q145-S147 PolarHBondContact O-N 2.86Å; S147-S149 PolarHBondContact O-N 2.98Å
148	Q	59.2	Low	57.1	Low	185 Å²	185	133.4 Å²	133.4	86%	0.864	76%	0.756	S	S	*	*			trans	-57.6	109.4	167.7	-70.2	-179.8	-2.5	0	0	106.4	P146 Q150	P146-Q148 PolarHBondContact O-N 3.2Å; Q148-Q150 PolarHBondContact O-N 3.27Å
149	S	53.4	Low	56.4	Low	105 Å²	105	139.3 Å²	139.3	73%	0.734	78%	0.778	S	S	*	*			trans	-56.3	103.7	171.4	31.7	0	0	0	0	107.6	S147 T151	S147-S149 PolarHBondContact O-N 2.98Å; S149-T151 VanDerWaalsContact C-N 3.27Å; S149-T151 PolarHBondContact O-N 2.88Å
150	Q	58.2	Low	56.3	Low	174 Å²	174	144.9 Å²	144.9	81%	0.813	80%	0.795	S	S	*	*			trans	-66.7	95.7	163.9	-72.4	-178.3	5	0	0	106.8	Q148 Q152	Q148-Q150 PolarHBondContact O-N 3.27Å; Q150-Q152 VanDerWaalsContact C-N 3.29Å; Q150-Q152 PolarHBondContact O-N 2.72Å
151	T	52.6	Low	56.6	Low	128 Å²	128	141.6 Å²	141.6	79%	0.785	80%	0.795	S	S	*	*			trans	-62.1	94.8	165.8	-35.2	0	0	0	0	107	S149 A153	S149-T151 VanDerWaalsContact C-N 3.27Å; S149-T151 PolarHBondContact O-N 2.88Å; T151-A153 VanDerWaalsContact C-N 3.29Å; T151-A153 PolarHBondContact O-N 3.06Å
152	Q	57.4	Low	57.1	Low	173 Å²	173	144.4 Å²	144.4	81%	0.808	80%	0.801	S	S	*	*			trans	-65.1	95.9	166.3	-76.3	-178.3	15.7	0	0	107.4	Q150 Q154	Q150-Q152 VanDerWaalsContact C-N 3.29Å; Q150-Q152 PolarHBondContact O-N 2.72Å; Q152-Q154 PolarHBondContact O-N 2.72Å
153	A	58.6	Low	57.6	Low	91 Å²	91	145.1 Å²	145.1	75%	0.752	81%	0.807	S	S	*	*			trans	-62.7	106.2	166.1	0	0	0	0	0	107.7	T151 S155	T151-A153 VanDerWaalsContact C-N 3.29Å; T151-A153 PolarHBondContact O-N 3.06Å; A153-S155 PolarHBondContact O-N 2.76Å
154	Q	60.6	Low	58.1	Low	183 Å²	183	148.7 Å²	148.7	86%	0.855	81%	0.813	S	S	*	*			trans	-58.9	104.2	169.9	-69.8	174.8	-10	0	0	108.3	Q152 L156	Q152-Q154 PolarHBondContact O-N 2.72Å; Q154-L156 PolarHBondContact O-N 2.84Å; Q154-L156 VanDerWaalsContact O-N 3.1Å
155	S	56.8	Low	58.1	Low	112 Å²	112	148.2 Å²	148.2	78%	0.783	82%	0.819	S	S	*	*			trans	-65.5	107.2	169.7	57.2	0	0	0	0	108.6	A153 G157	A153-S155 PolarHBondContact O-N 2.76Å; S155-G157 VanDerWaalsContact C-N 3.27Å; S155-G157 PolarHBondContact O-N 3.31Å
156	L	53.3	Low	58.3	Low	180 Å²	180	150.1 Å²	150.1	94%	0.942	82%	0.818	S	S	*	*			trans	-64.5	87.1	168.2	-118.9	105.2	0	0	0	108.9	Q154	Q154-L156 PolarHBondContact O-N 2.84Å; Q154-L156 VanDerWaalsContact O-N 3.1Å
157	G	55.8	Low	58.7	Low	62 Å²	62	157.2 Å²	157.2	64%	0.639	84%	0.842	S	S	*	*			trans	-93.5	102.8	176.6	0	0	0	0	0	111.8	S155	S155-G157 VanDerWaalsContact C-N 3.27Å; S155-G157 PolarHBondContact O-N 3.31Å
158	Q	57.4	Low	58.7	Low	187 Å²	187	159.6 Å²	159.6	87%	0.874	85%	0.846	S	S	*	*			trans	56.2	96.6	140.7	-61.3	176.5	1.4	0	0	118.8
159	F	53.2	Low	58.7	Low	213 Å²	213	158.2 Å²	158.2	93%	0.934	85%	0.845	S	S	*	*			trans	-134.7	85.1	149.2	-116.7	-92.3	0	0	0	109.6
160	R	58.4	Low	59	Low	247 Å²	247	161.2 Å²	161.2	93%	0.932	85%	0.851	S	S	*	*			trans	-94.8	91.2	163.2	-82.4	178.6	83.1	173.3	4.8	108	K162	R160-K162 PolarHBondContact O-N 3.48Å
161	G	60.6	Low	59	Low	71 Å²	71	160.4 Å²	160.4	73%	0.732	85%	0.853	S	S	*	*			trans	-62.8	119.4	167	0	0	0	0	0	110.2	A163	G161-A163 PolarHBondContact O-N 3.21Å
162	K	62.3	Low	59.4	Low	207 Å²	207	162.4 Å²	162.4	90%	0.9	86%	0.857	S	S	*	*			trans	-77.4	103.8	166.1	-73.3	-178.8	174.2	178.8	0	108	R160	R160-K162 PolarHBondContact O-N 3.48Å
163	A	66.6	Low	59.6	Low	104 Å²	104	161.7 Å²	161.7	86%	0.86	86%	0.86	S	S	*	*			trans	-75.4	122.8	164.4	0	0	0	0	0	108.9	G161	G161-A163 PolarHBondContact O-N 3.21Å
164	K	66	Low	59.6	Low	194 Å²	194	166.8 Å²	166.8	84%	0.843	87%	0.868	S	S	*	*			trans	-93.2	114.3	179.5	-158.7	176.9	-171.6	-179.7	0	107.2
165	A	56.7	Low	59.6	Low	102 Å²	102	165.5 Å²	165.5	84%	0.843	87%	0.869	S	S	*	*			trans	-69.1	132.4	169	0	0	0	0	0	109.2
166	R	64.4	Low	59.8	Low	216 Å²	216	170 Å²	170	82%	0.815	88%	0.876	S	S	*	*			trans	-138.4	114.3	173.8	-134.3	-176.5	174.1	-161.2	-4.6	108.3
167	Q	63.1	Low	60.4	Low	257 Å²	257	169.1 Å²	169.1	100%	1.201	87%	0.87	S	S	*	*			trans	54.7	0	155.9	-68.8	-179.6	-23.3	0	0	119.1

Retrieved 167 of 167 residues in 146.7 ms (Link to these results)

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