A0A077YW27_TRITR Loading...

Kazal 1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077YW27, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 150 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	48.3	Very low	70.6	Confident	238 Å²	238	121.2 Å²	121.2	100%	1.172	67%	0.668	S	S	*	*				0	93.9	0	-71	162.7	173.3	0	0	107.5	C3	M1-C3 PolarHBondContact O-N 3.4Å
2	V	60.8	Low	71.9	Confident	145 Å²	145	120.1 Å²	120.1	88%	0.879	66%	0.66	S	S	*	*			trans	-90.2	100.6	-177.8	-177.7	0	0	0	0	107.1	K4	V2-K4 PolarHBondContact O-N 3.44Å
3	C	61.6	Low	73.1	Confident	122 Å²	122	120.2 Å²	120.2	82%	0.824	66%	0.655	S	S	*	*			trans	-63.4	126.8	175	-82.4	0	0	0	0	109.4	M1 P5	M1-C3 PolarHBondContact O-N 3.4Å; C3-P5 VanDerWaalsContact O-CD 3.26Å; C3-P5 WeakPolarHBondContact O-CD 3.38Å
4	K	59	Low	74.3	Confident	157 Å²	157	116.6 Å²	116.6	68%	0.683	64%	0.639	S	S	*	*			trans	-79.3	106.8	-167.7	-138.6	170.6	-175.7	175.3	0	109.8	V2 Q6 S7	V2-K4 PolarHBondContact O-N 3.44Å; K4-Q6 PolarHBondContact O-N 2.73Å; K4-Q6 VanDerWaalsContact O-N 3.15Å; K4-S7 PolarHBondContact O-N 3.15Å
5	P	71.8	Confident	75.3	Confident	95 Å²	95	115.9 Å²	115.9	62%	0.617	63%	0.632	S	S	*	*	H	α-helix	trans	-64.3	-21.1	-177.3	25.7	-34.2	0	0	0	113.1	C3 S7	C3-P5 VanDerWaalsContact O-CD 3.26Å; C3-P5 WeakPolarHBondContact O-CD 3.38Å; P5-S7 VanDerWaalsContact C-N 3.34Å; P5-S7 PolarHBondContact O-N 2.86Å
6	Q	68.6	Low	76	Confident	136 Å²	136	116 Å²	116	64%	0.636	63%	0.627	S	S	*	*	H	α-helix	trans	-68.4	-29	178.7	-69.9	-177.1	-23.5	0	0	113.6	K4 V8 I10	K4-Q6 PolarHBondContact O-N 2.73Å; K4-Q6 VanDerWaalsContact O-N 3.15Å; Q6-V8 VanDerWaalsContact C-N 3.32Å; Q6-V8 PolarHBondContact O-N 3.25Å; Q6-I10 WeakPolarHBondContact O-CG1 3.26Å; Q6-I10 PolarHBondContact O-N 2.92Å
7	S	72.6	Confident	76.6	Confident	72 Å²	72	115.5 Å²	115.5	50%	0.503	62%	0.622	S	S	.	*	H	α-helix	trans	-67.8	-35	-179.3	-168.3	0	0	0	0	111.8	K4 P5 T11	K4-S7 PolarHBondContact O-N 3.15Å; P5-S7 VanDerWaalsContact C-N 3.34Å; P5-S7 PolarHBondContact O-N 2.86Å; S7-T11 WeakPolarHBondContact O-CG2 3.33Å; S7-T11 PolarHBondContact O-N 3.16Å; S7-T11 VanDerWaalsContact O-N 3.16Å; S7-T11 PolarHBondContact O-OG1 3.31Å
8	V	80.7	Confident	76.9	Confident	86 Å²	86	115.3 Å²	115.3	52%	0.521	62%	0.617	S	S	.	*	H	α-helix	trans	-71.8	-42.5	-177.1	-178.1	0	0	0	0	110.9	Q6 I10 T11 L12	Q6-V8 VanDerWaalsContact C-N 3.32Å; Q6-V8 PolarHBondContact O-N 3.25Å; V8-I10 VanDerWaalsContact C-N 3.34Å; V8-I10 PolarHBondContact O-N 3.4Å; V8-T11 WeakPolarHBondContact CA-OG1 3.28Å; V8-T11 PolarHBondContact O-N 3.36Å; V8-T11 PolarHBondContact O-OG1 3.45Å; V8-L12 HydrophobicContact CG1-CD1 4.22Å; V8-L12 HydrophobicContact CG1-CG 4.44Å; V8-L12 WeakPolarHBondContact O-CG 3.27Å; V8-L12 PolarHBondContact O-N 3.45Å
9	I	83.1	Confident	77.2	Confident	104 Å²	104	114.7 Å²	114.7	53%	0.533	61%	0.613	S	S	.	*	H	α-helix	trans	-62.7	-44	178.9	-60.5	172.1	0	0	0	110.2	T11 L12 M13	I9-T11 VanDerWaalsContact C-N 3.34Å; I9-T11 PolarHBondContact O-N 3.46Å; I9-L12 PolarHBondContact O-N 3.24Å; I9-M13 HydrophobicContact CG2-CG 4.32Å; I9-M13 VanDerWaalsContact O-CG 3.24Å; I9-M13 WeakPolarHBondContact O-CG 3.4Å; I9-M13 PolarHBondContact O-N 3.44Å
10	I	84.6	Confident	77.4	Confident	110 Å²	110	114.6 Å²	114.6	56%	0.564	61%	0.612	S	S	*	*	H	α-helix	trans	-61.2	-44.1	177.5	-64	167.3	0	0	0	110.5	Q6 V8 L12 M13 V14	Q6-I10 WeakPolarHBondContact O-CG1 3.26Å; Q6-I10 PolarHBondContact O-N 2.92Å; V8-I10 VanDerWaalsContact C-N 3.34Å; V8-I10 PolarHBondContact O-N 3.4Å; I10-L12 PolarHBondContact O-N 3.4Å; I10-M13 PolarHBondContact O-N 3.44Å; I10-V14 HydrophobicContact CG2-CG2 4.41Å; I10-V14 VanDerWaalsContact O-CG2 3.28Å; I10-V14 WeakPolarHBondContact O-CG2 3.39Å; I10-V14 PolarHBondContact O-N 3.26Å
11	T	85.5	Confident	77.4	Confident	68 Å²	68	113 Å²	113	42%	0.417	61%	0.61	S	S	.	*	H	α-helix	trans	-63.8	-39.7	177.8	51.3	0	0	0	0	112.9	S7 V8 I9 V14 I15	S7-T11 WeakPolarHBondContact O-CG2 3.33Å; S7-T11 PolarHBondContact O-N 3.16Å; S7-T11 VanDerWaalsContact O-N 3.16Å; S7-T11 PolarHBondContact O-OG1 3.31Å; V8-T11 WeakPolarHBondContact CA-OG1 3.28Å; V8-T11 PolarHBondContact O-N 3.36Å; V8-T11 PolarHBondContact O-OG1 3.45Å; I9-T11 VanDerWaalsContact C-N 3.34Å; I9-T11 PolarHBondContact O-N 3.46Å; T11-V14 PolarHBondContact O-N 2.96Å; T11-I15 WeakPolarHBondContact O-CB 3.19Å; T11-I15 WeakPolarHBondContact O-CD1 3.42Å; T11-I15 WeakPolarHBondContact O-CG1 3.34Å; T11-I15 PolarHBondContact O-N 3.28Å
12	L	85.9	Confident	78.6	Confident	108 Å²	108	107.9 Å²	107.9	57%	0.565	59%	0.587	S	S	*	*	H	α-helix	trans	-66.9	-41	177.4	-68.6	176.9	0	0	0	111.7	V8 I9 I10 I15 H16	V8-L12 HydrophobicContact CG1-CD1 4.22Å; V8-L12 HydrophobicContact CG1-CG 4.44Å; V8-L12 WeakPolarHBondContact O-CG 3.27Å; V8-L12 PolarHBondContact O-N 3.45Å; I9-L12 PolarHBondContact O-N 3.24Å; I10-L12 PolarHBondContact O-N 3.4Å; L12-I15 PolarHBondContact O-N 2.96Å; L12-H16 WeakPolarHBondContact O-CB 3.49Å; L12-H16 PolarHBondContact O-N 3.45Å
13	M	87.5	Confident	79.2	Confident	121 Å²	121	105 Å²	105	60%	0.596	57%	0.569	S	S	*	*	H	α-helix	trans	-62.3	-43.3	175.5	-68.6	-65.3	-145.3	0	0	111.4	I9 I10 H16 I17	I9-M13 HydrophobicContact CG2-CG 4.32Å; I9-M13 VanDerWaalsContact O-CG 3.24Å; I9-M13 WeakPolarHBondContact O-CG 3.4Å; I9-M13 PolarHBondContact O-N 3.44Å; I10-M13 PolarHBondContact O-N 3.44Å; M13-H16 PolarHBondContact O-N 3.48Å; M13-I17 WeakPolarHBondContact O-CD1 3.4Å; M13-I17 VanDerWaalsContact O-CG1 3.25Å; M13-I17 WeakPolarHBondContact O-CG1 3.28Å; M13-I17 PolarHBondContact O-N 3.37Å
14	V	90.4	Very high	79.6	Confident	71 Å²	71	103.9 Å²	103.9	43%	0.43	56%	0.56	S	S	.	*	H	α-helix	trans	-64.1	-46.8	176.5	173.1	0	0	0	0	110.8	I10 T11 H16 I17 E18	I10-V14 HydrophobicContact CG2-CG2 4.41Å; I10-V14 VanDerWaalsContact O-CG2 3.28Å; I10-V14 WeakPolarHBondContact O-CG2 3.39Å; I10-V14 PolarHBondContact O-N 3.26Å; T11-V14 PolarHBondContact O-N 2.96Å; V14-H16 PolarHBondContact O-N 3.49Å; V14-I17 PolarHBondContact O-N 3.12Å; V14-I17 VanDerWaalsContact O-N 3.14Å; V14-E18 HydrophobicContact CG1-CG 4.26Å; V14-E18 WeakPolarHBondContact O-CG 3.02Å; V14-E18 PolarHBondContact O-N 3.44Å
15	I	89.5	Confident	79.7	Confident	106 Å²	106	103 Å²	103	54%	0.544	56%	0.563	S	S	.	*	H	α-helix	trans	-58.1	-39.3	176.2	-68.1	161.8	0	0	0	111	T11 L12 L19	T11-I15 WeakPolarHBondContact O-CB 3.19Å; T11-I15 WeakPolarHBondContact O-CD1 3.42Å; T11-I15 WeakPolarHBondContact O-CG1 3.34Å; T11-I15 PolarHBondContact O-N 3.28Å; L12-I15 PolarHBondContact O-N 2.96Å; I15-L19 VanDerWaalsContact O-CB 3.27Å; I15-L19 WeakPolarHBondContact O-CB 3.49Å; I15-L19 PolarHBondContact O-N 2.87Å
16	H	86.2	Confident	79.2	Confident	117 Å²	117	102.6 Å²	102.6	54%	0.542	56%	0.558	S	S	.	*	H	α-helix	trans	-70.4	-36.5	179.1	-145.1	-58.7	0	0	0	112.4	L12 M13 V14 L19 L20	L12-H16 WeakPolarHBondContact O-CB 3.49Å; L12-H16 PolarHBondContact O-N 3.45Å; M13-H16 PolarHBondContact O-N 3.48Å; V14-H16 PolarHBondContact O-N 3.49Å; H16-L19 PolarHBondContact O-N 2.99Å; H16-L20 WeakPolarHBondContact O-CB 3.36Å; H16-L20 WeakPolarHBondContact O-CG 3.24Å; H16-L20 PolarHBondContact O-N 2.98Å
17	I	86	Confident	78.9	Confident	108 Å²	108	101.9 Å²	101.9	55%	0.554	56%	0.563	S	S	*	*	H	α-helix	trans	-67.1	-45	174.6	-68.4	163.7	0	0	0	110.5	M13 V14 L19 L20 S21	M13-I17 WeakPolarHBondContact O-CD1 3.4Å; M13-I17 VanDerWaalsContact O-CG1 3.25Å; M13-I17 WeakPolarHBondContact O-CG1 3.28Å; M13-I17 PolarHBondContact O-N 3.37Å; V14-I17 PolarHBondContact O-N 3.12Å; V14-I17 VanDerWaalsContact O-N 3.14Å; I17-L19 VanDerWaalsContact C-N 3.31Å; I17-L19 PolarHBondContact O-N 3.26Å; I17-L20 PolarHBondContact O-N 3.47Å; I17-S21 PolarHBondContact O-N 3.46Å; I17-S21 PolarHBondContact O-OG 3.14Å
18	E	82.1	Confident	78.1	Confident	112 Å²	112	103.6 Å²	103.6	52%	0.523	58%	0.575	S	S	.	*	H	α-helix	trans	-63.7	-35.7	174.7	-65.4	-62.3	155.9	0	0	111.9	V14 S21 L22	V14-E18 HydrophobicContact CG1-CG 4.26Å; V14-E18 WeakPolarHBondContact O-CG 3.02Å; V14-E18 PolarHBondContact O-N 3.44Å; E18-S21 WeakPolarHBondContact CA-OG 3.18Å; E18-S21 PolarHBondContact O-N 2.88Å; E18-S21 PolarHBondContact O-OG 2.96Å; E18-L22 WeakPolarHBondContact O-CD1 3.49Å; E18-L22 VanDerWaalsContact O-CG 3.28Å; E18-L22 WeakPolarHBondContact O-CG 3.45Å; E18-L22 PolarHBondContact O-N 3.28Å; E18-L22 VanDerWaalsContact O-N 3.12Å
19	L	82.8	Confident	77	Confident	103 Å²	103	107.2 Å²	107.2	54%	0.539	59%	0.586	S	S	.	*	H	α-helix	trans	-69.6	-36.9	175.6	-172.6	64.1	0	0	0	111.8	I15 H16 I17 L22 V23	I15-L19 VanDerWaalsContact O-CB 3.27Å; I15-L19 WeakPolarHBondContact O-CB 3.49Å; I15-L19 PolarHBondContact O-N 2.87Å; H16-L19 PolarHBondContact O-N 2.99Å; I17-L19 VanDerWaalsContact C-N 3.31Å; I17-L19 PolarHBondContact O-N 3.26Å; L19-L22 PolarHBondContact O-N 3.31Å; L19-V23 PolarHBondContact O-N 2.94Å
20	L	81	Confident	75.9	Confident	113 Å²	113	108.8 Å²	108.8	59%	0.592	59%	0.589	S	S	*	*	H	α-helix	trans	-69.8	-31.9	175.8	-71.5	169.7	0	0	0	112.1	H16 I17 L22 V23	H16-L20 WeakPolarHBondContact O-CB 3.36Å; H16-L20 WeakPolarHBondContact O-CG 3.24Å; H16-L20 PolarHBondContact O-N 2.98Å; I17-L20 PolarHBondContact O-N 3.47Å; L20-L22 VanDerWaalsContact C-N 3.34Å; L20-V23 PolarHBondContact O-N 2.95Å
21	S	78.1	Confident	74.8	Confident	82 Å²	82	107.7 Å²	107.7	57%	0.573	59%	0.592	S	S	*	*	H	α-helix	trans	-76.1	-21	174.4	64	0	0	0	0	113.3	I17 E18 V23	I17-S21 PolarHBondContact O-N 3.46Å; I17-S21 PolarHBondContact O-OG 3.14Å; E18-S21 WeakPolarHBondContact CA-OG 3.18Å; E18-S21 PolarHBondContact O-N 2.88Å; E18-S21 PolarHBondContact O-OG 2.96Å; S21-V23 VanDerWaalsContact C-N 3.34Å
22	L	72.7	Confident	74.1	Confident	130 Å²	130	112.4 Å²	112.4	68%	0.681	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-10.4	173	-76.1	166.9	0	0	0	114	E18 L19 L20 P24	E18-L22 WeakPolarHBondContact O-CD1 3.49Å; E18-L22 VanDerWaalsContact O-CG 3.28Å; E18-L22 WeakPolarHBondContact O-CG 3.45Å; E18-L22 PolarHBondContact O-N 3.28Å; E18-L22 VanDerWaalsContact O-N 3.12Å; L19-L22 PolarHBondContact O-N 3.31Å; L20-L22 VanDerWaalsContact C-N 3.34Å; L22-P24 WeakPolarHBondContact O-CD 3.25Å
23	V	73.3	Confident	74.2	Confident	85 Å²	85	110 Å²	110	52%	0.515	60%	0.603	S	S	.	*	S	Bend	trans	-83.9	100.3	167.9	-174.1	0	0	0	0	106.6	L19 L20 S21 N25	L19-V23 PolarHBondContact O-N 2.94Å; L20-V23 PolarHBondContact O-N 2.95Å; S21-V23 VanDerWaalsContact C-N 3.34Å; V23-N25 PolarHBondContact O-N 2.94Å
24	P	69.9	Low	74.5	Confident	97 Å²	97	109.2 Å²	109.2	63%	0.63	59%	0.594	S	S	*	*			trans	-55.1	131.6	170.8	24.8	-33.2	0	0	0	107.2	L22 V26	L22-P24 WeakPolarHBondContact O-CD 3.25Å; P24-V26 VanDerWaalsContact C-N 3.29Å; P24-V26 PolarHBondContact O-N 3.25Å
25	N	61.9	Low	74.5	Confident	140 Å²	140	112.8 Å²	112.8	75%	0.749	61%	0.606	S	S	*	*			trans	-54.9	98.4	173	-76.9	-55.8	0	0	0	108.2	V23 V27 S28	V23-N25 PolarHBondContact O-N 2.94Å; N25-V27 PolarHBondContact O-N 3.15Å; N25-S28 PolarHBondContact O-N 3.44Å; N25-S28 VanDerWaalsContact O-N 3.12Å
26	V	61.7	Low	74.7	Confident	85 Å²	85	108.9 Å²	108.9	52%	0.515	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-61.3	-12.8	-175.3	-138.9	0	0	0	0	111.7	P24 S28 Q29 F30	P24-V26 VanDerWaalsContact C-N 3.29Å; P24-V26 PolarHBondContact O-N 3.25Å; V26-S28 PolarHBondContact O-N 3.19Å; V26-Q29 PolarHBondContact O-N 2.73Å; V26-F30 WeakPolarHBondContact O-CD2 3.08Å; V26-F30 WeakPolarHBondContact O-CE2 3.44Å
27	V	60.5	Low	75.1	Confident	121 Å²	121	111.1 Å²	111.1	73%	0.733	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-63.8	-25.5	176.8	-164.6	0	0	0	0	112.5	N25	N25-V27 PolarHBondContact O-N 3.15Å
28	S	56.4	Low	75.4	Confident	108 Å²	108	107.5 Å²	107.5	76%	0.755	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-81.9	-10.7	-176.5	-169.8	0	0	0	0	114.7	N25 V26	N25-S28 PolarHBondContact O-N 3.44Å; N25-S28 VanDerWaalsContact O-N 3.12Å; V26-S28 PolarHBondContact O-N 3.19Å
29	Q	56.8	Low	75.9	Confident	163 Å²	163	103.9 Å²	103.9	76%	0.762	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	-13.3	-174.9	-72.9	-173	-25.5	0	0	114	V26 S31	V26-Q29 PolarHBondContact O-N 2.73Å; Q29-S31 VanDerWaalsContact C-N 3.34Å; Q29-S31 PolarHBondContact O-N 2.95Å
30	F	61.2	Low	76.4	Confident	136 Å²	136	101.8 Å²	101.8	60%	0.596	56%	0.559	S	S	*	*	S	Bend	trans	-74.2	96.5	166.4	-61.5	-76.1	0	0	0	107.1	V26 L32	V26-F30 WeakPolarHBondContact O-CD2 3.08Å; V26-F30 WeakPolarHBondContact O-CE2 3.44Å; F30-L32 PolarHBondContact O-N 3.32Å; F30-L32 VanDerWaalsContact O-N 3.07Å
31	S	61.2	Low	76.8	Confident	88 Å²	88	98.4 Å²	98.4	62%	0.615	55%	0.547	S	S	*	.			trans	-46.2	122.4	161.7	-67.1	0	0	0	0	106.3	Q29 V33	Q29-S31 VanDerWaalsContact C-N 3.34Å; Q29-S31 PolarHBondContact O-N 2.95Å; S31-V33 WeakPolarHBondContact O-CG2 3.19Å; S31-V33 PolarHBondContact O-N 3.47Å
32	L	71.9	Confident	77.5	Confident	166 Å²	166	94.5 Å²	94.5	87%	0.869	52%	0.52	S	S	*	.			trans	-68.7	87	-174.9	-173.1	75.2	0	0	0	108.1	F30 R34	F30-L32 PolarHBondContact O-N 3.32Å; F30-L32 VanDerWaalsContact O-N 3.07Å; L32-R34 PolarHBondContact O-N 3.12Å
33	V	87.9	Confident	78.4	Confident	59 Å²	59	90.5 Å²	90.5	36%	0.358	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-63.7	129.6	178.1	172.5	0	0	0	0	108.2	S31 T57 K80 I81	S31-V33 WeakPolarHBondContact O-CG2 3.19Å; S31-V33 PolarHBondContact O-N 3.47Å; V33-T57 HydrophobicContact CB-CG2 4.44Å; V33-T57 HydrophobicContact CG1-CG2 3.67Å; V33-T57 HydrophobicContact CG2-CG2 3.8Å; V33-K80 HydrophobicContact CG1-CB 3.11Å; V33-K80 HydrophobicContact CG1-CD 3.52Å; V33-K80 HydrophobicContact CG1-CG 3.95Å; V33-I81 CarbonylContact C-O 3.56Å; V33-I81 VanDerWaalsContact CA-O 3.32Å; V33-I81 WeakPolarHBondContact CA-O 3.27Å; V33-I81 WeakPolarHBondContact CG1-O 3.44Å
34	R	92.2	Very high	79.3	Confident	103 Å²	103	93.6 Å²	93.6	39%	0.389	50%	0.499	S	S	.	.	B	Isolated β-bridge	trans	-103.1	144.8	178.6	-165.1	-178.1	83.5	-134.1	4.2	110.8	L32 E65 I81 D84	L32-R34 PolarHBondContact O-N 3.12Å; R34-E65 IonicContact NH2-OE1 2.96Å; R34-E65 PolarHBondContact NH2-OE1 2.78Å; R34-E65 IonicContact NH2-OE2 3.87Å; R34-I81 HydrophobicContact CB-CB 4.48Å; R34-I81 PolarHBondContact N-O 2.94Å; R34-I81 PolarHBondContact O-N 3.17Å; R34-D84 IonicContact CZ-OD1 3.02Å; R34-D84 IonicContact NH1-OD1 3.43Å; R34-D84 PolarHBondContact NH1-OD1 3.24Å; R34-D84 IonicContact NH1-OD2 3.48Å; R34-D84 PolarHBondContact NH1-OD2 2.89Å; R34-D84 IonicContact NH2-OD1 3.71Å; R34-D84 PolarHBondContact NH2-OD1 3.3Å
35	E	91.9	Very high	80.4	Confident	147 Å²	147	89.9 Å²	89.9	69%	0.687	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-73.1	136.1	169.8	-66.1	179.5	178.7	0	0	110.6
36	P	93.3	Very high	82	Confident	24 Å²	24	89.8 Å²	89.8	16%	0.156	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-74.4	143.7	176.2	30	-33.8	0	0	0	111.7	C38 E65 M68 M72 I81	P36-C38 PolarHBondContact O-N 2.98Å; P36-C38 VanDerWaalsContact O-N 3.17Å; P36-E65 WeakPolarHBondContact CA-OE1 3.17Å; P36-E65 HydrophobicContact CB-CG 3.99Å; P36-M68 HydrophobicContact CB-CE 4.45Å; P36-M68 HydrophobicContact CB-SD 4.15Å; P36-M68 HydrophobicContact CG-CE 4.2Å; P36-M68 HydrophobicContact CG-SD 4.49Å; P36-M72 HydrophobicContact CG-CE 4.07Å; P36-M72 HydrophobicContact CG-SD 3.87Å; P36-I81 HydrophobicContact CB-CD1 3.95Å; P36-I81 HydrophobicContact CB-CG1 4.19Å
37	F	93.4	Very high	83.5	Confident	163 Å²	163	86.6 Å²	86.6	72%	0.715	45%	0.454	S	S	*	.			trans	-80.6	93.1	172.3	-176.6	-100.5	0	0	0	111.1	E65	F37-E65 PolarHBondContact N-OE1 2.91Å
38	C	93.7	Very high	85.1	Confident	32 Å²	32	89.5 Å²	89.5	22%	0.216	46%	0.457	C	S	.	.			trans	-92.9	105.5	178.2	-56.6	0	0	0	0	112.3	P36 W43 C69	P36-C38 PolarHBondContact O-N 2.98Å; P36-C38 VanDerWaalsContact O-N 3.17Å; C38-W43 HydrophobicContact CB-CZ2 4.21Å; C38-W43 VanDerWaalsContact CB-NE1 3.29Å; C38-W43 WeakPolarHBondContact O-CZ2 3.35Å; C38-C69 WeakPolarHBondContact CA-SG 3.32Å; C38-C69 HydrophobicContact CB-CB 3.59Å; C38-C69 WeakPolarHBondContact CB-SG 3.45Å; C38-C69 WeakPolarHBondContact SG-CB 3.49Å; C38-C69 CovalentContact SG-SG 2.03Å; C38-C69 PolarHBondContact SG-SG 2.96Å
39	S	92.7	Very high	86.8	Confident	37 Å²	37	91.3 Å²	91.3	26%	0.259	46%	0.459	S	S	.	.			trans	-79.9	156.2	171.7	76.1	0	0	0	0	111.6	A41 A42 W43	S39-A41 PolarHBondContact O-N 2.93Å; S39-A41 VanDerWaalsContact O-N 3.1Å; S39-A42 WeakPolarHBondContact O-CB 3.33Å; S39-A42 PolarHBondContact O-N 2.75Å; S39-A42 PolarHBondContact OG-N 2.84Å; S39-W43 PolarHBondContact O-N 2.85Å
40	P	92.1	Very high	88.5	Confident	59 Å²	59	87.4 Å²	87.4	38%	0.383	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.2	174.6	-26.8	35.4	0	0	0	115.1	W43	P40-W43 HydrophobicContact CB-CE3 4.18Å; P40-W43 HydrophobicContact CB-CZ3 4.14Å; P40-W43 HydrophobicContact CG-CH2 4.47Å; P40-W43 HydrophobicContact CG-CZ3 4.06Å
41	A	90.8	Very high	90.2	Very high	41 Å²	41	87 Å²	87	34%	0.339	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-39.7	173.9	0	0	0	0	0	111.4	S39 W43 R44 G45 H46	S39-A41 PolarHBondContact O-N 2.93Å; S39-A41 VanDerWaalsContact O-N 3.1Å; A41-W43 PolarHBondContact O-N 3.07Å; A41-R44 PolarHBondContact O-N 3.46Å; A41-R44 VanDerWaalsContact O-N 3.14Å; A41-G45 PolarHBondContact O-N 2.04Å; A41-H46 HydrophobicContact CB-CB 4.15Å; A41-H46 WeakPolarHBondContact O-CB 3.37Å; A41-H46 PolarHBondContact O-N 3.25Å
42	A	92.5	Very high	91.9	Very high	1 Å²	1	91.2 Å²	91.2	1%	0.008	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-60.9	-44.2	179.8	0	0	0	0	0	112	S39 R44 G45 C66 C69 F70	S39-A42 WeakPolarHBondContact O-CB 3.33Å; S39-A42 PolarHBondContact O-N 2.75Å; S39-A42 PolarHBondContact OG-N 2.84Å; A42-R44 PolarHBondContact O-N 2.87Å; A42-R44 VanDerWaalsContact O-N 3.1Å; A42-G45 PolarHBondContact O-N 2.98Å; A42-C66 HydrophobicContact CB-CB 4.35Å; A42-C66 WeakPolarHBondContact CB-SG 3.45Å; A42-C69 HydrophobicContact CB-CB 3.79Å; A42-F70 WeakPolarHBondContact O-CA 3.32Å; A42-F70 VanDerWaalsContact O-CB 3.3Å; A42-F70 WeakPolarHBondContact O-CB 3.22Å
43	W	90.9	Very high	93.1	Very high	46 Å²	46	84.5 Å²	84.5	17%	0.174	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-60.7	-22.7	177.8	-54.3	-33.8	0	0	0	114.1	C38 S39 P40 A41 Y73 H121	C38-W43 HydrophobicContact CB-CZ2 4.21Å; C38-W43 VanDerWaalsContact CB-NE1 3.29Å; C38-W43 WeakPolarHBondContact O-CZ2 3.35Å; S39-W43 PolarHBondContact O-N 2.85Å; P40-W43 HydrophobicContact CB-CE3 4.18Å; P40-W43 HydrophobicContact CB-CZ3 4.14Å; P40-W43 HydrophobicContact CG-CH2 4.47Å; P40-W43 HydrophobicContact CG-CZ3 4.06Å; A41-W43 PolarHBondContact O-N 3.07Å; W43-Y73 HydrophobicContact CB-CD1 4.27Å; W43-Y73 HydrophobicContact CB-CD2 4.04Å; W43-Y73 HydrophobicContact CB-CG 3.89Å; W43-Y73 HydrophobicContact CG-CD2 4.24Å; W43-Y73 HydrophobicContact CG-CG 4.38Å; W43-Y73 WeakPolarHBondContact O-CD1 3.41Å; W43-H121 AromaticContact CE3-CE1 3.86Å; W43-H121 AromaticContact CE3-NE2 3.57Å; W43-H121 AromaticContact CZ3-NE2 3.58Å
44	R	92.5	Very high	93.5	Very high	150 Å²	150	81.8 Å²	81.8	57%	0.566	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-94.2	5.5	177.1	-62.8	-179.1	-170.9	141.9	3.6	113	A41 A42 H46	A41-R44 PolarHBondContact O-N 3.46Å; A41-R44 VanDerWaalsContact O-N 3.14Å; A42-R44 PolarHBondContact O-N 2.87Å; A42-R44 VanDerWaalsContact O-N 3.1Å; R44-H46 VanDerWaalsContact C-N 3.26Å; R44-H46 PolarHBondContact O-N 2.95Å
45	G	92.9	Very high	93.6	Very high	19 Å²	19	76.9 Å²	76.9	20%	0.196	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	14.9	-176.7	0	0	0	0	0	113.6	A41 A42 C47	A41-G45 PolarHBondContact O-N 2.04Å; A42-G45 PolarHBondContact O-N 2.98Å; G45-C47 VanDerWaalsContact C-N 3.29Å; G45-C47 PolarHBondContact O-N 3.07Å; G45-C47 VanDerWaalsContact O-N 3.07Å
46	H	94.4	Very high	93.7	Very high	137 Å²	137	69.9 Å²	69.9	63%	0.634	34%	0.342	S	S	*	.			trans	-85.1	76.3	173.8	-65.8	-60.4	0	0	0	110.1	A41 R44	A41-H46 HydrophobicContact CB-CB 4.15Å; A41-H46 WeakPolarHBondContact O-CB 3.37Å; A41-H46 PolarHBondContact O-N 3.25Å; R44-H46 VanDerWaalsContact C-N 3.26Å; R44-H46 PolarHBondContact O-N 2.95Å
47	C	94.4	Very high	93.6	Very high	19 Å²	19	70.9 Å²	70.9	13%	0.128	35%	0.348	C	S	.	.			trans	-114.8	141.6	178.3	-63.5	0	0	0	0	110.6	G45 C66 W67	G45-C47 VanDerWaalsContact C-N 3.29Å; G45-C47 PolarHBondContact O-N 3.07Å; G45-C47 VanDerWaalsContact O-N 3.07Å; C47-C66 WeakPolarHBondContact CA-SG 3.44Å; C47-C66 HydrophobicContact CB-CB 3.72Å; C47-C66 WeakPolarHBondContact CB-SG 3.32Å; C47-C66 WeakPolarHBondContact SG-CB 3.37Å; C47-C66 PolarHBondContact SG-O 3.12Å; C47-C66 VanDerWaalsContact SG-O 3.38Å; C47-C66 CovalentContact SG-SG 2.03Å; C47-C66 PolarHBondContact SG-SG 2.74Å; C47-W67 HydrophobicContact CB-CD2 3.81Å; C47-W67 HydrophobicContact CB-CE3 4.28Å; C47-W67 HydrophobicContact CB-CG 4.25Å; C47-W67 HydrophobicContact CB-CH2 4.29Å; C47-W67 HydrophobicContact CB-CZ2 3.84Å; C47-W67 HydrophobicContact CB-CZ3 4.5Å
48	F	93	Very high	93.5	Very high	181 Å²	181	65.4 Å²	65.4	79%	0.794	33%	0.326	S	S	*	.			trans	-71	142.4	167	-65.4	-73.6	0	0	0	109.2	V50 N64	F48-V50 HydrophobicContact CB-CG2 3.95Å; F48-V50 PolarHBondContact O-N 3.15Å; F48-N64 PolarHBondContact O-ND2 2.87Å
49	N	92.2	Very high	93.4	Very high	147 Å²	147	65 Å²	65	79%	0.786	33%	0.328	S	S	*	.			trans	-79.2	55.4	173.3	-66.7	-24.3	0	0	0	110.9	W67	N49-W67 WeakPolarHBondContact OD1-CZ2 3.46Å
50	V	94.2	Very high	93.5	Very high	80 Å²	80	66.7 Å²	66.7	49%	0.485	33%	0.333	S	S	.	.			trans	-95.2	123.2	173.3	176	0	0	0	0	107.8	F48 R52 N64	F48-V50 HydrophobicContact CB-CG2 3.95Å; F48-V50 PolarHBondContact O-N 3.15Å; V50-R52 PolarHBondContact O-N 2.71Å; V50-N64 PolarHBondContact O-ND2 2.81Å
51	Y	96.3	Very high	93.6	Very high	128 Å²	128	66.3 Å²	66.3	50%	0.502	33%	0.33	S	S	.	.			trans	-77.3	109.3	174.4	-162.5	-113.2	0	0	0	110.1	P53 D63 E86	Y51-P53 HydrophobicContact CD1-CG 4.38Å; Y51-P53 HydrophobicContact CE1-CB 4.35Å; Y51-P53 HydrophobicContact CE1-CG 3.77Å; Y51-P53 HydrophobicContact CE2-CB 4.47Å; Y51-D63 HydrophobicContact CD2-CB 4.25Å; Y51-D63 HydrophobicContact CE2-CB 4.38Å; Y51-E86 PolarHBondContact OH-OE1 3.42Å
52	R	96.6	Very high	93.9	Very high	176 Å²	176	65 Å²	65	66%	0.664	32%	0.316	S	S	*	.			trans	-147.1	77.2	175	-175.2	-172.1	-61.4	176.2	0.8	107.1	V50 D63 N64	V50-R52 PolarHBondContact O-N 2.71Å; R52-D63 CarbonylContact C-O 3.34Å; R52-D63 PolarHBondContact N-O 3.42Å; R52-N64 HydrophobicContact CB-CB 4.47Å; R52-N64 WeakPolarHBondContact O-CA 3.45Å
53	P	97	Very high	94	Very high	25 Å²	25	69.1 Å²	69.1	16%	0.162	34%	0.338	C	S	.	.			trans	-64.6	146.7	-165.8	25.3	-34.1	0	0	0	111.7	Y51 T61 Y62 G85 E86	Y51-P53 HydrophobicContact CD1-CG 4.38Å; Y51-P53 HydrophobicContact CE1-CB 4.35Å; Y51-P53 HydrophobicContact CE1-CG 3.77Å; Y51-P53 HydrophobicContact CE2-CB 4.47Å; P53-T61 HydrophobicContact CB-CG2 3.95Å; P53-Y62 CarbonylContact C-O 3.54Å; P53-Y62 WeakPolarHBondContact CA-O 3.34Å; P53-G85 CarbonylContact C-O 3.57Å; P53-G85 CarbonylContact O-C 3.52Å; P53-G85 WeakPolarHBondContact O-CA 3.49Å; P53-G85 PolarHBondContact O-N 3.27Å; P53-E86 HydrophobicContact CB-CG 3.67Å; P53-E86 HydrophobicContact CG-CG 3.66Å
54	V	96	Very high	94.2	Very high	3 Å²	3	67.6 Å²	67.6	2%	0.018	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	140.6	170.5	-64.2	0	0	0	0	109.4	Y62 M68 I81 G85	V54-Y62 HydrophobicContact CG2-CD2 4.49Å; V54-Y62 PolarHBondContact N-O 2.99Å; V54-Y62 PolarHBondContact O-N 2.9Å; V54-M68 HydrophobicContact CG2-SD 3.98Å; V54-I81 HydrophobicContact CB-CG2 4.27Å; V54-I81 HydrophobicContact CG1-CD1 4.48Å; V54-G85 CarbonylContact C-O 3.51Å; V54-G85 WeakPolarHBondContact CA-O 3.47Å; V54-G85 PolarHBondContact N-O 3.12Å
55	C	94.8	Very high	94.3	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	120.7	175.3	-175.9	0	0	0	0	109.1	A82 Y83 G85 C87	C55-A82 WeakPolarHBondContact O-CB 3.22Å; C55-A82 PolarHBondContact O-N 2.96Å; C55-Y83 HydrophobicContact CB-CD1 4.27Å; C55-Y83 HydrophobicContact CB-CD2 3.9Å; C55-Y83 HydrophobicContact CB-CE1 3.93Å; C55-Y83 HydrophobicContact CB-CE2 3.56Å; C55-Y83 HydrophobicContact CB-CG 4.25Å; C55-Y83 PolarHBondContact N-O 3.24Å; C55-Y83 VanDerWaalsContact SG-CZ 3.55Å; C55-Y83 PolarHBondContact SG-OH 3.44Å; C55-G85 PolarHBondContact N-O 3.2Å; C55-C87 WeakPolarHBondContact CA-SG 3.05Å; C55-C87 HydrophobicContact CB-CB 4Å; C55-C87 WeakPolarHBondContact CB-SG 3.44Å; C55-C87 WeakPolarHBondContact SG-CA 3.45Å; C55-C87 WeakPolarHBondContact SG-CB 3.23Å; C55-C87 CovalentContact SG-SG 2.04Å; C55-C87 PolarHBondContact SG-SG 3.27Å
56	G	93.3	Very high	94.5	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	157.1	174	0	0	0	0	0	112.2	D58 G59 I60 K80	G56-D58 WeakPolarHBondContact CA-OD1 3.02Å; G56-D58 PolarHBondContact O-N 2.48Å; G56-D58 VanDerWaalsContact O-N 3.15Å; G56-G59 PolarHBondContact O-N 2.83Å; G56-I60 PolarHBondContact N-O 3.05Å; G56-K80 CarbonylContact C-O 3.03Å; G56-K80 WeakPolarHBondContact CA-O 3.35Å
57	T	91.6	Very high	94.6	Very high	45 Å²	45	60 Å²	60	28%	0.276	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-12.9	168.8	49.8	0	0	0	0	113.2	V33 G59 K80 A82 P93	V33-T57 HydrophobicContact CB-CG2 4.44Å; V33-T57 HydrophobicContact CG1-CG2 3.67Å; V33-T57 HydrophobicContact CG2-CG2 3.8Å; T57-G59 VanDerWaalsContact C-N 3.3Å; T57-K80 HydrophobicContact CG2-CB 3.92Å; T57-K80 WeakPolarHBondContact CG2-O 3.35Å; T57-K80 PolarHBondContact N-O 3.11Å; T57-K80 PolarHBondContact OG1-N 2.75Å; T57-K80 VanDerWaalsContact OG1-N 3.11Å; T57-K80 PolarHBondContact OG1-O 3Å; T57-A82 HydrophobicContact CG2-CB 4.37Å; T57-P93 WeakPolarHBondContact O-CB 3.02Å
58	D	91.2	Very high	94.6	Very high	47 Å²	47	59.1 Å²	59.1	25%	0.251	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-1.9	172.2	66.3	-22.2	0	0	0	113.1	G56 I60 Y62 R71 V79	G56-D58 WeakPolarHBondContact CA-OD1 3.02Å; G56-D58 PolarHBondContact O-N 2.48Å; G56-D58 VanDerWaalsContact O-N 3.15Å; D58-I60 VanDerWaalsContact C-N 3.3Å; D58-I60 PolarHBondContact OD1-N 2.97Å; D58-I60 WeakPolarHBondContact OD2-CD1 3.48Å; D58-Y62 PolarHBondContact OD2-OH 2.94Å; D58-Y62 VanDerWaalsContact OD2-OH 3.12Å; D58-R71 IonicContact OD2-CZ 2.92Å; D58-R71 IonicContact OD2-NH1 3Å; D58-R71 PolarHBondContact OD2-NH1 3.29Å; D58-R71 IonicContact OD2-NH2 3.72Å; D58-V79 HydrophobicContact CB-CG1 4.11Å; D58-V79 HydrophobicContact CB-CG2 4.24Å; D58-V79 VanDerWaalsContact OD1-CG1 3.32Å; D58-V79 WeakPolarHBondContact OD1-CG1 3.09Å
59	G	92.1	Very high	94.8	Very high	25 Å²	25	50.5 Å²	50.5	26%	0.258	26%	0.255	S	S	.	.	S	Bend	trans	76.6	14.8	-179.4	0	0	0	0	0	114.8	G56 T57	G56-G59 PolarHBondContact O-N 2.83Å; T57-G59 VanDerWaalsContact C-N 3.3Å
60	I	93.7	Very high	94.9	Very high	72 Å²	72	46.3 Å²	46.3	37%	0.369	23%	0.231	S	C	.	.			trans	-98.2	131.1	176	-67.1	174	0	0	0	109.1	G56 D58 Y62	G56-I60 PolarHBondContact N-O 3.05Å; D58-I60 VanDerWaalsContact C-N 3.3Å; D58-I60 PolarHBondContact OD1-N 2.97Å; D58-I60 WeakPolarHBondContact OD2-CD1 3.48Å; I60-Y62 HydrophobicContact CB-CE2 4.22Å; I60-Y62 HydrophobicContact CG2-CE2 4.27Å; I60-Y62 WeakPolarHBondContact O-CD2 3.36Å; I60-Y62 WeakPolarHBondContact O-CE2 3.17Å
61	T	95.8	Very high	95	Very high	51 Å²	51	45 Å²	45	31%	0.313	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	125.5	168.9	-59.6	0	0	0	0	109.4	P53 E86 C87	P53-T61 HydrophobicContact CB-CG2 3.95Å; T61-E86 HydrophobicContact CG2-CB 3.92Å; T61-E86 HydrophobicContact CG2-CG 3.93Å; T61-C87 WeakPolarHBondContact OG1-CB 3.23Å; T61-C87 PolarHBondContact OG1-N 2.89Å
62	Y	95.8	Very high	94.9	Very high	12 Å²	12	40.2 Å²	40.2	5%	0.047	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	130.6	173.7	-63.4	-94.2	0	0	0	110.1	P53 V54 D58 I60 N64 M68 R71 V79	P53-Y62 CarbonylContact C-O 3.54Å; P53-Y62 WeakPolarHBondContact CA-O 3.34Å; V54-Y62 HydrophobicContact CG2-CD2 4.49Å; V54-Y62 PolarHBondContact N-O 2.99Å; V54-Y62 PolarHBondContact O-N 2.9Å; D58-Y62 PolarHBondContact OD2-OH 2.94Å; D58-Y62 VanDerWaalsContact OD2-OH 3.12Å; I60-Y62 HydrophobicContact CB-CE2 4.22Å; I60-Y62 HydrophobicContact CG2-CE2 4.27Å; I60-Y62 WeakPolarHBondContact O-CD2 3.36Å; I60-Y62 WeakPolarHBondContact O-CE2 3.17Å; Y62-N64 PolarHBondContact O-N 2.81Å; Y62-M68 HydrophobicContact CD1-CB 3.54Å; Y62-M68 HydrophobicContact CD1-CG 3.86Å; Y62-M68 HydrophobicContact CD2-CB 4.15Å; Y62-M68 HydrophobicContact CD2-CG 3.9Å; Y62-M68 HydrophobicContact CD2-SD 4.23Å; Y62-M68 HydrophobicContact CE1-CB 3.9Å; Y62-M68 HydrophobicContact CE1-CG 3.77Å; Y62-M68 HydrophobicContact CE2-CE 4.42Å; Y62-M68 HydrophobicContact CE2-CG 3.89Å; Y62-M68 HydrophobicContact CE2-SD 4.36Å; Y62-M68 HydrophobicContact CG-CB 3.62Å; Y62-M68 HydrophobicContact CG-CG 3.87Å; Y62-R71 HydrophobicContact CE1-CB 4.11Å; Y62-R71 VanDerWaalsContact CE1-CD 3.42Å; Y62-R71 HydrophobicContact CE1-CG 4.4Å; Y62-R71 PolarHBondContact OH-NH1 3.3Å; Y62-V79 HydrophobicContact CE2-CG1 4.27Å; Y62-V79 WeakPolarHBondContact OH-CG2 3.48Å
63	D	95.6	Very high	94.7	Very high	89 Å²	89	38.5 Å²	38.5	48%	0.476	19%	0.194	S	C	.	.	S	Bend	trans	-50.2	-36.8	-180	-70.7	-9.8	0	0	0	113.4	Y51 R52	Y51-D63 HydrophobicContact CD2-CB 4.25Å; Y51-D63 HydrophobicContact CE2-CB 4.38Å; R52-D63 CarbonylContact C-O 3.34Å; R52-D63 PolarHBondContact N-O 3.42Å
64	N	94.8	Very high	94.5	Very high	13 Å²	13	42.9 Å²	42.9	7%	0.07	22%	0.216	C	C	.	.	S	Bend	trans	-158.8	165.8	167.4	59.2	58.2	0	0	0	111.9	F48 V50 R52 Y62 C66 W67 M68	F48-N64 PolarHBondContact O-ND2 2.87Å; V50-N64 PolarHBondContact O-ND2 2.81Å; R52-N64 HydrophobicContact CB-CB 4.47Å; R52-N64 WeakPolarHBondContact O-CA 3.45Å; Y62-N64 PolarHBondContact O-N 2.81Å; N64-C66 PolarHBondContact O-N 2.88Å; N64-C66 WeakPolarHBondContact OD1-CA 3.32Å; N64-C66 VanDerWaalsContact OD1-CB 3.23Å; N64-C66 WeakPolarHBondContact OD1-CB 3.47Å; N64-C66 PolarHBondContact OD1-N 3.12Å; N64-C66 VanDerWaalsContact OD1-N 3.08Å; N64-W67 VanDerWaalsContact CG-CD1 3.49Å; N64-W67 PolarHBondContact O-N 2.96Å; N64-W67 VanDerWaalsContact O-N 3.15Å; N64-W67 VanDerWaalsContact OD1-CD1 3.29Å; N64-W67 PolarHBondContact OD1-N 3.34Å; N64-M68 PolarHBondContact O-N 2.92Å
65	E	95.3	Very high	94.4	Very high	43 Å²	43	47.5 Å²	47.5	20%	0.201	24%	0.237	C	C	.	.	H	α-helix	trans	-56.9	-29	177.9	-173.7	170.3	-156.3	0	0	113.3	R34 P36 F37 M68 C69 I81	R34-E65 IonicContact NH2-OE1 2.96Å; R34-E65 PolarHBondContact NH2-OE1 2.78Å; R34-E65 IonicContact NH2-OE2 3.87Å; P36-E65 WeakPolarHBondContact CA-OE1 3.17Å; P36-E65 HydrophobicContact CB-CG 3.99Å; F37-E65 PolarHBondContact N-OE1 2.91Å; E65-M68 WeakPolarHBondContact O-CB 3.42Å; E65-C69 PolarHBondContact O-N 2.78Å; E65-C69 PolarHBondContact O-SG 3.49Å; E65-I81 HydrophobicContact CG-CD1 4.12Å; E65-I81 WeakPolarHBondContact OE1-CD1 3.48Å
66	C	96.5	Very high	94.2	Very high	31 Å²	31	50.7 Å²	50.7	21%	0.209	27%	0.27	C	S	.	.	H	α-helix	trans	-69.6	-46.7	176.7	-173.3	0	0	0	0	111.4	A42 C47 N64 M68 C69 F70	A42-C66 HydrophobicContact CB-CB 4.35Å; A42-C66 WeakPolarHBondContact CB-SG 3.45Å; C47-C66 WeakPolarHBondContact CA-SG 3.44Å; C47-C66 HydrophobicContact CB-CB 3.72Å; C47-C66 WeakPolarHBondContact CB-SG 3.32Å; C47-C66 WeakPolarHBondContact SG-CB 3.37Å; C47-C66 PolarHBondContact SG-O 3.12Å; C47-C66 VanDerWaalsContact SG-O 3.38Å; C47-C66 CovalentContact SG-SG 2.03Å; C47-C66 PolarHBondContact SG-SG 2.74Å; N64-C66 PolarHBondContact O-N 2.88Å; N64-C66 WeakPolarHBondContact OD1-CA 3.32Å; N64-C66 VanDerWaalsContact OD1-CB 3.23Å; N64-C66 WeakPolarHBondContact OD1-CB 3.47Å; N64-C66 PolarHBondContact OD1-N 3.12Å; N64-C66 VanDerWaalsContact OD1-N 3.08Å; C66-M68 VanDerWaalsContact C-N 3.28Å; C66-M68 PolarHBondContact O-N 3.2Å; C66-C69 WeakPolarHBondContact O-CB 3.39Å; C66-C69 PolarHBondContact O-N 2.81Å; C66-C69 VanDerWaalsContact O-N 3.17Å; C66-F70 PolarHBondContact O-N 3.36Å
67	W	95.7	Very high	94	Very high	73 Å²	73	53.1 Å²	53.1	28%	0.277	29%	0.285	S	S	.	.	H	α-helix	trans	-65	-33.6	175.7	-73.3	125.4	0	0	0	112.2	C47 N49 N64 F70 R71	C47-W67 HydrophobicContact CB-CD2 3.81Å; C47-W67 HydrophobicContact CB-CE3 4.28Å; C47-W67 HydrophobicContact CB-CG 4.25Å; C47-W67 HydrophobicContact CB-CH2 4.29Å; C47-W67 HydrophobicContact CB-CZ2 3.84Å; C47-W67 HydrophobicContact CB-CZ3 4.5Å; N49-W67 WeakPolarHBondContact OD1-CZ2 3.46Å; N64-W67 VanDerWaalsContact CG-CD1 3.49Å; N64-W67 PolarHBondContact O-N 2.96Å; N64-W67 VanDerWaalsContact O-N 3.15Å; N64-W67 VanDerWaalsContact OD1-CD1 3.29Å; N64-W67 PolarHBondContact OD1-N 3.34Å; W67-F70 HydrophobicContact CE3-CB 4.19Å; W67-F70 AromaticContact CE3-CD1 3.9Å; W67-F70 HydrophobicContact CE3-CD1 3.9Å; W67-F70 HydrophobicContact CE3-CG 4.29Å; W67-F70 AromaticContact CZ3-CD1 3.92Å; W67-F70 HydrophobicContact CZ3-CD1 3.92Å; W67-F70 HydrophobicContact CZ3-CE1 4.4Å; W67-F70 HydrophobicContact CZ3-CG 4.37Å; W67-F70 PolarHBondContact O-N 3.37Å; W67-R71 PolarHBondContact O-N 3.47Å
68	M	96.2	Very high	93.9	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-57.1	-51	169	-177.1	-175.5	177.3	0	0	111.7	P36 V54 Y62 N64 E65 C66 F70 R71 M72 V79 I81	P36-M68 HydrophobicContact CB-CE 4.45Å; P36-M68 HydrophobicContact CB-SD 4.15Å; P36-M68 HydrophobicContact CG-CE 4.2Å; P36-M68 HydrophobicContact CG-SD 4.49Å; V54-M68 HydrophobicContact CG2-SD 3.98Å; Y62-M68 HydrophobicContact CD1-CB 3.54Å; Y62-M68 HydrophobicContact CD1-CG 3.86Å; Y62-M68 HydrophobicContact CD2-CB 4.15Å; Y62-M68 HydrophobicContact CD2-CG 3.9Å; Y62-M68 HydrophobicContact CD2-SD 4.23Å; Y62-M68 HydrophobicContact CE1-CB 3.9Å; Y62-M68 HydrophobicContact CE1-CG 3.77Å; Y62-M68 HydrophobicContact CE2-CE 4.42Å; Y62-M68 HydrophobicContact CE2-CG 3.89Å; Y62-M68 HydrophobicContact CE2-SD 4.36Å; Y62-M68 HydrophobicContact CG-CB 3.62Å; Y62-M68 HydrophobicContact CG-CG 3.87Å; N64-M68 PolarHBondContact O-N 2.92Å; E65-M68 WeakPolarHBondContact O-CB 3.42Å; C66-M68 VanDerWaalsContact C-N 3.28Å; C66-M68 PolarHBondContact O-N 3.2Å; M68-F70 VanDerWaalsContact C-N 3.31Å; M68-F70 PolarHBondContact O-N 3.37Å; M68-R71 PolarHBondContact O-N 3.27Å; M68-M72 HydrophobicContact CE-SD 4.18Å; M68-M72 HydrophobicContact CG-SD 4.12Å; M68-M72 VanDerWaalsContact O-CG 3.27Å; M68-M72 WeakPolarHBondContact O-CG 3.14Å; M68-M72 PolarHBondContact O-N 3.42Å; M68-V79 HydrophobicContact CE-CB 3.74Å; M68-V79 HydrophobicContact CE-CG1 3.61Å; M68-V79 WeakPolarHBondContact CE-O 3.35Å; M68-I81 HydrophobicContact CE-CG1 4.04Å; M68-I81 HydrophobicContact SD-CD1 4.44Å; M68-I81 HydrophobicContact SD-CG1 3.72Å
69	C	95.8	Very high	93.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.1	-34.5	177.4	-69.6	0	0	0	0	113.6	C38 A42 E65 C66 Y73	C38-C69 WeakPolarHBondContact CA-SG 3.32Å; C38-C69 HydrophobicContact CB-CB 3.59Å; C38-C69 WeakPolarHBondContact CB-SG 3.45Å; C38-C69 WeakPolarHBondContact SG-CB 3.49Å; C38-C69 CovalentContact SG-SG 2.03Å; C38-C69 PolarHBondContact SG-SG 2.96Å; A42-C69 HydrophobicContact CB-CB 3.79Å; E65-C69 PolarHBondContact O-N 2.78Å; E65-C69 PolarHBondContact O-SG 3.49Å; C66-C69 WeakPolarHBondContact O-CB 3.39Å; C66-C69 PolarHBondContact O-N 2.81Å; C66-C69 VanDerWaalsContact O-N 3.17Å; C69-Y73 PolarHBondContact O-N 3.15Å
70	F	95.8	Very high	94	Very high	60 Å²	60	59.5 Å²	59.5	26%	0.263	31%	0.306	S	S	.	.	H	α-helix	trans	-62.4	-49.9	173.3	177.5	-115.1	0	0	0	110.9	A42 C66 W67 M68 M72 Y73 D74	A42-F70 WeakPolarHBondContact O-CA 3.32Å; A42-F70 VanDerWaalsContact O-CB 3.3Å; A42-F70 WeakPolarHBondContact O-CB 3.22Å; C66-F70 PolarHBondContact O-N 3.36Å; W67-F70 HydrophobicContact CE3-CB 4.19Å; W67-F70 AromaticContact CE3-CD1 3.9Å; W67-F70 HydrophobicContact CE3-CD1 3.9Å; W67-F70 HydrophobicContact CE3-CG 4.29Å; W67-F70 AromaticContact CZ3-CD1 3.92Å; W67-F70 HydrophobicContact CZ3-CD1 3.92Å; W67-F70 HydrophobicContact CZ3-CE1 4.4Å; W67-F70 HydrophobicContact CZ3-CG 4.37Å; W67-F70 PolarHBondContact O-N 3.37Å; M68-F70 VanDerWaalsContact C-N 3.31Å; M68-F70 PolarHBondContact O-N 3.37Å; F70-M72 VanDerWaalsContact C-N 3.34Å; F70-M72 PolarHBondContact O-N 3.18Å; F70-Y73 WeakPolarHBondContact O-CB 3.41Å; F70-Y73 PolarHBondContact O-N 3.04Å; F70-Y73 VanDerWaalsContact O-N 3.12Å; F70-D74 HydrophobicContact CZ-CB 4.43Å; F70-D74 WeakPolarHBondContact O-CB 3.36Å; F70-D74 PolarHBondContact O-N 3.02Å
71	R	94.6	Very high	94	Very high	52 Å²	52	56.1 Å²	56.1	20%	0.196	29%	0.289	C	S	.	.	H	α-helix	trans	-59.9	-43.8	177.9	-170.1	-165	175.6	-147.4	-18.2	112	D58 Y62 W67 M68 Y73 D74 E75	D58-R71 IonicContact OD2-CZ 2.92Å; D58-R71 IonicContact OD2-NH1 3Å; D58-R71 PolarHBondContact OD2-NH1 3.29Å; D58-R71 IonicContact OD2-NH2 3.72Å; Y62-R71 HydrophobicContact CE1-CB 4.11Å; Y62-R71 VanDerWaalsContact CE1-CD 3.42Å; Y62-R71 HydrophobicContact CE1-CG 4.4Å; Y62-R71 PolarHBondContact OH-NH1 3.3Å; W67-R71 PolarHBondContact O-N 3.47Å; M68-R71 PolarHBondContact O-N 3.27Å; R71-Y73 PolarHBondContact O-N 3.48Å; R71-D74 PolarHBondContact O-N 3.43Å; R71-E75 VanDerWaalsContact CG-CD 3.46Å; R71-E75 HydrophobicContact CG-CG 4.07Å; R71-E75 WeakPolarHBondContact CG-OE1 3.24Å; R71-E75 IonicContact CZ-OE1 2.96Å; R71-E75 IonicContact CZ-OE2 3.93Å; R71-E75 IonicContact NE-OE1 3.36Å; R71-E75 PolarHBondContact NE-OE1 2.62Å; R71-E75 IonicContact NE-OE2 3.91Å; R71-E75 PolarHBondContact NE-OE2 2.8Å; R71-E75 IonicContact NH2-OE1 2.74Å; R71-E75 IonicContact NH2-OE2 3.72Å; R71-E75 PolarHBondContact NH2-OE2 3Å; R71-E75 WeakPolarHBondContact O-CB 3.23Å; R71-E75 PolarHBondContact O-N 3.48Å
72	M	94.2	Very high	93.8	Very high	27 Å²	27	54.1 Å²	54.1	13%	0.133	28%	0.278	C	S	.	.	H	α-helix	trans	-56.2	-39.1	176.6	-71.5	168.8	68.1	0	0	112	P36 M68 F70 G76 V77 L78 V79	P36-M72 HydrophobicContact CG-CE 4.07Å; P36-M72 HydrophobicContact CG-SD 3.87Å; M68-M72 HydrophobicContact CE-SD 4.18Å; M68-M72 HydrophobicContact CG-SD 4.12Å; M68-M72 VanDerWaalsContact O-CG 3.27Å; M68-M72 WeakPolarHBondContact O-CG 3.14Å; M68-M72 PolarHBondContact O-N 3.42Å; F70-M72 VanDerWaalsContact C-N 3.34Å; F70-M72 PolarHBondContact O-N 3.18Å; M72-G76 CarbonylContact O-C 3.11Å; M72-G76 VanDerWaalsContact O-CA 3.26Å; M72-G76 WeakPolarHBondContact O-CA 3.33Å; M72-G76 PolarHBondContact O-N 2.93Å; M72-G76 VanDerWaalsContact O-N 3.12Å; M72-V77 VanDerWaalsContact CA-O 3.24Å; M72-V77 WeakPolarHBondContact CA-O 3.26Å; M72-V77 VanDerWaalsContact CB-O 3.23Å; M72-V77 WeakPolarHBondContact CB-O 3.09Å; M72-V77 WeakPolarHBondContact CG-O 3.47Å; M72-V77 PolarHBondContact O-N 3.39Å; M72-L78 HydrophobicContact CE-CD1 3.92Å; M72-V79 WeakPolarHBondContact CE-O 3.19Å; M72-V79 HydrophobicContact CG-CB 4.43Å
73	Y	93.3	Very high	93.7	Very high	140 Å²	140	56.1 Å²	56.1	55%	0.549	29%	0.286	S	S	.	.	H	α-helix	trans	-74.8	-46.3	177.8	-177.6	-96.9	0	0	0	112.7	W43 C69 F70 R71	W43-Y73 HydrophobicContact CB-CD1 4.27Å; W43-Y73 HydrophobicContact CB-CD2 4.04Å; W43-Y73 HydrophobicContact CB-CG 3.89Å; W43-Y73 HydrophobicContact CG-CD2 4.24Å; W43-Y73 HydrophobicContact CG-CG 4.38Å; W43-Y73 WeakPolarHBondContact O-CD1 3.41Å; C69-Y73 PolarHBondContact O-N 3.15Å; F70-Y73 WeakPolarHBondContact O-CB 3.41Å; F70-Y73 PolarHBondContact O-N 3.04Å; F70-Y73 VanDerWaalsContact O-N 3.12Å; R71-Y73 PolarHBondContact O-N 3.48Å
74	D	93.4	Very high	93.6	Very high	117 Å²	117	56.9 Å²	56.9	63%	0.626	29%	0.29	S	S	*	.	H	α-helix	trans	-68.2	-44.6	-175.6	-169.2	62.1	0	0	0	112.3	F70 R71	F70-D74 HydrophobicContact CZ-CB 4.43Å; F70-D74 WeakPolarHBondContact O-CB 3.36Å; F70-D74 PolarHBondContact O-N 3.02Å; R71-D74 PolarHBondContact O-N 3.43Å
75	E	93	Very high	93.6	Very high	100 Å²	100	57.4 Å²	57.4	47%	0.467	30%	0.298	S	S	.	.	H	α-helix	trans	-87.9	-13.4	179.7	-63.9	179	-163.2	0	0	113	R71 V77	R71-E75 VanDerWaalsContact CG-CD 3.46Å; R71-E75 HydrophobicContact CG-CG 4.07Å; R71-E75 WeakPolarHBondContact CG-OE1 3.24Å; R71-E75 IonicContact CZ-OE1 2.96Å; R71-E75 IonicContact CZ-OE2 3.93Å; R71-E75 IonicContact NE-OE1 3.36Å; R71-E75 PolarHBondContact NE-OE1 2.62Å; R71-E75 IonicContact NE-OE2 3.91Å; R71-E75 PolarHBondContact NE-OE2 2.8Å; R71-E75 IonicContact NH2-OE1 2.74Å; R71-E75 IonicContact NH2-OE2 3.72Å; R71-E75 PolarHBondContact NH2-OE2 3Å; R71-E75 WeakPolarHBondContact O-CB 3.23Å; R71-E75 PolarHBondContact O-N 3.48Å; E75-V77 VanDerWaalsContact C-N 3.28Å; E75-V77 HydrophobicContact CB-CG1 4.03Å; E75-V77 HydrophobicContact CB-CG2 4.08Å; E75-V77 PolarHBondContact O-N 3.32Å
76	G	90.2	Very high	93.7	Very high	67 Å²	67	60.3 Å²	60.3	69%	0.691	31%	0.312	S	S	*	.			trans	68.9	25	-174.6	0	0	0	0	0	113.8	M72	M72-G76 CarbonylContact O-C 3.11Å; M72-G76 VanDerWaalsContact O-CA 3.26Å; M72-G76 WeakPolarHBondContact O-CA 3.33Å; M72-G76 PolarHBondContact O-N 2.93Å; M72-G76 VanDerWaalsContact O-N 3.12Å
77	V	89.5	Confident	93.6	Very high	52 Å²	52	59.8 Å²	59.8	32%	0.315	31%	0.308	S	S	.	.			trans	-94.4	139.4	179	-62.6	0	0	0	0	111.1	M72 E75 V79	M72-V77 VanDerWaalsContact CA-O 3.24Å; M72-V77 WeakPolarHBondContact CA-O 3.26Å; M72-V77 VanDerWaalsContact CB-O 3.23Å; M72-V77 WeakPolarHBondContact CB-O 3.09Å; M72-V77 WeakPolarHBondContact CG-O 3.47Å; M72-V77 PolarHBondContact O-N 3.39Å; E75-V77 VanDerWaalsContact C-N 3.28Å; E75-V77 HydrophobicContact CB-CG1 4.03Å; E75-V77 HydrophobicContact CB-CG2 4.08Å; E75-V77 PolarHBondContact O-N 3.32Å; V77-V79 HydrophobicContact CB-CG2 4.36Å; V77-V79 HydrophobicContact CG2-CG2 4.01Å
78	L	90.4	Very high	93.3	Very high	151 Å²	151	63.9 Å²	63.9	79%	0.791	33%	0.325	S	S	*	.			trans	-100	107	171.9	-172.5	74.6	0	0	0	109	M72	M72-L78 HydrophobicContact CE-CD1 3.92Å
79	V	91.5	Very high	92.9	Very high	6 Å²	6	72.5 Å²	72.5	4%	0.036	37%	0.371	C	S	.	.			trans	-117.2	141.2	176.9	-172	0	0	0	0	108.4	D58 Y62 M68 M72 V77	D58-V79 HydrophobicContact CB-CG1 4.11Å; D58-V79 HydrophobicContact CB-CG2 4.24Å; D58-V79 VanDerWaalsContact OD1-CG1 3.32Å; D58-V79 WeakPolarHBondContact OD1-CG1 3.09Å; Y62-V79 HydrophobicContact CE2-CG1 4.27Å; Y62-V79 WeakPolarHBondContact OH-CG2 3.48Å; M68-V79 HydrophobicContact CE-CB 3.74Å; M68-V79 HydrophobicContact CE-CG1 3.61Å; M68-V79 WeakPolarHBondContact CE-O 3.35Å; M72-V79 WeakPolarHBondContact CE-O 3.19Å; M72-V79 HydrophobicContact CG-CB 4.43Å; V77-V79 HydrophobicContact CB-CG2 4.36Å; V77-V79 HydrophobicContact CG2-CG2 4.01Å
80	K	93.2	Very high	92.4	Very high	93 Å²	93	78.9 Å²	78.9	40%	0.404	41%	0.405	S	S	.	.			trans	-109.7	164.3	172.6	-60.8	-175.9	176.2	-174.6	0	109.9	V33 G56 T57 A82	V33-K80 HydrophobicContact CG1-CB 3.11Å; V33-K80 HydrophobicContact CG1-CD 3.52Å; V33-K80 HydrophobicContact CG1-CG 3.95Å; G56-K80 CarbonylContact C-O 3.03Å; G56-K80 WeakPolarHBondContact CA-O 3.35Å; T57-K80 HydrophobicContact CG2-CB 3.92Å; T57-K80 WeakPolarHBondContact CG2-O 3.35Å; T57-K80 PolarHBondContact N-O 3.11Å; T57-K80 PolarHBondContact OG1-N 2.75Å; T57-K80 VanDerWaalsContact OG1-N 3.11Å; T57-K80 PolarHBondContact OG1-O 3Å; K80-A82 PolarHBondContact O-N 3.06Å
81	I	93.1	Very high	91.7	Very high	2 Å²	2	79 Å²	79	1%	0.01	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	117.7	178.7	-61.6	171.4	0	0	0	108.3	V33 R34 P36 V54 E65 M68	V33-I81 CarbonylContact C-O 3.56Å; V33-I81 VanDerWaalsContact CA-O 3.32Å; V33-I81 WeakPolarHBondContact CA-O 3.27Å; V33-I81 WeakPolarHBondContact CG1-O 3.44Å; R34-I81 HydrophobicContact CB-CB 4.48Å; R34-I81 PolarHBondContact N-O 2.94Å; R34-I81 PolarHBondContact O-N 3.17Å; P36-I81 HydrophobicContact CB-CD1 3.95Å; P36-I81 HydrophobicContact CB-CG1 4.19Å; V54-I81 HydrophobicContact CB-CG2 4.27Å; V54-I81 HydrophobicContact CG1-CD1 4.48Å; E65-I81 HydrophobicContact CG-CD1 4.12Å; E65-I81 WeakPolarHBondContact OE1-CD1 3.48Å; M68-I81 HydrophobicContact CE-CG1 4.04Å; M68-I81 HydrophobicContact SD-CD1 4.44Å; M68-I81 HydrophobicContact SD-CG1 3.72Å
82	A	92.2	Very high	90.5	Very high	9 Å²	9	83.6 Å²	83.6	7%	0.074	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	-48.1	173.1	0	0	0	0	0	110.9	C55 T57 K80 Y91	C55-A82 WeakPolarHBondContact O-CB 3.22Å; C55-A82 PolarHBondContact O-N 2.96Å; T57-A82 HydrophobicContact CG2-CB 4.37Å; K80-A82 PolarHBondContact O-N 3.06Å; A82-Y91 HydrophobicContact CB-CE2 4.32Å; A82-Y91 VanDerWaalsContact CB-OH 3.23Å; A82-Y91 WeakPolarHBondContact CB-OH 3.46Å
83	Y	92.7	Very high	89.3	Confident	54 Å²	54	84.6 Å²	84.6	21%	0.212	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	157.9	174.2	49.2	-88.7	0	0	0	110.7	C55 E86 C87 Y88 Y91	C55-Y83 HydrophobicContact CB-CD1 4.27Å; C55-Y83 HydrophobicContact CB-CD2 3.9Å; C55-Y83 HydrophobicContact CB-CE1 3.93Å; C55-Y83 HydrophobicContact CB-CE2 3.56Å; C55-Y83 HydrophobicContact CB-CG 4.25Å; C55-Y83 PolarHBondContact N-O 3.24Å; C55-Y83 VanDerWaalsContact SG-CZ 3.55Å; C55-Y83 PolarHBondContact SG-OH 3.44Å; Y83-E86 WeakPolarHBondContact CE2-O 3.04Å; Y83-C87 VanDerWaalsContact OH-CA 3.32Å; Y83-C87 WeakPolarHBondContact OH-CA 3.01Å; Y83-Y88 HydrophobicContact CE2-CD2 4.19Å; Y83-Y88 AromaticContact CE2-CE2 3.92Å; Y83-Y88 HydrophobicContact CE2-CE2 3.92Å; Y83-Y88 AromaticContact CZ-CD2 3.77Å; Y83-Y88 AromaticContact CZ-CE2 3.88Å; Y83-Y88 WeakPolarHBondContact OH-CD2 3Å; Y83-Y88 PolarHBondContact OH-N 2.88Å; Y83-Y88 VanDerWaalsContact OH-N 3.07Å; Y83-Y91 AromaticContact CE1-CD2 3.77Å; Y83-Y91 HydrophobicContact CE1-CD2 3.77Å; Y83-Y91 AromaticContact CE1-CE2 3.64Å; Y83-Y91 HydrophobicContact CE1-CE2 3.64Å
84	D	94.4	Very high	87.6	Confident	104 Å²	104	85.5 Å²	85.5	56%	0.556	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	132.3	172.1	-56.7	-76.3	0	0	0	109.4	R34	R34-D84 IonicContact CZ-OD1 3.02Å; R34-D84 IonicContact NH1-OD1 3.43Å; R34-D84 PolarHBondContact NH1-OD1 3.24Å; R34-D84 IonicContact NH1-OD2 3.48Å; R34-D84 PolarHBondContact NH1-OD2 2.89Å; R34-D84 IonicContact NH2-OD1 3.71Å; R34-D84 PolarHBondContact NH2-OD1 3.3Å
85	G	95.5	Very high	85.8	Confident	24 Å²	24	86.1 Å²	86.1	25%	0.247	45%	0.451	C	S	.	.	S	Bend	trans	123.7	176.2	-171.4	0	0	0	0	0	113.2	P53 V54 C55	P53-G85 CarbonylContact C-O 3.57Å; P53-G85 CarbonylContact O-C 3.52Å; P53-G85 WeakPolarHBondContact O-CA 3.49Å; P53-G85 PolarHBondContact O-N 3.27Å; V54-G85 CarbonylContact C-O 3.51Å; V54-G85 WeakPolarHBondContact CA-O 3.47Å; V54-G85 PolarHBondContact N-O 3.12Å; C55-G85 PolarHBondContact N-O 3.2Å
86	E	96.1	Very high	83.8	Confident	105 Å²	105	85.5 Å²	85.5	49%	0.491	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-73.6	148.3	171.2	-56.9	177.4	160.6	0	0	110	Y51 P53 T61 Y83	Y51-E86 PolarHBondContact OH-OE1 3.42Å; P53-E86 HydrophobicContact CB-CG 3.67Å; P53-E86 HydrophobicContact CG-CG 3.66Å; T61-E86 HydrophobicContact CG2-CB 3.92Å; T61-E86 HydrophobicContact CG2-CG 3.93Å; Y83-E86 WeakPolarHBondContact CE2-O 3.04Å
87	C	94.6	Very high	81.9	Confident	20 Å²	20	88 Å²	88	14%	0.135	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-62.9	138.3	169.8	-63.9	0	0	0	0	110.8	C55 T61 Y83	C55-C87 WeakPolarHBondContact CA-SG 3.05Å; C55-C87 HydrophobicContact CB-CB 4Å; C55-C87 WeakPolarHBondContact CB-SG 3.44Å; C55-C87 WeakPolarHBondContact SG-CA 3.45Å; C55-C87 WeakPolarHBondContact SG-CB 3.23Å; C55-C87 CovalentContact SG-SG 2.04Å; C55-C87 PolarHBondContact SG-SG 3.27Å; T61-C87 WeakPolarHBondContact OG1-CB 3.23Å; T61-C87 PolarHBondContact OG1-N 2.89Å; Y83-C87 VanDerWaalsContact OH-CA 3.32Å; Y83-C87 WeakPolarHBondContact OH-CA 3.01Å
88	Y	90.6	Very high	80.1	Confident	158 Å²	158	90.2 Å²	90.2	62%	0.62	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-67.8	149.9	169.5	-57.9	-65.7	0	0	0	111.2	Y83 D90 Y91	Y83-Y88 HydrophobicContact CE2-CD2 4.19Å; Y83-Y88 AromaticContact CE2-CE2 3.92Å; Y83-Y88 HydrophobicContact CE2-CE2 3.92Å; Y83-Y88 AromaticContact CZ-CD2 3.77Å; Y83-Y88 AromaticContact CZ-CE2 3.88Å; Y83-Y88 WeakPolarHBondContact OH-CD2 3Å; Y83-Y88 PolarHBondContact OH-N 2.88Å; Y83-Y88 VanDerWaalsContact OH-N 3.07Å; Y88-D90 WeakPolarHBondContact CB-OD1 3.22Å; Y88-D90 PolarHBondContact O-N 3.07Å; Y88-Y91 WeakPolarHBondContact O-CB 3.3Å; Y88-Y91 PolarHBondContact O-N 2.88Å
89	D	88	Confident	78.1	Confident	181 Å²	181	90.5 Å²	90.5	97%	0.968	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-28.8	179.6	-68.4	-43.4	0	0	0	112.9
90	D	84.9	Confident	76.4	Confident	134 Å²	134	98 Å²	98	72%	0.717	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	11.2	175.7	62.8	-54.8	0	0	0	113	Y88 E92	Y88-D90 WeakPolarHBondContact CB-OD1 3.22Å; Y88-D90 PolarHBondContact O-N 3.07Å; D90-E92 PolarHBondContact O-N 3.08Å
91	Y	80.4	Confident	74.7	Confident	64 Å²	64	99.1 Å²	99.1	25%	0.251	53%	0.528	S	S	.	.			trans	-67.3	101.2	174.6	-174.9	-100.6	0	0	0	109.8	A82 Y83 Y88 P93	A82-Y91 HydrophobicContact CB-CE2 4.32Å; A82-Y91 VanDerWaalsContact CB-OH 3.23Å; A82-Y91 WeakPolarHBondContact CB-OH 3.46Å; Y83-Y91 AromaticContact CE1-CD2 3.77Å; Y83-Y91 HydrophobicContact CE1-CD2 3.77Å; Y83-Y91 AromaticContact CE1-CE2 3.64Å; Y83-Y91 HydrophobicContact CE1-CE2 3.64Å; Y88-Y91 WeakPolarHBondContact O-CB 3.3Å; Y88-Y91 PolarHBondContact O-N 2.88Å; Y91-P93 HydrophobicContact CE1-CB 4.01Å; Y91-P93 WeakPolarHBondContact O-CD 3.45Å
92	E	69.4	Low	72.9	Confident	148 Å²	148	104.5 Å²	104.5	69%	0.692	56%	0.561	S	S	*	*			trans	-90.3	109	171.9	-65.5	-139.6	139	0	0	110.2	D90 F94	D90-E92 PolarHBondContact O-N 3.08Å; E92-F94 PolarHBondContact O-N 2.89Å
93	P	69	Low	71.5	Confident	47 Å²	47	109.1 Å²	109.1	31%	0.305	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.3	18.4	-177.2	23.6	-32.3	0	0	0	115.3	T57 Y91	T57-P93 WeakPolarHBondContact O-CB 3.02Å; Y91-P93 HydrophobicContact CE1-CB 4.01Å; Y91-P93 WeakPolarHBondContact O-CD 3.45Å
94	F	58.8	Low	69.7	Low	159 Å²	159	114.7 Å²	114.7	70%	0.697	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.6	10.4	-174.5	-81.4	-86.5	0	0	0	115.3	E92 A96	E92-F94 PolarHBondContact O-N 2.89Å; F94-A96 PolarHBondContact O-N 3.07Å
95	V	54.3	Low	68.4	Low	131 Å²	131	116 Å²	116	79%	0.794	63%	0.625	S	S	*	*			trans	-80.2	-2.8	168.1	-164.8	0	0	0	0	112.3	L97	V95-L97 PolarHBondContact O-N 2.03Å; V95-L97 VanDerWaalsContact O-N 3.15Å
96	A	50.3	Low	67.1	Low	86 Å²	86	117.2 Å²	117.2	71%	0.711	63%	0.629	S	S	*	*	S	Bend	trans	-84.2	63	162.3	0	0	0	0	0	110.9	F94	F94-A96 PolarHBondContact O-N 3.07Å
97	L	51.1	Low	65.7	Low	120 Å²	120	117.6 Å²	117.6	63%	0.628	64%	0.641	S	S	*	*			trans	-99.4	148.5	162.3	-71.4	174.7	0	0	0	108.7	V95	V95-L97 PolarHBondContact O-N 2.03Å; V95-L97 VanDerWaalsContact O-N 3.15Å
98	P	50.9	Low	64.5	Low	98 Å²	98	124.2 Å²	124.2	64%	0.636	66%	0.663	S	S	*	*			cis	-103.4	152.5	12.3	21.2	-2.6	0	0	0	111.6	E100	P98-E100 PolarHBondContact O-N 3.38Å
99	L	49.2	Very low	63.3	Low	157 Å²	157	118.6 Å²	118.6	82%	0.822	64%	0.643	S	S	*	*			trans	-53.1	95.3	152.1	-62	170.2	0	0	0	106.4	P101	L99-P101 VanDerWaalsContact O-N 3.15Å
100	E	56.5	Low	61.8	Low	164 Å²	164	118.9 Å²	118.9	77%	0.766	64%	0.639	S	S	*	*			trans	-52.8	125.5	157	-68.1	-165.7	158.4	0	0	104.4	P98 V102	P98-E100 PolarHBondContact O-N 3.38Å; E100-V102 PolarHBondContact O-N 2.03Å
101	P	57.8	Low	61.1	Low	116 Å²	116	117.8 Å²	117.8	75%	0.753	64%	0.637	S	S	*	*			trans	-54.7	114.8	176	21.6	-30.1	0	0	0	105.8	L99 P103	L99-P101 VanDerWaalsContact O-N 3.15Å; P101-P103 WeakPolarHBondContact O-CD 3.42Å
102	V	55.4	Low	60.2	Low	116 Å²	116	118 Å²	118	70%	0.703	64%	0.644	S	S	*	*			trans	-45.5	116.4	167.9	177.4	0	0	0	0	104	E100 L104	E100-V102 PolarHBondContact O-N 2.03Å; V102-L104 PolarHBondContact O-N 2.75Å
103	P	61	Low	60	Low	106 Å²	106	115.1 Å²	115.1	69%	0.688	64%	0.639	S	S	*	*			trans	-53.2	118.9	-176.9	17.2	-28	0	0	0	105.3	P101 Q105	P101-P103 WeakPolarHBondContact O-CD 3.42Å; P103-Q105 VanDerWaalsContact C-N 3.33Å; P103-Q105 WeakPolarHBondContact O-CA 3.32Å; P103-Q105 PolarHBondContact O-N 2.93Å
104	L	56.5	Low	59.4	Low	171 Å²	171	122.2 Å²	122.2	90%	0.895	66%	0.661	S	S	*	*			trans	-44.8	107.7	179.3	-101	159.6	0	0	0	105.4	V102 P106	V102-L104 PolarHBondContact O-N 2.75Å; L104-P106 WeakPolarHBondContact O-CD 3.22Å
105	Q	66	Low	59.4	Low	131 Å²	131	122.3 Å²	122.3	61%	0.612	66%	0.661	S	S	*	*			trans	-52.7	119.8	-172.2	-85.1	-159.2	-36.9	0	0	106.1	P103 I109	P103-Q105 VanDerWaalsContact C-N 3.33Å; P103-Q105 WeakPolarHBondContact O-CA 3.32Å; P103-Q105 PolarHBondContact O-N 2.93Å; Q105-I109 HydrophobicContact CB-CB 4.01Å; Q105-I109 HydrophobicContact CB-CD1 3.54Å; Q105-I109 HydrophobicContact CB-CG1 4.27Å; Q105-I109 HydrophobicContact CB-CG2 4.24Å; Q105-I109 HydrophobicContact CG-CD1 3.61Å; Q105-I109 HydrophobicContact CG-CG2 4.39Å
106	P	68.5	Low	59.2	Low	49 Å²	49	119.7 Å²	119.7	32%	0.318	65%	0.647	S	S	.	*			trans	-53.9	147.8	-174.8	21	-37	0	0	0	109.3	L104 W108 I109	L104-P106 WeakPolarHBondContact O-CD 3.22Å; P106-W108 VanDerWaalsContact CB-CD1 3.49Å; P106-W108 HydrophobicContact CB-CG 4.35Å; P106-W108 HydrophobicContact CG-CD2 4.21Å; P106-W108 HydrophobicContact CG-CG 4.42Å; P106-W108 HydrophobicContact CG-CZ2 3.7Å; P106-W108 PolarHBondContact O-N 3.49Å; P106-I109 HydrophobicContact CG-CD1 3.91Å; P106-I109 HydrophobicContact CG-CG1 4.17Å; P106-I109 PolarHBondContact O-N 3.45Å
107	P	66.8	Low	59.5	Low	114 Å²	114	121 Å²	121	74%	0.74	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-54.7	-21.4	-167.3	-25.2	31	0	0	0	114.4	I109 Q110	P107-I109 PolarHBondContact O-N 3.17Å; P107-Q110 PolarHBondContact O-N 2.83Å
108	W	68.9	Low	59.4	Low	159 Å²	159	123.1 Å²	123.1	60%	0.602	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-70	-14	175	63.2	-101.5	0	0	0	114.1	P106 Q110 T111 V112	P106-W108 VanDerWaalsContact CB-CD1 3.49Å; P106-W108 HydrophobicContact CB-CG 4.35Å; P106-W108 HydrophobicContact CG-CD2 4.21Å; P106-W108 HydrophobicContact CG-CG 4.42Å; P106-W108 HydrophobicContact CG-CZ2 3.7Å; P106-W108 PolarHBondContact O-N 3.49Å; W108-Q110 PolarHBondContact O-N 3.44Å; W108-T111 WeakPolarHBondContact O-CB 3.49Å; W108-T111 PolarHBondContact O-N 3.26Å; W108-T111 PolarHBondContact O-OG1 3.47Å; W108-V112 PolarHBondContact O-N 3.1Å
109	I	65.8	Low	59.1	Low	40 Å²	40	119.8 Å²	119.8	21%	0.205	64%	0.642	C	S	.	*	G	3₁₀ helix	trans	-69.9	-22.8	174.8	-66.1	176.5	0	0	0	111.4	Q105 P106 P107 T111 V112	Q105-I109 HydrophobicContact CB-CB 4.01Å; Q105-I109 HydrophobicContact CB-CD1 3.54Å; Q105-I109 HydrophobicContact CB-CG1 4.27Å; Q105-I109 HydrophobicContact CB-CG2 4.24Å; Q105-I109 HydrophobicContact CG-CD1 3.61Å; Q105-I109 HydrophobicContact CG-CG2 4.39Å; P106-I109 HydrophobicContact CG-CD1 3.91Å; P106-I109 HydrophobicContact CG-CG1 4.17Å; P106-I109 PolarHBondContact O-N 3.45Å; P107-I109 PolarHBondContact O-N 3.17Å; I109-T111 PolarHBondContact O-N 3.17Å; I109-V112 HydrophobicContact CB-CG2 4.46Å; I109-V112 HydrophobicContact CG2-CG2 4.05Å; I109-V112 WeakPolarHBondContact O-CG2 3.11Å; I109-V112 PolarHBondContact O-N 2.67Å
110	Q	57	Low	58.5	Low	187 Å²	187	122 Å²	122	87%	0.874	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-71.1	-11.5	169.1	-63.4	-168.2	-18.8	0	0	113.3	P107 W108	P107-Q110 PolarHBondContact O-N 2.83Å; W108-Q110 PolarHBondContact O-N 3.44Å
111	T	69.6	Low	57.8	Low	110 Å²	110	119.3 Å²	119.3	68%	0.675	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-99.1	-10.9	178.4	68.5	0	0	0	0	113.7	W108 I109	W108-T111 WeakPolarHBondContact O-CB 3.49Å; W108-T111 PolarHBondContact O-N 3.26Å; W108-T111 PolarHBondContact O-OG1 3.47Å; I109-T111 PolarHBondContact O-N 3.17Å
112	V	60.8	Low	57	Low	68 Å²	68	122.1 Å²	122.1	41%	0.412	64%	0.637	S	S	.	*	S	Bend	trans	-82.8	128.5	166.6	-73	0	0	0	0	108.4	W108 I109 Y114	W108-V112 PolarHBondContact O-N 3.1Å; I109-V112 HydrophobicContact CB-CG2 4.46Å; I109-V112 HydrophobicContact CG2-CG2 4.05Å; I109-V112 WeakPolarHBondContact O-CG2 3.11Å; I109-V112 PolarHBondContact O-N 2.67Å; V112-Y114 PolarHBondContact O-N 3.33Å
113	P	66.4	Low	56.2	Low	89 Å²	89	119.5 Å²	119.5	58%	0.578	63%	0.633	S	S	*	*			trans	-49	133.2	162.9	-21.2	31	0	0	0	107.9	F115	P113-F115 HydrophobicContact CB-CD2 4.49Å; P113-F115 HydrophobicContact CB-CE2 4.1Å; P113-F115 HydrophobicContact CG-CE2 4.2Å; P113-F115 WeakPolarHBondContact O-CD2 3.28Å; P113-F115 PolarHBondContact O-N 2.95Å
114	Y	56.5	Low	55.2	Low	196 Å²	196	125.3 Å²	125.3	77%	0.769	65%	0.648	S	S	*	*			trans	-54.9	107	172	176.3	-99.8	0	0	0	107.8	V112 P116	V112-Y114 PolarHBondContact O-N 3.33Å; Y114-P116 HydrophobicContact CE1-CB 3.93Å; Y114-P116 WeakPolarHBondContact O-CD 3.4Å
115	F	57.7	Low	54.3	Low	161 Å²	161	120.1 Å²	120.1	71%	0.706	64%	0.636	S	S	*	*			trans	-89.1	101.5	171.7	-79.7	-84.5	0	0	0	105.8	P113	P113-F115 HydrophobicContact CB-CD2 4.49Å; P113-F115 HydrophobicContact CB-CE2 4.1Å; P113-F115 HydrophobicContact CG-CE2 4.2Å; P113-F115 WeakPolarHBondContact O-CD2 3.28Å; P113-F115 PolarHBondContact O-N 2.95Å
116	P	51.5	Low	52.8	Low	75 Å²	75	122.9 Å²	122.9	49%	0.487	65%	0.646	S	S	.	*			trans	-54	152.1	169.4	23.9	-32.7	0	0	0	108.7	Y114 I118	Y114-P116 HydrophobicContact CE1-CB 3.93Å; Y114-P116 WeakPolarHBondContact O-CD 3.4Å; P116-I118 PolarHBondContact O-N 3.44Å
117	P	54.8	Low	51.7	Low	115 Å²	115	127.6 Å²	127.6	75%	0.747	67%	0.667	S	S	*	*			trans	-45.5	130.9	171	-23.5	32	0	0	0	108.4	G119	P117-G119 PolarHBondContact O-N 3Å
118	I	50.7	Low	50.3	Low	163 Å²	163	130.4 Å²	130.4	84%	0.836	67%	0.671	S	S	*	*			trans	-70.9	72.1	-177.3	-49.3	169.9	0	0	0	107.8	P116	P116-I118 PolarHBondContact O-N 3.44Å
119	G	44.6	Very low	49.2	Very low	29 Å²	29	130.2 Å²	130.2	30%	0.299	68%	0.676	S	S	.	*			trans	-93.2	117.4	162.4	0	0	0	0	0	107	P117 H121	P117-G119 PolarHBondContact O-N 3Å; G119-H121 PolarHBondContact O-CD2 3.42Å; G119-H121 VanDerWaalsContact O-CD2 3.31Å; G119-H121 PolarHBondContact O-N 3.46Å; G119-H121 VanDerWaalsContact O-N 3.11Å
120	Y	35.3	Very low	48	Very low	202 Å²	202	135.4 Å²	135.4	79%	0.792	70%	0.697	S	S	*	*			trans	-48.1	110.3	-172.2	-77.6	-105	0	0	0	114
121	H	42.9	Very low	47.2	Very low	109 Å²	109	129.9 Å²	129.9	51%	0.505	69%	0.69	S	S	.	*			trans	-124	85.9	163.9	-74.7	-83.8	0	0	0	110.3	W43 G119	W43-H121 AromaticContact CE3-CE1 3.86Å; W43-H121 AromaticContact CE3-NE2 3.57Å; W43-H121 AromaticContact CZ3-NE2 3.58Å; G119-H121 PolarHBondContact O-CD2 3.42Å; G119-H121 VanDerWaalsContact O-CD2 3.31Å; G119-H121 PolarHBondContact O-N 3.46Å; G119-H121 VanDerWaalsContact O-N 3.11Å
122	N	40.2	Very low	46.4	Very low	175 Å²	175	130.1 Å²	130.1	94%	0.936	69%	0.692	S	S	*	*			trans	-126.8	105	158.4	-90.5	-19.5	0	0	0	107.4
123	G	39.3	Very low	46	Very low	60 Å²	60	132.7 Å²	132.7	62%	0.619	70%	0.699	S	S	*	*			trans	158.5	75.3	176.8	0	0	0	0	0	113.2	G125	G123-G125 PolarHBondContact O-N 3.02Å
124	K	39.2	Very low	45.3	Very low	229 Å²	229	132.2 Å²	132.2	100%	0.996	70%	0.703	S	S	*	*			trans	-64	81.6	148.9	-75.9	-179.7	176.4	175.2	0	107.1
125	G	38.9	Very low	45.1	Very low	62 Å²	62	125.9 Å²	125.9	64%	0.639	69%	0.691	S	S	*	*			trans	-113.5	96.1	175.4	0	0	0	0	0	108.6	G123 L127	G123-G125 PolarHBondContact O-N 3.02Å; G125-L127 PolarHBondContact O-N 3.43Å; G125-L127 VanDerWaalsContact O-N 3.1Å
126	K	34.5	Very low	45	Very low	189 Å²	189	122.8 Å²	122.8	82%	0.822	68%	0.679	S	S	*	*			trans	-66.4	100.2	169.6	-166.1	-177.4	-174.4	-171.9	0	106.9
127	L	44.4	Very low	45.4	Very low	148 Å²	148	124 Å²	124	78%	0.775	68%	0.681	S	S	*	*			trans	-122.2	95.1	166.6	-81.4	166.7	0	0	0	107.5	G125 E129	G125-L127 PolarHBondContact O-N 3.43Å; G125-L127 VanDerWaalsContact O-N 3.1Å; L127-E129 PolarHBondContact O-N 3.41Å
128	E	37.7	Very low	45.6	Very low	173 Å²	173	123.1 Å²	123.1	81%	0.808	67%	0.67	S	S	*	*			trans	-56.3	107.7	153.6	-73.8	168.9	97.1	0	0	107.7
129	E	45.3	Very low	46.2	Very low	155 Å²	155	122.2 Å²	122.2	72%	0.724	66%	0.66	S	S	*	*			trans	-148.9	96.3	166.8	-123.3	177.4	162.4	0	0	111.4	L127 G131	L127-E129 PolarHBondContact O-N 3.41Å; E129-G131 PolarHBondContact O-N 2.97Å
130	K	40.9	Very low	47	Very low	148 Å²	148	129 Å²	129	64%	0.643	68%	0.677	S	S	*	*			trans	48.5	58.9	134.3	-65.7	-175.6	159.8	-149	0	117.9	T132 E133	K130-T132 PolarHBondContact O-N 3.14Å; K130-E133 IonicContact NZ-OE2 2.84Å; K130-E133 PolarHBondContact NZ-OE2 3.1Å
131	G	40.2	Very low	48.4	Very low	71 Å²	71	126.2 Å²	126.2	73%	0.732	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-1.2	164	0	0	0	0	0	115.3	E129	E129-G131 PolarHBondContact O-N 2.97Å
132	T	53.7	Low	49.2	Very low	116 Å²	116	125.2 Å²	125.2	71%	0.712	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	-11.9	-175.2	49.8	0	0	0	0	115.1	K130	K130-T132 PolarHBondContact O-N 3.14Å
133	E	52.4	Low	50.1	Low	121 Å²	121	119.7 Å²	119.7	57%	0.565	65%	0.646	S	S	*	*	H	α-helix	trans	-84.5	-27.4	-176	-140.6	171.9	141.4	0	0	112.9	K130 L137	K130-E133 IonicContact NZ-OE2 2.84Å; K130-E133 PolarHBondContact NZ-OE2 3.1Å; E133-L137 PolarHBondContact O-N 3.31Å
134	A	50.7	Low	51.1	Low	79 Å²	79	121.4 Å²	121.4	65%	0.653	65%	0.648	S	S	*	*	H	α-helix	trans	-76.1	-33.4	177.1	0	0	0	0	0	113.2	E136	A134-E136 VanDerWaalsContact C-N 3.33Å
135	A	51.5	Low	52	Low	63 Å²	63	116.8 Å²	116.8	52%	0.521	63%	0.634	S	S	.	*	H	α-helix	trans	-73.3	-25.5	174	0	0	0	0	0	112.6
136	E	56.2	Low	53	Low	96 Å²	96	121.7 Å²	121.7	45%	0.449	64%	0.64	S	S	.	*	H	α-helix	trans	-80.2	-31.9	177	-162.3	67.2	-163.4	0	0	112.1	A134 K139 R140	A134-E136 VanDerWaalsContact C-N 3.33Å; E136-K139 PolarHBondContact O-N 3.45Å; E136-R140 WeakPolarHBondContact O-CG 3.44Å; E136-R140 PolarHBondContact O-N 3.39Å; E136-R140 VanDerWaalsContact O-N 3.08Å
137	L	59.7	Low	54.3	Low	100 Å²	100	120.2 Å²	120.2	52%	0.524	64%	0.641	S	S	.	*	H	α-helix	trans	-69.8	-33.2	177.4	-169.7	67.4	0	0	0	112.7	E133 R140 K141	E133-L137 PolarHBondContact O-N 3.31Å; L137-R140 PolarHBondContact O-N 3.2Å; L137-K141 PolarHBondContact O-N 3.29Å
138	D	60.4	Low	54.8	Low	98 Å²	98	116.5 Å²	116.5	52%	0.524	64%	0.638	S	S	.	*	H	α-helix	trans	-70.1	-39.5	175.2	-167.1	59.8	0	0	0	111.9	R140 K141 N142	D138-R140 VanDerWaalsContact C-N 3.34Å; D138-R140 PolarHBondContact O-N 3.11Å; D138-K141 PolarHBondContact O-N 3.07Å; D138-N142 PolarHBondContact O-N 3.08Å; D138-N142 PolarHBondContact OD2-ND2 3.43Å
139	K	61.4	Low	55.4	Low	144 Å²	144	117.4 Å²	117.4	63%	0.626	64%	0.64	S	S	*	*	H	α-helix	trans	-61.1	-40.4	171.4	-74.9	-177	-179.1	177.4	0	112.5	E136 A143	E136-K139 PolarHBondContact O-N 3.45Å; K139-A143 VanDerWaalsContact O-CB 3.28Å; K139-A143 WeakPolarHBondContact O-CB 3.49Å; K139-A143 PolarHBondContact O-N 3.22Å
140	R	63	Low	55.4	Low	171 Å²	171	120.3 Å²	120.3	65%	0.645	67%	0.668	S	S	*	*	H	α-helix	trans	-66.7	-37.9	176.9	-73.5	179.8	-176.9	-167.7	1.1	112.7	E136 L137 D138 S144	E136-R140 WeakPolarHBondContact O-CG 3.44Å; E136-R140 PolarHBondContact O-N 3.39Å; E136-R140 VanDerWaalsContact O-N 3.08Å; L137-R140 PolarHBondContact O-N 3.2Å; D138-R140 VanDerWaalsContact C-N 3.34Å; D138-R140 PolarHBondContact O-N 3.11Å; R140-S144 WeakPolarHBondContact O-CB 3.44Å; R140-S144 PolarHBondContact O-N 3.24Å
141	K	64.1	Low	56.1	Low	143 Å²	143	119 Å²	119	62%	0.622	67%	0.669	S	S	*	*	H	α-helix	trans	-70.4	-38.3	177.4	-77.2	-177.1	174.8	-177.9	0	112.6	L137 D138 L145	L137-K141 PolarHBondContact O-N 3.29Å; D138-K141 PolarHBondContact O-N 3.07Å; K141-L145 PolarHBondContact O-N 3.1Å
142	N	58.6	Low	57	Low	88 Å²	88	121.5 Å²	121.5	47%	0.471	67%	0.665	S	S	.	*	H	α-helix	trans	-77.4	-31.7	178.5	-74.5	-27.4	0	0	0	113.4	D138 L145	D138-N142 PolarHBondContact O-N 3.08Å; D138-N142 PolarHBondContact OD2-ND2 3.43Å; N142-L145 PolarHBondContact O-N 2.89Å
143	A	60	Low	57.1	Low	60 Å²	60	121.8 Å²	121.8	50%	0.496	66%	0.663	S	S	.	*	H	α-helix	trans	-65.1	-40.2	171.3	0	0	0	0	0	111.7	K139 L145 Q146	K139-A143 VanDerWaalsContact O-CB 3.28Å; K139-A143 WeakPolarHBondContact O-CB 3.49Å; K139-A143 PolarHBondContact O-N 3.22Å; A143-L145 PolarHBondContact O-N 3.4Å; A143-Q146 PolarHBondContact O-N 3.24Å
144	S	60.3	Low	57.4	Low	96 Å²	96	121.8 Å²	121.8	67%	0.671	67%	0.669	S	S	*	*	H	α-helix	trans	-72	-13.3	179.9	-158.7	0	0	0	0	114.1	R140	R140-S144 WeakPolarHBondContact O-CB 3.44Å; R140-S144 PolarHBondContact O-N 3.24Å
145	L	58.1	Low	57.8	Low	132 Å²	132	124.5 Å²	124.5	69%	0.691	67%	0.67	S	S	*	*	H	α-helix	trans	-86.8	-20.2	177.1	-165.4	67.6	0	0	0	112.7	K141 N142 A143	K141-L145 PolarHBondContact O-N 3.1Å; N142-L145 PolarHBondContact O-N 2.89Å; A143-L145 PolarHBondContact O-N 3.4Å
146	Q	59.9	Low	58.3	Low	165 Å²	165	128.6 Å²	128.6	77%	0.771	68%	0.68	S	S	*	*	H	α-helix	trans	-83.9	-23	-179.8	-68.3	-165.3	-14.5	0	0	113.7	A143 G148	A143-Q146 PolarHBondContact O-N 3.24Å; Q146-G148 VanDerWaalsContact C-N 3.29Å; Q146-G148 PolarHBondContact O-N 2.84Å
147	D	61.7	Low	58.4	Low	158 Å²	158	130.9 Å²	130.9	85%	0.845	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-0.6	175.3	-82.6	-42.7	0	0	0	114.1
148	G	55.1	Low	58.3	Low	69 Å²	69	133.3 Å²	133.3	71%	0.711	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	14.8	-179.8	0	0	0	0	0	115.5	Q146	Q146-G148 VanDerWaalsContact C-N 3.29Å; Q146-G148 PolarHBondContact O-N 2.84Å
149	K	49.7	Very low	58.1	Low	193 Å²	193	136.3 Å²	136.3	84%	0.839	73%	0.725	S	S	*	*			trans	-127.8	65.5	-173.6	-151	178	-168.6	-177.1	0	112.3
150	V	45.7	Very low	57.8	Low	216 Å²	216	135.5 Å²	135.5	100%	1.309	73%	0.734	S	S	*	*			trans	-140.1	0	156.4	179.5	0	0	0	0	108.5

Retrieved 150 of 150 residues in 83.4 ms (Link to these results)

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