A0A5K4F3E8_SCHMA Loading...

Doublecortin domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F3E8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 225 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	83.5	Confident	85.5	Confident	102 Å²	102	118.4 Å²	118.4	50%	0.502	56%	0.556	S	S	.	*				0	-57.1	0	-59.1	-52.8	-88.8	0	0	112.4	Q3 V4 R5 I15 I18	M1-Q3 VanDerWaalsContact C-N 3.32Å; M1-Q3 PolarHBondContact O-N 3.12Å; M1-V4 WeakPolarHBondContact O-CB 3.18Å; M1-V4 PolarHBondContact O-N 3.07Å; M1-R5 PolarHBondContact O-N 2.97Å; M1-R5 VanDerWaalsContact O-N 3.09Å; M1-I15 HydrophobicContact CE-CB 3.8Å; M1-I15 HydrophobicContact CE-CG2 3.37Å; M1-I15 WeakPolarHBondContact CE-O 3.2Å; M1-I18 HydrophobicContact CE-CG1 4.09Å; M1-I18 HydrophobicContact SD-CD1 3.67Å; M1-I18 HydrophobicContact SD-CG1 3.76Å
2	E	84.5	Confident	85.1	Confident	104 Å²	104	111.8 Å²	111.8	49%	0.486	53%	0.53	S	S	.	.	H	α-helix	trans	-62	-36	-175.6	-164.7	62.9	-174.1	0	0	113.8	V4 R5 K6	E2-V4 VanDerWaalsContact C-N 3.32Å; E2-V4 PolarHBondContact O-N 3.5Å; E2-R5 PolarHBondContact O-N 2.96Å; E2-R5 IonicContact OE1-NH1 3.22Å; E2-R5 PolarHBondContact OE1-NH1 3.13Å; E2-R5 IonicContact OE2-NH1 2.71Å; E2-K6 WeakPolarHBondContact O-CG 3.43Å; E2-K6 PolarHBondContact O-N 3.09Å
3	Q	86.6	Confident	85.1	Confident	155 Å²	155	108.2 Å²	108.2	72%	0.724	52%	0.522	S	S	*	.	H	α-helix	trans	-61.6	-38.9	173.9	-170	173.8	3.3	0	0	112.7	M1 K6 Q7	M1-Q3 VanDerWaalsContact C-N 3.32Å; M1-Q3 PolarHBondContact O-N 3.12Å; Q3-K6 PolarHBondContact O-N 3.41Å; Q3-Q7 WeakPolarHBondContact O-CG 3.37Å; Q3-Q7 PolarHBondContact O-N 3.48Å
4	V	88.2	Confident	85.3	Confident	50 Å²	50	104.1 Å²	104.1	30%	0.303	52%	0.515	S	S	.	.	H	α-helix	trans	-67.7	-41.6	176.6	-178.7	0	0	0	0	110.3	M1 E2 K6 Q7 L8 I15 I18 A41	M1-V4 WeakPolarHBondContact O-CB 3.18Å; M1-V4 PolarHBondContact O-N 3.07Å; E2-V4 VanDerWaalsContact C-N 3.32Å; E2-V4 PolarHBondContact O-N 3.5Å; V4-K6 PolarHBondContact O-N 3.48Å; V4-Q7 PolarHBondContact O-N 2.82Å; V4-L8 HydrophobicContact CG1-CD1 3.99Å; V4-L8 HydrophobicContact CG1-CG 4.39Å; V4-L8 WeakPolarHBondContact O-CG 3.07Å; V4-L8 PolarHBondContact O-N 2.84Å; V4-I15 HydrophobicContact CB-CD1 3.85Å; V4-I15 HydrophobicContact CG1-CD1 3.63Å; V4-I18 HydrophobicContact CG2-CD1 3.95Å; V4-A41 HydrophobicContact CG1-CB 4.13Å
5	R	87.7	Confident	85.6	Confident	85 Å²	85	98.5 Å²	98.5	32%	0.321	49%	0.487	S	S	.	.	H	α-helix	trans	-60.3	-44.2	175.8	-176.5	-176	172.5	-144.3	-1.9	111.6	M1 E2 Q7 L8 G9 V12 I15	M1-R5 PolarHBondContact O-N 2.97Å; M1-R5 VanDerWaalsContact O-N 3.09Å; E2-R5 PolarHBondContact O-N 2.96Å; E2-R5 IonicContact OE1-NH1 3.22Å; E2-R5 PolarHBondContact OE1-NH1 3.13Å; E2-R5 IonicContact OE2-NH1 2.71Å; R5-Q7 VanDerWaalsContact C-N 3.27Å; R5-Q7 PolarHBondContact O-N 2.83Å; R5-L8 PolarHBondContact O-N 3Å; R5-G9 PolarHBondContact O-N 3.01Å; R5-V12 PolarHBondContact NE-O 2.95Å; R5-I15 HydrophobicContact CB-CD1 3.88Å; R5-I15 HydrophobicContact CB-CG1 4.27Å
6	K	87.6	Confident	85.9	Confident	162 Å²	162	102.6 Å²	102.6	70%	0.704	50%	0.495	S	S	*	.	H	α-helix	trans	-59	-37.6	176	-74.8	-176.3	178.7	-175.3	0	112.5	E2 Q3 V4	E2-K6 WeakPolarHBondContact O-CG 3.43Å; E2-K6 PolarHBondContact O-N 3.09Å; Q3-K6 PolarHBondContact O-N 3.41Å; V4-K6 PolarHBondContact O-N 3.48Å
7	Q	88.4	Confident	86.2	Confident	159 Å²	159	97.6 Å²	97.6	74%	0.743	47%	0.473	S	S	*	.	H	α-helix	trans	-74.4	-33.1	178.7	-69.7	-68.8	-13.3	0	0	113.5	Q3 V4 R5 G9	Q3-Q7 WeakPolarHBondContact O-CG 3.37Å; Q3-Q7 PolarHBondContact O-N 3.48Å; V4-Q7 PolarHBondContact O-N 2.82Å; R5-Q7 VanDerWaalsContact C-N 3.27Å; R5-Q7 PolarHBondContact O-N 2.83Å; Q7-G9 VanDerWaalsContact C-N 3.31Å; Q7-G9 PolarHBondContact O-N 2.97Å
8	L	86	Confident	86.5	Confident	97 Å²	97	93.2 Å²	93.2	51%	0.508	45%	0.452	S	S	.	.	H	α-helix	trans	-79.5	-11.9	179.7	-64.8	172.7	0	0	0	113.9	V4 R5 V12 I15 A41	V4-L8 HydrophobicContact CG1-CD1 3.99Å; V4-L8 HydrophobicContact CG1-CG 4.39Å; V4-L8 WeakPolarHBondContact O-CG 3.07Å; V4-L8 PolarHBondContact O-N 2.84Å; R5-L8 PolarHBondContact O-N 3Å; L8-V12 HydrophobicContact CB-CB 4.38Å; L8-V12 HydrophobicContact CB-CG1 4.49Å; L8-V12 HydrophobicContact CB-CG2 3.83Å; L8-V12 HydrophobicContact CD1-CG1 4.49Å; L8-V12 WeakPolarHBondContact O-CG2 3.16Å; L8-I15 HydrophobicContact CD1-CD1 4.02Å; L8-A41 HydrophobicContact CD1-CB 3.66Å
9	G	83.1	Confident	86.7	Confident	30 Å²	30	88.8 Å²	88.8	31%	0.309	43%	0.431	S	S	.	.			trans	107.2	159.7	175.1	0	0	0	0	0	114.4	R5 Q7 Y11 V12	R5-G9 PolarHBondContact O-N 3.01Å; Q7-G9 VanDerWaalsContact C-N 3.31Å; Q7-G9 PolarHBondContact O-N 2.97Å; G9-Y11 PolarHBondContact O-N 3.03Å; G9-Y11 VanDerWaalsContact O-N 3.15Å; G9-V12 PolarHBondContact O-N 2.8Å
10	Q	81.1	Confident	86.8	Confident	155 Å²	155	85.8 Å²	85.8	72%	0.724	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.6	-171.2	70.1	-177	38.3	0	0	114.9	V12	Q10-V12 VanDerWaalsContact C-N 3.3Å
11	Y	83.5	Confident	86.7	Confident	203 Å²	203	83 Å²	83	80%	0.796	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-4.8	-177.5	-62	-75.2	0	0	0	113.4	G9 P13	G9-Y11 PolarHBondContact O-N 3.03Å; G9-Y11 VanDerWaalsContact O-N 3.15Å; Y11-P13 WeakPolarHBondContact O-CD 3.4Å
12	V	80.6	Confident	86.7	Confident	39 Å²	39	85.7 Å²	85.7	24%	0.236	42%	0.424	C	S	.	.	S	Bend	trans	-81.6	123.7	-178.9	-176.3	0	0	0	0	109.9	R5 L8 G9 Q10	R5-V12 PolarHBondContact NE-O 2.95Å; L8-V12 HydrophobicContact CB-CB 4.38Å; L8-V12 HydrophobicContact CB-CG1 4.49Å; L8-V12 HydrophobicContact CB-CG2 3.83Å; L8-V12 HydrophobicContact CD1-CG1 4.49Å; L8-V12 WeakPolarHBondContact O-CG2 3.16Å; G9-V12 PolarHBondContact O-N 2.8Å; Q10-V12 VanDerWaalsContact C-N 3.3Å
13	P	85.2	Confident	86.6	Confident	66 Å²	66	85.3 Å²	85.3	43%	0.429	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-61	166.3	175.5	17.5	-24.1	0	0	0	111.9	Y11 I15 P43	Y11-P13 WeakPolarHBondContact O-CD 3.4Å; P13-I15 PolarHBondContact O-N 3.05Å; P13-P43 HydrophobicContact CB-CB 4.24Å; P13-P43 HydrophobicContact CG-CB 3.65Å; P13-P43 HydrophobicContact CG-CG 4.29Å
14	A	88.5	Confident	86.5	Confident	51 Å²	51	79.9 Å²	79.9	42%	0.421	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-55.8	123.9	-178.3	0	0	0	0	0	111.4	R16 R44	A14-R16 PolarHBondContact O-N 3.08Å; A14-R44 PolarHBondContact O-N 3.12Å
15	I	90.1	Very high	86.5	Confident	19 Å²	19	81.6 Å²	81.6	10%	0.097	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	124.5	-177.8	-52.3	171.5	0	0	0	109.3	M1 V4 R5 L8 P13 A41 V42	M1-I15 HydrophobicContact CE-CB 3.8Å; M1-I15 HydrophobicContact CE-CG2 3.37Å; M1-I15 WeakPolarHBondContact CE-O 3.2Å; V4-I15 HydrophobicContact CB-CD1 3.85Å; V4-I15 HydrophobicContact CG1-CD1 3.63Å; R5-I15 HydrophobicContact CB-CD1 3.88Å; R5-I15 HydrophobicContact CB-CG1 4.27Å; L8-I15 HydrophobicContact CD1-CD1 4.02Å; P13-I15 PolarHBondContact O-N 3.05Å; I15-A41 HydrophobicContact CD1-CB 3.98Å; I15-A41 HydrophobicContact CG1-CB 4.44Å; I15-A41 HydrophobicContact CG2-CB 3.89Å; I15-V42 WeakPolarHBondContact CG2-O 3.41Å
16	R	89.8	Confident	86.6	Confident	165 Å²	165	82.9 Å²	82.9	62%	0.623	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	-43	179.7	-178.6	-177.3	178.6	177.7	0.4	112	A14 V42 R44	A14-R16 PolarHBondContact O-N 3.08Å; R16-V42 PolarHBondContact N-O 3.35Å; R16-R44 HydrophobicContact CB-CG 3.92Å; R16-R44 HydrophobicContact CG-CG 4.38Å
17	C	90.3	Very high	86.8	Confident	17 Å²	17	76.1 Å²	76.1	12%	0.115	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	158.2	-177.3	52.9	0	0	0	0	111.5	K26 V42	C17-K26 HydrophobicContact CB-CD 3.77Å; C17-K26 HydrophobicContact CB-CG 3.95Å; C17-V42 PolarHBondContact N-O 2.66Å; C17-V42 PolarHBondContact O-N 2.87Å
18	I	91.5	Very high	86.8	Confident	19 Å²	19	76.1 Å²	76.1	10%	0.097	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	136.2	170.2	-60.1	172.3	0	0	0	107	M1 V4 I27 Y39 V40	M1-I18 HydrophobicContact CE-CG1 4.09Å; M1-I18 HydrophobicContact SD-CD1 3.67Å; M1-I18 HydrophobicContact SD-CG1 3.76Å; V4-I18 HydrophobicContact CG2-CD1 3.95Å; I18-I27 HydrophobicContact CB-CB 4.46Å; I18-I27 HydrophobicContact CB-CD1 4.25Å; I18-I27 HydrophobicContact CG2-CD1 3.61Å; I18-I27 HydrophobicContact CG2-CG1 4.38Å; I18-I27 PolarHBondContact O-N 3.01Å; I18-Y39 VanDerWaalsContact CG2-CB 3.48Å; I18-Y39 HydrophobicContact CG2-CD1 4.49Å; I18-Y39 HydrophobicContact CG2-CG 4.14Å; I18-V40 CarbonylContact C-O 3.56Å; I18-V40 WeakPolarHBondContact CA-O 3.39Å
19	V	91.1	Very high	87	Confident	9 Å²	9	76.3 Å²	76.3	6%	0.055	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	140	-173.5	-174.5	0	0	0	0	110	G24 T25 V40 V42 L48	V19-G24 WeakPolarHBondContact CG1-O 3.44Å; V19-T25 WeakPolarHBondContact CA-O 3.14Å; V19-T25 WeakPolarHBondContact CG1-O 3.41Å; V19-V40 PolarHBondContact N-O 3.19Å; V19-V40 PolarHBondContact O-N 3.08Å; V19-V42 HydrophobicContact CG2-CG2 4.07Å; V19-L48 HydrophobicContact CB-CD1 3.56Å; V19-L48 HydrophobicContact CG1-CD1 3.6Å; V19-L48 HydrophobicContact CG2-CD1 3.89Å
20	S	88.9	Confident	87.2	Confident	28 Å²	28	80.7 Å²	80.7	20%	0.196	43%	0.427	C	S	.	.			trans	-69.5	125.5	171.6	-67.5	0	0	0	0	110.5	N22 T23 G24 T25 Y39	S20-N22 VanDerWaalsContact C-N 3.27Å; S20-N22 PolarHBondContact O-N 2.96Å; S20-T23 WeakPolarHBondContact CB-OG1 3.48Å; S20-G24 VanDerWaalsContact O-CA 3.32Å; S20-G24 WeakPolarHBondContact O-CA 3.48Å; S20-G24 PolarHBondContact O-N 3.09Å; S20-T25 PolarHBondContact N-O 3.06Å; S20-Y39 WeakPolarHBondContact OG-CE1 3.25Å
21	P	85.4	Confident	87.5	Confident	27 Å²	27	79.1 Å²	79.1	18%	0.175	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-31.7	-176	24.6	-32.8	0	0	0	112.6	R38 V40 Y53	P21-R38 WeakPolarHBondContact CD-O 3.3Å; P21-R38 WeakPolarHBondContact CG-O 3.27Å; P21-V40 HydrophobicContact CB-CG2 3.91Å; P21-Y53 HydrophobicContact CB-CD2 3.82Å; P21-Y53 HydrophobicContact CB-CG 4.38Å
22	N	82.3	Confident	87.7	Confident	159 Å²	159	73.2 Å²	73.2	85%	0.85	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-36.1	-174.6	-60.9	-5.7	0	0	0	112.5	S20	S20-N22 VanDerWaalsContact C-N 3.27Å; S20-N22 PolarHBondContact O-N 2.96Å
23	T	82.8	Confident	88.1	Confident	97 Å²	97	74.9 Å²	74.9	60%	0.595	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-15.5	-174.9	59.1	0	0	0	0	113.6	S20 T25	S20-T23 WeakPolarHBondContact CB-OG1 3.48Å; T23-T25 VanDerWaalsContact CB-OG1 3.25Å; T23-T25 WeakPolarHBondContact CB-OG1 3.17Å; T23-T25 PolarHBondContact O-N 3.39Å; T23-T25 WeakPolarHBondContact OG1-CB 3.34Å; T23-T25 PolarHBondContact OG1-N 2.64Å; T23-T25 PolarHBondContact OG1-OG1 2.86Å
24	G	84.1	Confident	88.3	Confident	40 Å²	40	77.2 Å²	77.2	41%	0.412	43%	0.427	S	S	.	.			trans	67.6	7.9	-171.6	0	0	0	0	0	113.8	V19 S20 K26	V19-G24 WeakPolarHBondContact CG1-O 3.44Å; S20-G24 VanDerWaalsContact O-CA 3.32Å; S20-G24 WeakPolarHBondContact O-CA 3.48Å; S20-G24 PolarHBondContact O-N 3.09Å; G24-K26 PolarHBondContact O-N 2.99Å
25	T	88.4	Confident	88.3	Confident	86 Å²	86	82.7 Å²	82.7	53%	0.528	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-75.4	127.3	-177	-42.2	0	0	0	0	110.4	V19 S20 T23	V19-T25 WeakPolarHBondContact CA-O 3.14Å; V19-T25 WeakPolarHBondContact CG1-O 3.41Å; S20-T25 PolarHBondContact N-O 3.06Å; T23-T25 VanDerWaalsContact CB-OG1 3.25Å; T23-T25 WeakPolarHBondContact CB-OG1 3.17Å; T23-T25 PolarHBondContact O-N 3.39Å; T23-T25 WeakPolarHBondContact OG1-CB 3.34Å; T23-T25 PolarHBondContact OG1-N 2.64Å; T23-T25 PolarHBondContact OG1-OG1 2.86Å
26	K	90.8	Very high	88.1	Confident	112 Å²	112	89.1 Å²	89.1	49%	0.487	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	125.2	174.6	176.7	176.6	169.8	-172.1	0	110.1	C17 G24 Q28	C17-K26 HydrophobicContact CB-CD 3.77Å; C17-K26 HydrophobicContact CB-CG 3.95Å; G24-K26 PolarHBondContact O-N 2.99Å; K26-Q28 PolarHBondContact O-N 2.95Å
27	I	91	Very high	88	Confident	21 Å²	21	86.3 Å²	86.3	11%	0.108	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	123.9	172.2	-56.7	-178.8	0	0	0	108	I18 N29 D32 I33 Y39	I18-I27 HydrophobicContact CB-CB 4.46Å; I18-I27 HydrophobicContact CB-CD1 4.25Å; I18-I27 HydrophobicContact CG2-CD1 3.61Å; I18-I27 HydrophobicContact CG2-CG1 4.38Å; I18-I27 PolarHBondContact O-N 3.01Å; I27-N29 VanDerWaalsContact CG2-O 3.24Å; I27-N29 WeakPolarHBondContact CG2-O 3.22Å; I27-D32 HydrophobicContact CG2-CB 4.01Å; I27-I33 HydrophobicContact CD1-CG1 3.97Å; I27-I33 HydrophobicContact CG2-CD1 4.25Å; I27-I33 HydrophobicContact CG2-CG1 3.67Å; I27-Y39 HydrophobicContact CD1-CD1 3.25Å; I27-Y39 HydrophobicContact CD1-CD2 4.41Å; I27-Y39 HydrophobicContact CD1-CE1 3.31Å; I27-Y39 HydrophobicContact CD1-CE2 4.49Å; I27-Y39 HydrophobicContact CD1-CG 3.8Å; I27-Y39 HydrophobicContact CG1-CD1 4.3Å; I27-Y39 HydrophobicContact CG1-CE1 4.25Å
28	Q	89.3	Confident	87.9	Confident	159 Å²	159	91.2 Å²	91.2	74%	0.743	49%	0.489	S	S	*	.			trans	-101.3	-42.7	177.7	-59.9	-168.9	21	0	0	110.8	K26 D32	K26-Q28 PolarHBondContact O-N 2.95Å; Q28-D32 PolarHBondContact N-OD2 3.32Å
29	N	88.6	Confident	87.8	Confident	100 Å²	100	93.2 Å²	93.2	54%	0.535	50%	0.495	S	S	.	.	S	Bend	trans	-113.8	153.9	-177	-61.1	-54	0	0	0	111.4	I27 C31 D32	I27-N29 VanDerWaalsContact CG2-O 3.24Å; I27-N29 WeakPolarHBondContact CG2-O 3.22Å; N29-C31 PolarHBondContact O-N 3.43Å; N29-D32 PolarHBondContact N-OD2 3.31Å; N29-D32 WeakPolarHBondContact O-CB 3.5Å; N29-D32 PolarHBondContact O-N 2.81Å; N29-D32 VanDerWaalsContact O-N 3.11Å
30	V	87.2	Confident	87.8	Confident	122 Å²	122	93.7 Å²	93.7	74%	0.739	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-62.2	-29.3	175.8	-177	0	0	0	0	111	D32 I33	V30-D32 PolarHBondContact O-N 3.33Å; V30-I33 VanDerWaalsContact O-CB 3.32Å; V30-I33 WeakPolarHBondContact O-CB 3.5Å; V30-I33 WeakPolarHBondContact O-CG1 3.36Å; V30-I33 PolarHBondContact O-N 2.91Å; V30-I33 VanDerWaalsContact O-N 3.13Å
31	C	88.3	Confident	87.9	Confident	122 Å²	122	93.8 Å²	93.8	82%	0.824	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-66.1	-19.7	177	-53.2	0	0	0	0	113.9	N29 I33	N29-C31 PolarHBondContact O-N 3.43Å; C31-I33 PolarHBondContact O-N 2.83Å
32	D	88	Confident	88.1	Confident	80 Å²	80	93 Å²	93	43%	0.428	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-81.1	-6.1	177.7	-48.7	-31.2	0	0	0	111.5	I27 Q28 N29 V30	I27-D32 HydrophobicContact CG2-CB 4.01Å; Q28-D32 PolarHBondContact N-OD2 3.32Å; N29-D32 PolarHBondContact N-OD2 3.31Å; N29-D32 WeakPolarHBondContact O-CB 3.5Å; N29-D32 PolarHBondContact O-N 2.81Å; N29-D32 VanDerWaalsContact O-N 3.11Å; V30-D32 PolarHBondContact O-N 3.33Å
33	I	88.8	Confident	88.5	Confident	73 Å²	73	86.1 Å²	86.1	37%	0.374	46%	0.46	S	S	.	.			trans	-87.9	114.3	178.8	-54	179.6	0	0	0	108.4	I27 V30 C31 Y39	I27-I33 HydrophobicContact CD1-CG1 3.97Å; I27-I33 HydrophobicContact CG2-CD1 4.25Å; I27-I33 HydrophobicContact CG2-CG1 3.67Å; V30-I33 VanDerWaalsContact O-CB 3.32Å; V30-I33 WeakPolarHBondContact O-CB 3.5Å; V30-I33 WeakPolarHBondContact O-CG1 3.36Å; V30-I33 PolarHBondContact O-N 2.91Å; V30-I33 VanDerWaalsContact O-N 3.13Å; C31-I33 PolarHBondContact O-N 2.83Å; I33-Y39 HydrophobicContact CG2-CD2 4.26Å; I33-Y39 HydrophobicContact CG2-CE2 3.61Å
34	M	88.9	Confident	88.6	Confident	115 Å²	115	90.6 Å²	90.6	57%	0.567	47%	0.466	S	S	*	.			trans	-88.4	143.5	177.3	-59.8	-179.7	84.3	0	0	110.3	H37 Y39	M34-H37 HydrophobicContact CB-CB 4.16Å; M34-H37 VanDerWaalsContact CB-ND1 3.34Å; M34-H37 WeakPolarHBondContact CB-ND1 3.37Å; M34-H37 PolarHBondContact O-N 2.83Å; M34-Y39 PolarHBondContact N-OH 3.24Å
35	E	88.7	Confident	88.6	Confident	166 Å²	166	92.6 Å²	92.6	78%	0.776	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	142.3	175.6	-163.2	176.6	177.6	0	0	110.6	H37	E35-H37 PolarHBondContact O-N 2.83Å; E35-H37 VanDerWaalsContact O-N 3.08Å; E35-H37 PolarHBondContact O-ND1 3.05Å
36	N	85.9	Confident	88.4	Confident	155 Å²	155	93.2 Å²	93.2	83%	0.829	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	15.3	179.8	-57.8	-43.2	0	0	0	116.1
37	H	88.2	Confident	88	Confident	106 Å²	106	91.8 Å²	91.8	49%	0.491	49%	0.492	S	S	.	.			trans	-93.6	147.5	174.1	-74	66.1	0	0	0	111.9	M34 E35 Y39	M34-H37 HydrophobicContact CB-CB 4.16Å; M34-H37 VanDerWaalsContact CB-ND1 3.34Å; M34-H37 WeakPolarHBondContact CB-ND1 3.37Å; M34-H37 PolarHBondContact O-N 2.83Å; E35-H37 PolarHBondContact O-N 2.83Å; E35-H37 VanDerWaalsContact O-N 3.08Å; E35-H37 PolarHBondContact O-ND1 3.05Å; H37-Y39 HydrophobicContact CB-CE2 3.66Å; H37-Y39 WeakPolarHBondContact O-CD2 3.47Å; H37-Y39 WeakPolarHBondContact O-CE2 3.31Å
38	R	88	Confident	87.6	Confident	120 Å²	120	93.6 Å²	93.6	45%	0.453	50%	0.501	S	S	.	.			trans	-92.8	139.6	178.5	-61.1	-175.2	-172.1	-168.7	2.9	110.2	P21 D57	P21-R38 WeakPolarHBondContact CD-O 3.3Å; P21-R38 WeakPolarHBondContact CG-O 3.27Å; R38-D57 IonicContact CZ-OD2 3.93Å; R38-D57 IonicContact NH1-OD2 3.2Å; R38-D57 PolarHBondContact NH1-OD2 2.6Å; R38-D57 IonicContact NH2-OD2 2.6Å
39	Y	89.8	Confident	87.3	Confident	60 Å²	60	92.4 Å²	92.4	24%	0.235	49%	0.494	C	S	.	.			trans	-136.4	150.9	-179.3	-60.4	-74.7	0	0	0	111.2	I18 S20 I27 I33 M34 H37	I18-Y39 VanDerWaalsContact CG2-CB 3.48Å; I18-Y39 HydrophobicContact CG2-CD1 4.49Å; I18-Y39 HydrophobicContact CG2-CG 4.14Å; S20-Y39 WeakPolarHBondContact OG-CE1 3.25Å; I27-Y39 HydrophobicContact CD1-CD1 3.25Å; I27-Y39 HydrophobicContact CD1-CD2 4.41Å; I27-Y39 HydrophobicContact CD1-CE1 3.31Å; I27-Y39 HydrophobicContact CD1-CE2 4.49Å; I27-Y39 HydrophobicContact CD1-CG 3.8Å; I27-Y39 HydrophobicContact CG1-CD1 4.3Å; I27-Y39 HydrophobicContact CG1-CE1 4.25Å; I33-Y39 HydrophobicContact CG2-CD2 4.26Å; I33-Y39 HydrophobicContact CG2-CE2 3.61Å; M34-Y39 PolarHBondContact N-OH 3.24Å; H37-Y39 HydrophobicContact CB-CE2 3.66Å; H37-Y39 WeakPolarHBondContact O-CD2 3.47Å; H37-Y39 WeakPolarHBondContact O-CE2 3.31Å
40	V	90.1	Very high	86.6	Confident	19 Å²	19	94.5 Å²	94.5	12%	0.115	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	120.2	179.6	-178.4	0	0	0	0	108.9	I18 V19 P21 V42 L48 Y53	I18-V40 CarbonylContact C-O 3.56Å; I18-V40 WeakPolarHBondContact CA-O 3.39Å; V19-V40 PolarHBondContact N-O 3.19Å; V19-V40 PolarHBondContact O-N 3.08Å; P21-V40 HydrophobicContact CB-CG2 3.91Å; V40-V42 HydrophobicContact CG1-CG2 4.23Å; V40-L48 HydrophobicContact CB-CD1 4.43Å; V40-L48 HydrophobicContact CG1-CD1 4.28Å; V40-Y53 HydrophobicContact CG1-CE1 4.11Å; V40-Y53 WeakPolarHBondContact CG1-OH 3.33Å; V40-Y53 HydrophobicContact CG2-CD1 4.15Å; V40-Y53 HydrophobicContact CG2-CD2 3.86Å; V40-Y53 HydrophobicContact CG2-CE1 3.95Å; V40-Y53 HydrophobicContact CG2-CE2 3.66Å; V40-Y53 HydrophobicContact CG2-CG 4.09Å
41	A	90.9	Very high	86.1	Confident	30 Å²	30	93.6 Å²	93.6	25%	0.248	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	119	170.4	0	0	0	0	0	109.8	V4 L8 I15	V4-A41 HydrophobicContact CG1-CB 4.13Å; L8-A41 HydrophobicContact CD1-CB 3.66Å; I15-A41 HydrophobicContact CD1-CB 3.98Å; I15-A41 HydrophobicContact CG1-CB 4.44Å; I15-A41 HydrophobicContact CG2-CB 3.89Å
42	V	90.3	Very high	85.8	Confident	10 Å²	10	91.5 Å²	91.5	6%	0.061	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	118.7	179.4	-174	0	0	0	0	109.2	I15 R16 C17 V19 V40 E46 L48	I15-V42 WeakPolarHBondContact CG2-O 3.41Å; R16-V42 PolarHBondContact N-O 3.35Å; C17-V42 PolarHBondContact N-O 2.66Å; C17-V42 PolarHBondContact O-N 2.87Å; V19-V42 HydrophobicContact CG2-CG2 4.07Å; V40-V42 HydrophobicContact CG1-CG2 4.23Å; V42-E46 VanDerWaalsContact CG1-O 3.32Å; V42-E46 WeakPolarHBondContact CG1-O 3.47Å; V42-L48 HydrophobicContact CG2-CB 4.3Å; V42-L48 HydrophobicContact CG2-CD1 3.77Å
43	P	89.5	Confident	85.4	Confident	16 Å²	16	90.7 Å²	90.7	10%	0.104	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	162.6	178.1	25.5	-28.5	0	0	0	113.5	P13 G45 E46	P13-P43 HydrophobicContact CB-CB 4.24Å; P13-P43 HydrophobicContact CG-CB 3.65Å; P13-P43 HydrophobicContact CG-CG 4.29Å; P43-G45 PolarHBondContact O-N 3.37Å; P43-E46 HydrophobicContact CG-CB 3.9Å; P43-E46 HydrophobicContact CG-CG 3.82Å; P43-E46 PolarHBondContact O-N 3.14Å
44	R	85.5	Confident	85	Confident	191 Å²	191	92 Å²	92	72%	0.721	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	130.8	169.8	-84.9	-163.4	-178.4	-144.1	4.6	109.7	A14 R16	A14-R44 PolarHBondContact O-N 3.12Å; R16-R44 HydrophobicContact CB-CG 3.92Å; R16-R44 HydrophobicContact CG-CG 4.38Å
45	G	83.6	Confident	84.4	Confident	81 Å²	81	92.3 Å²	92.3	84%	0.835	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.4	-14	178.3	0	0	0	0	0	114.6	P43	P43-G45 PolarHBondContact O-N 3.37Å
46	E	84.9	Confident	83.7	Confident	99 Å²	99	86.8 Å²	86.8	46%	0.463	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-102.6	145.5	175.3	-61.9	-168.1	-173.4	0	0	111.8	V42 P43	V42-E46 VanDerWaalsContact CG1-O 3.32Å; V42-E46 WeakPolarHBondContact CG1-O 3.47Å; P43-E46 HydrophobicContact CG-CB 3.9Å; P43-E46 HydrophobicContact CG-CG 3.82Å; P43-E46 PolarHBondContact O-N 3.14Å
47	A	83	Confident	83.1	Confident	82 Å²	82	81.9 Å²	81.9	68%	0.678	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-85.9	152.6	168.8	0	0	0	0	0	110.2	K49	A47-K49 PolarHBondContact O-N 3.35Å; A47-K49 VanDerWaalsContact O-N 3.17Å
48	L	82.7	Confident	82.4	Confident	60 Å²	60	80.6 Å²	80.6	31%	0.314	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-61.1	119.1	171	-177.2	111.2	0	0	0	109.2	V19 V40 V42 L50	V19-L48 HydrophobicContact CB-CD1 3.56Å; V19-L48 HydrophobicContact CG1-CD1 3.6Å; V19-L48 HydrophobicContact CG2-CD1 3.89Å; V40-L48 HydrophobicContact CB-CD1 4.43Å; V40-L48 HydrophobicContact CG1-CD1 4.28Å; V42-L48 HydrophobicContact CG2-CB 4.3Å; V42-L48 HydrophobicContact CG2-CD1 3.77Å; L48-L50 HydrophobicContact CD2-CD1 4.41Å; L48-L50 PolarHBondContact O-N 3.24Å
49	K	81.6	Confident	81.4	Confident	133 Å²	133	82.7 Å²	82.7	58%	0.578	43%	0.432	S	S	*	.			trans	-84.3	108.8	175.1	-67.8	177.4	-178.7	167	0	108.6	A47 L51 Y53	A47-K49 PolarHBondContact O-N 3.35Å; A47-K49 VanDerWaalsContact O-N 3.17Å; K49-L51 VanDerWaalsContact C-N 3.25Å; K49-L51 HydrophobicContact CB-CD1 4.11Å; K49-L51 HydrophobicContact CB-CG 4.27Å; K49-L51 PolarHBondContact O-N 3.31Å; K49-Y53 WeakPolarHBondContact O-CE2 3.47Å; K49-Y53 PolarHBondContact O-OH 2.83Å
50	L	73.9	Confident	80.2	Confident	144 Å²	144	83.9 Å²	83.9	75%	0.754	45%	0.449	S	S	*	.			trans	-72	83.8	179.3	-165.8	67.4	0	0	0	110.4	L48	L48-L50 HydrophobicContact CD2-CD1 4.41Å; L48-L50 PolarHBondContact O-N 3.24Å
51	L	76.5	Confident	78.9	Confident	104 Å²	104	90.6 Å²	90.6	55%	0.545	47%	0.472	S	S	.	.			trans	-107.9	155.6	176.7	-69.2	166.7	0	0	0	109.3	K49 Y53	K49-L51 VanDerWaalsContact C-N 3.25Å; K49-L51 HydrophobicContact CB-CD1 4.11Å; K49-L51 HydrophobicContact CB-CG 4.27Å; K49-L51 PolarHBondContact O-N 3.31Å; L51-Y53 HydrophobicContact CB-CE1 4.5Å; L51-Y53 HydrophobicContact CB-CE2 4.43Å; L51-Y53 WeakPolarHBondContact O-CD2 3.48Å; L51-Y53 PolarHBondContact O-N 3.03Å
52	D	81.9	Confident	77.4	Confident	77 Å²	77	98 Å²	98	41%	0.412	50%	0.495	S	S	.	.			trans	-72.7	82.8	164.1	-169.8	-23.3	0	0	0	108.3	H54 K55 A56	D52-H54 PolarHBondContact O-N 2.86Å; D52-H54 WeakPolarHBondContact OD1-CB 3.36Å; D52-H54 PolarHBondContact OD1-N 2.93Å; D52-K55 HydrophobicContact CB-CB 4.24Å; D52-K55 HydrophobicContact CB-CD 4.34Å; D52-K55 HydrophobicContact CB-CG 4.37Å; D52-K55 PolarHBondContact O-N 2.83Å; D52-K55 VanDerWaalsContact O-N 3.14Å; D52-K55 PolarHBondContact OD1-N 2.85Å; D52-K55 VanDerWaalsContact OD2-CD 3.23Å; D52-K55 WeakPolarHBondContact OD2-CD 3.24Å; D52-K55 VanDerWaalsContact OD2-CE 3.31Å; D52-K55 WeakPolarHBondContact OD2-CE 3.4Å; D52-K55 WeakPolarHBondContact OD2-CG 3.36Å; D52-K55 IonicContact OD2-NZ 3.98Å; D52-K55 PolarHBondContact OD2-NZ 2.78Å; D52-A56 PolarHBondContact O-N 2.78Å
53	Y	81.3	Confident	75.8	Confident	64 Å²	64	101.3 Å²	101.3	25%	0.251	52%	0.524	S	S	.	.	H	α-helix	trans	-60.3	-24.3	-177.5	-70.8	-78.5	0	0	0	112.1	P21 V40 K49 L51 D57	P21-Y53 HydrophobicContact CB-CD2 3.82Å; P21-Y53 HydrophobicContact CB-CG 4.38Å; V40-Y53 HydrophobicContact CG1-CE1 4.11Å; V40-Y53 WeakPolarHBondContact CG1-OH 3.33Å; V40-Y53 HydrophobicContact CG2-CD1 4.15Å; V40-Y53 HydrophobicContact CG2-CD2 3.86Å; V40-Y53 HydrophobicContact CG2-CE1 3.95Å; V40-Y53 HydrophobicContact CG2-CE2 3.66Å; V40-Y53 HydrophobicContact CG2-CG 4.09Å; K49-Y53 WeakPolarHBondContact O-CE2 3.47Å; K49-Y53 PolarHBondContact O-OH 2.83Å; L51-Y53 HydrophobicContact CB-CE1 4.5Å; L51-Y53 HydrophobicContact CB-CE2 4.43Å; L51-Y53 WeakPolarHBondContact O-CD2 3.48Å; L51-Y53 PolarHBondContact O-N 3.03Å; Y53-D57 WeakPolarHBondContact O-CB 3.5Å; Y53-D57 PolarHBondContact O-N 3.45Å; Y53-D57 VanDerWaalsContact O-N 3.16Å
54	H	79	Confident	74.4	Confident	101 Å²	101	104.5 Å²	104.5	47%	0.468	55%	0.546	S	S	.	.	H	α-helix	trans	-66.2	-51.1	173.8	-167.5	-86.5	0	0	0	110.9	D52 A56 D57 E58	D52-H54 PolarHBondContact O-N 2.86Å; D52-H54 WeakPolarHBondContact OD1-CB 3.36Å; D52-H54 PolarHBondContact OD1-N 2.93Å; H54-A56 VanDerWaalsContact C-N 3.31Å; H54-A56 PolarHBondContact O-N 3.49Å; H54-D57 PolarHBondContact O-N 2.75Å; H54-E58 IonicContact CE1-OE1 4Å; H54-E58 PolarHBondContact CE1-OE1 3.36Å; H54-E58 IonicContact ND1-OE1 2.71Å; H54-E58 PolarHBondContact ND1-OE1 2.98Å; H54-E58 VanDerWaalsContact ND1-OE1 3.17Å; H54-E58 WeakPolarHBondContact O-CG 3.44Å; H54-E58 PolarHBondContact O-N 3.38Å
55	K	78.1	Confident	73.3	Confident	121 Å²	121	102.2 Å²	102.2	53%	0.526	55%	0.549	S	S	.	.	H	α-helix	trans	-64.4	-33.3	176.7	-71.6	-174.8	-177.3	116	0	113.3	D52 E58 K59	D52-K55 HydrophobicContact CB-CB 4.24Å; D52-K55 HydrophobicContact CB-CD 4.34Å; D52-K55 HydrophobicContact CB-CG 4.37Å; D52-K55 PolarHBondContact O-N 2.83Å; D52-K55 VanDerWaalsContact O-N 3.14Å; D52-K55 PolarHBondContact OD1-N 2.85Å; D52-K55 VanDerWaalsContact OD2-CD 3.23Å; D52-K55 WeakPolarHBondContact OD2-CD 3.24Å; D52-K55 VanDerWaalsContact OD2-CE 3.31Å; D52-K55 WeakPolarHBondContact OD2-CE 3.4Å; D52-K55 WeakPolarHBondContact OD2-CG 3.36Å; D52-K55 IonicContact OD2-NZ 3.98Å; D52-K55 PolarHBondContact OD2-NZ 2.78Å; K55-E58 PolarHBondContact O-N 2.94Å; K55-K59 WeakPolarHBondContact O-CG 3.49Å; K55-K59 PolarHBondContact O-N 3.18Å
56	A	74	Confident	72.3	Confident	50 Å²	50	105.7 Å²	105.7	41%	0.413	54%	0.543	S	S	.	.	H	α-helix	trans	-65.8	-41	177.5	0	0	0	0	0	111.7	D52 H54 K59 S60	D52-A56 PolarHBondContact O-N 2.78Å; H54-A56 VanDerWaalsContact C-N 3.31Å; H54-A56 PolarHBondContact O-N 3.49Å; A56-K59 PolarHBondContact O-N 3.41Å; A56-S60 PolarHBondContact O-N 3.4Å
57	D	72.3	Confident	71.5	Confident	51 Å²	51	104.6 Å²	104.6	27%	0.273	54%	0.538	S	S	.	.	H	α-helix	trans	-69.6	-36.7	175	-173.7	52.3	0	0	0	112	R38 Y53 H54 K59 S60 R61	R38-D57 IonicContact CZ-OD2 3.93Å; R38-D57 IonicContact NH1-OD2 3.2Å; R38-D57 PolarHBondContact NH1-OD2 2.6Å; R38-D57 IonicContact NH2-OD2 2.6Å; Y53-D57 WeakPolarHBondContact O-CB 3.5Å; Y53-D57 PolarHBondContact O-N 3.45Å; Y53-D57 VanDerWaalsContact O-N 3.16Å; H54-D57 PolarHBondContact O-N 2.75Å; D57-K59 VanDerWaalsContact C-N 3.34Å; D57-K59 PolarHBondContact O-N 2.86Å; D57-S60 PolarHBondContact O-N 3.13Å; D57-S60 PolarHBondContact O-OG 2.76Å; D57-R61 WeakPolarHBondContact O-CG 3.49Å; D57-R61 PolarHBondContact O-N 2.76Å; D57-R61 IonicContact OD1-NE 3.96Å; D57-R61 IonicContact OD2-CZ 3.96Å; D57-R61 IonicContact OD2-NE 3.41Å; D57-R61 PolarHBondContact OD2-NE 3.3Å; D57-R61 IonicContact OD2-NH2 3.65Å; D57-R61 PolarHBondContact OD2-NH2 2.72Å
58	E	73.8	Confident	71.5	Confident	80 Å²	80	104.3 Å²	104.3	37%	0.374	53%	0.527	S	S	.	.	H	α-helix	trans	-61.2	-43.3	172	-72.9	175.3	166.7	0	0	111.9	H54 K55 S60 R61 Y62	H54-E58 IonicContact CE1-OE1 4Å; H54-E58 PolarHBondContact CE1-OE1 3.36Å; H54-E58 IonicContact ND1-OE1 2.71Å; H54-E58 PolarHBondContact ND1-OE1 2.98Å; H54-E58 VanDerWaalsContact ND1-OE1 3.17Å; H54-E58 WeakPolarHBondContact O-CG 3.44Å; H54-E58 PolarHBondContact O-N 3.38Å; K55-E58 PolarHBondContact O-N 2.94Å; E58-S60 VanDerWaalsContact C-N 3.29Å; E58-S60 PolarHBondContact O-N 2.9Å; E58-R61 PolarHBondContact O-N 2.9Å; E58-Y62 WeakPolarHBondContact O-CD2 3.35Å; E58-Y62 PolarHBondContact O-N 3.46Å
59	K	66.8	Low	71.4	Confident	164 Å²	164	106.1 Å²	106.1	71%	0.713	55%	0.545	S	S	*	.	H	α-helix	trans	-64.4	-29.7	177.3	-78.8	-178.8	-179.7	179.6	0	113.6	K55 A56 D57 Y62	K55-K59 WeakPolarHBondContact O-CG 3.49Å; K55-K59 PolarHBondContact O-N 3.18Å; A56-K59 PolarHBondContact O-N 3.41Å; D57-K59 VanDerWaalsContact C-N 3.34Å; D57-K59 PolarHBondContact O-N 2.86Å; K59-Y62 VanDerWaalsContact O-O 3.08Å
60	S	64.6	Low	71.4	Confident	84 Å²	84	103 Å²	103	59%	0.587	54%	0.54	S	S	*	.	H	α-helix	trans	-76.7	-27.3	176.5	71.5	0	0	0	0	112.3	A56 D57 E58	A56-S60 PolarHBondContact O-N 3.4Å; D57-S60 PolarHBondContact O-N 3.13Å; D57-S60 PolarHBondContact O-OG 2.76Å; E58-S60 VanDerWaalsContact C-N 3.29Å; E58-S60 PolarHBondContact O-N 2.9Å
61	R	63.5	Low	71.9	Confident	160 Å²	160	100.4 Å²	100.4	60%	0.604	52%	0.524	S	S	*	.	H	α-helix	trans	-71.7	-30.2	175.8	-68.8	171.4	-170.3	-166.1	-3.9	113.1	D57 E58 A63	D57-R61 WeakPolarHBondContact O-CG 3.49Å; D57-R61 PolarHBondContact O-N 2.76Å; D57-R61 IonicContact OD1-NE 3.96Å; D57-R61 IonicContact OD2-CZ 3.96Å; D57-R61 IonicContact OD2-NE 3.41Å; D57-R61 PolarHBondContact OD2-NE 3.3Å; D57-R61 IonicContact OD2-NH2 3.65Å; D57-R61 PolarHBondContact OD2-NH2 2.72Å; E58-R61 PolarHBondContact O-N 2.9Å; R61-A63 PolarHBondContact O-N 2.94Å
62	Y	58.2	Low	72.3	Confident	185 Å²	185	99.8 Å²	99.8	73%	0.725	52%	0.521	S	S	*	.	S	Bend	trans	-76.8	106.7	165.9	-61.7	-71.5	0	0	0	107.3	E58 K59 S64	E58-Y62 WeakPolarHBondContact O-CD2 3.35Å; E58-Y62 PolarHBondContact O-N 3.46Å; K59-Y62 VanDerWaalsContact O-O 3.08Å; Y62-S64 PolarHBondContact O-N 2.89Å
63	A	56.6	Low	72.1	Confident	81 Å²	81	100.6 Å²	100.6	67%	0.669	52%	0.521	S	S	*	.			trans	-36.1	131.2	178.9	0	0	0	0	0	110.6	R61 N65	R61-A63 PolarHBondContact O-N 2.94Å; A63-N65 PolarHBondContact O-N 2.76Å
64	S	61.3	Low	72.1	Confident	82 Å²	82	102.2 Å²	102.2	57%	0.573	53%	0.531	S	S	*	.			trans	-45.6	130.9	173.9	47.3	0	0	0	0	108.2	Y62 H66	Y62-S64 PolarHBondContact O-N 2.89Å; S64-H66 PolarHBondContact O-N 2.98Å; S64-H66 PolarHBondContact OG-CD2 3.14Å; S64-H66 PolarHBondContact OG-NE2 2.86Å
65	N	61.4	Low	72.4	Confident	144 Å²	144	101.5 Å²	101.5	77%	0.77	53%	0.526	S	S	*	.			trans	-65.4	60.9	-179.5	-69.9	-44.5	0	0	0	110.8	A63 H67	A63-N65 PolarHBondContact O-N 2.76Å; N65-H67 PolarHBondContact O-N 3.29Å
66	H	62.4	Low	72.8	Confident	154 Å²	154	100.9 Å²	100.9	71%	0.713	52%	0.521	S	S	*	.			trans	-70.1	86.5	164.5	-71.5	-66.6	0	0	0	105.8	S64 T68	S64-H66 PolarHBondContact O-N 2.98Å; S64-H66 PolarHBondContact OG-CD2 3.14Å; S64-H66 PolarHBondContact OG-NE2 2.86Å; H66-T68 PolarHBondContact O-N 3.17Å; H66-T68 VanDerWaalsContact O-N 3.11Å
67	H	68.1	Low	73	Confident	76 Å²	76	99.8 Å²	99.8	35%	0.352	51%	0.506	S	S	.	.			trans	-55.5	121.4	171.8	-70.8	-55.9	0	0	0	108.6	N65 E71 L72	N65-H67 PolarHBondContact O-N 3.29Å; H67-E71 WeakPolarHBondContact CA-OE2 3.15Å; H67-E71 HydrophobicContact CB-CB 4.18Å; H67-E71 IonicContact CE1-OE2 3.77Å; H67-E71 IonicContact CG-OE2 3.22Å; H67-E71 IonicContact ND1-OE2 2.73Å; H67-E71 PolarHBondContact ND1-OE2 3.37Å; H67-L72 HydrophobicContact CB-CD1 4.44Å; H67-L72 HydrophobicContact CB-CD2 3.5Å; H67-L72 HydrophobicContact CB-CG 3.64Å
68	T	82.4	Confident	73.5	Confident	75 Å²	75	104.4 Å²	104.4	46%	0.46	52%	0.52	S	S	.	.			trans	-58.2	153.2	171.2	-53.6	0	0	0	0	109.1	H66 S70 E71 L72	H66-T68 PolarHBondContact O-N 3.17Å; H66-T68 VanDerWaalsContact O-N 3.11Å; T68-S70 WeakPolarHBondContact CG2-OG 3.33Å; T68-S70 PolarHBondContact O-N 3.27Å; T68-S70 VanDerWaalsContact O-N 3.14Å; T68-E71 WeakPolarHBondContact O-CA 3.45Å; T68-E71 WeakPolarHBondContact O-CB 3.31Å; T68-E71 PolarHBondContact O-N 2.83Å; T68-L72 PolarHBondContact O-N 3.14Å
69	S	81.7	Confident	74.2	Confident	99 Å²	99	108.3 Å²	108.3	69%	0.692	53%	0.532	S	S	*	.	H	α-helix	trans	-51.4	-36.7	174.8	52.2	0	0	0	0	112.6	L72 F73	S69-L72 PolarHBondContact O-N 3.3Å; S69-F73 WeakPolarHBondContact O-CB 3.48Å; S69-F73 PolarHBondContact O-N 2.97Å
70	S	82.2	Confident	75	Confident	66 Å²	66	103.3 Å²	103.3	46%	0.462	51%	0.508	S	S	.	.	H	α-helix	trans	-62.8	-44.9	172.5	56.2	0	0	0	0	112.8	T68 L72 F73 E74	T68-S70 WeakPolarHBondContact CG2-OG 3.33Å; T68-S70 PolarHBondContact O-N 3.27Å; T68-S70 VanDerWaalsContact O-N 3.14Å; S70-L72 PolarHBondContact O-N 2.96Å; S70-F73 WeakPolarHBondContact O-CB 3.31Å; S70-F73 PolarHBondContact O-N 2.87Å; S70-E74 WeakPolarHBondContact O-CG 3.49Å; S70-E74 PolarHBondContact O-N 3.01Å
71	E	84	Confident	75.8	Confident	90 Å²	90	102.9 Å²	102.9	42%	0.421	50%	0.497	S	S	.	.	H	α-helix	trans	-65.4	-40.2	177.3	-66.8	-178.1	-170.8	0	0	112.2	H67 T68 F73 E74 K75	H67-E71 WeakPolarHBondContact CA-OE2 3.15Å; H67-E71 HydrophobicContact CB-CB 4.18Å; H67-E71 IonicContact CE1-OE2 3.77Å; H67-E71 IonicContact CG-OE2 3.22Å; H67-E71 IonicContact ND1-OE2 2.73Å; H67-E71 PolarHBondContact ND1-OE2 3.37Å; T68-E71 WeakPolarHBondContact O-CA 3.45Å; T68-E71 WeakPolarHBondContact O-CB 3.31Å; T68-E71 PolarHBondContact O-N 2.83Å; E71-F73 VanDerWaalsContact C-N 3.33Å; E71-E74 PolarHBondContact O-N 2.72Å; E71-K75 VanDerWaalsContact O-CB 3.25Å; E71-K75 WeakPolarHBondContact O-CB 3.24Å; E71-K75 PolarHBondContact O-N 2.85Å
72	L	83.9	Confident	76.8	Confident	92 Å²	92	100.9 Å²	100.9	48%	0.482	50%	0.497	S	S	.	.	H	α-helix	trans	-63.1	-42.7	174.7	-69.8	178.8	0	0	0	111	H67 T68 S69 S70 K75 Y76	H67-L72 HydrophobicContact CB-CD1 4.44Å; H67-L72 HydrophobicContact CB-CD2 3.5Å; H67-L72 HydrophobicContact CB-CG 3.64Å; T68-L72 PolarHBondContact O-N 3.14Å; S69-L72 PolarHBondContact O-N 3.3Å; S70-L72 PolarHBondContact O-N 2.96Å; L72-K75 PolarHBondContact O-N 3.38Å; L72-Y76 WeakPolarHBondContact O-CB 3.38Å; L72-Y76 PolarHBondContact O-N 3Å
73	F	78.3	Confident	78.2	Confident	94 Å²	94	100.2 Å²	100.2	41%	0.412	49%	0.493	S	S	.	.	H	α-helix	trans	-61.4	-47.4	175.1	-179.2	-99.2	0	0	0	111.4	S69 S70 E71 K75 Y76 W77	S69-F73 WeakPolarHBondContact O-CB 3.48Å; S69-F73 PolarHBondContact O-N 2.97Å; S70-F73 WeakPolarHBondContact O-CB 3.31Å; S70-F73 PolarHBondContact O-N 2.87Å; E71-F73 VanDerWaalsContact C-N 3.33Å; F73-K75 PolarHBondContact O-N 3.42Å; F73-Y76 WeakPolarHBondContact O-CB 3.16Å; F73-Y76 PolarHBondContact O-N 3.23Å; F73-Y76 VanDerWaalsContact O-N 3.17Å; F73-W77 AromaticContact CD1-CD1 3.51Å; F73-W77 AromaticContact CD2-CD1 3.72Å; F73-W77 AromaticContact CD2-NE1 3.63Å; F73-W77 AromaticContact CE1-CD1 3.27Å; F73-W77 HydrophobicContact CE1-CG 4.34Å; F73-W77 AromaticContact CE1-NE1 3.51Å; F73-W77 AromaticContact CE2-CD1 3.52Å; F73-W77 AromaticContact CE2-NE1 3.03Å; F73-W77 AromaticContact CG-CD1 3.74Å; F73-W77 AromaticContact CZ-CD1 3.32Å; F73-W77 HydrophobicContact CZ-CG 4.49Å; F73-W77 AromaticContact CZ-NE1 2.99Å; F73-W77 VanDerWaalsContact O-CD1 3.25Å; F73-W77 PolarHBondContact O-N 3.42Å
74	E	81.1	Confident	79.5	Confident	98 Å²	98	96.9 Å²	96.9	46%	0.458	46%	0.464	S	S	.	.	H	α-helix	trans	-62.4	-40.4	176.3	-76.8	-54.3	132.7	0	0	112.7	S70 E71 Y76 W77 R78	S70-E74 WeakPolarHBondContact O-CG 3.49Å; S70-E74 PolarHBondContact O-N 3.01Å; E71-E74 PolarHBondContact O-N 2.72Å; E74-Y76 VanDerWaalsContact C-N 3.32Å; E74-Y76 PolarHBondContact O-N 2.87Å; E74-W77 PolarHBondContact O-N 3.03Å; E74-R78 WeakPolarHBondContact O-CB 3.44Å; E74-R78 PolarHBondContact O-N 3.24Å; E74-R78 PolarHBondContact O-NE 3.17Å
75	K	85.6	Confident	80.5	Confident	85 Å²	85	98.9 Å²	98.9	37%	0.37	46%	0.462	S	S	.	.	H	α-helix	trans	-65.9	-35.8	175.5	-174.2	178.5	-175.6	175	0	111.8	E71 L72 F73 R79	E71-K75 VanDerWaalsContact O-CB 3.25Å; E71-K75 WeakPolarHBondContact O-CB 3.24Å; E71-K75 PolarHBondContact O-N 2.85Å; L72-K75 PolarHBondContact O-N 3.38Å; F73-K75 PolarHBondContact O-N 3.42Å; K75-R79 PolarHBondContact O-N 2.93Å; K75-R79 PolarHBondContact O-NE 2.96Å
76	Y	85.9	Confident	81.6	Confident	108 Å²	108	95.2 Å²	95.2	42%	0.424	45%	0.448	S	S	.	.	H	α-helix	trans	-66	-50.9	172.7	171.5	-91.5	0	0	0	110.7	L72 F73 E74 R78 R79 R80	L72-Y76 WeakPolarHBondContact O-CB 3.38Å; L72-Y76 PolarHBondContact O-N 3Å; F73-Y76 WeakPolarHBondContact O-CB 3.16Å; F73-Y76 PolarHBondContact O-N 3.23Å; F73-Y76 VanDerWaalsContact O-N 3.17Å; E74-Y76 VanDerWaalsContact C-N 3.32Å; E74-Y76 PolarHBondContact O-N 2.87Å; Y76-R78 PolarHBondContact O-N 3.42Å; Y76-R79 PolarHBondContact O-N 3.06Å; Y76-R80 WeakPolarHBondContact O-CB 3.44Å; Y76-R80 PolarHBondContact O-N 3.28Å
77	W	79.7	Confident	82.6	Confident	27 Å²	27	91.2 Å²	91.2	10%	0.102	43%	0.429	C	S	.	.	H	α-helix	trans	-60.8	-42.5	-179.6	-87.7	102	0	0	0	112.8	F73 E74 R79 R80 H81 E128 L129 R132	F73-W77 AromaticContact CD1-CD1 3.51Å; F73-W77 AromaticContact CD2-CD1 3.72Å; F73-W77 AromaticContact CD2-NE1 3.63Å; F73-W77 AromaticContact CE1-CD1 3.27Å; F73-W77 HydrophobicContact CE1-CG 4.34Å; F73-W77 AromaticContact CE1-NE1 3.51Å; F73-W77 AromaticContact CE2-CD1 3.52Å; F73-W77 AromaticContact CE2-NE1 3.03Å; F73-W77 AromaticContact CG-CD1 3.74Å; F73-W77 AromaticContact CZ-CD1 3.32Å; F73-W77 HydrophobicContact CZ-CG 4.49Å; F73-W77 AromaticContact CZ-NE1 2.99Å; F73-W77 VanDerWaalsContact O-CD1 3.25Å; F73-W77 PolarHBondContact O-N 3.42Å; E74-W77 PolarHBondContact O-N 3.03Å; W77-R79 PolarHBondContact O-N 3.34Å; W77-R80 PolarHBondContact O-N 3.39Å; W77-H81 WeakPolarHBondContact O-CB 3.35Å; W77-H81 PolarHBondContact O-N 3.37Å; W77-E128 HydrophobicContact CH2-CG 4.44Å; W77-E128 VanDerWaalsContact CZ2-OE1 3.3Å; W77-E128 WeakPolarHBondContact CZ2-OE1 3.49Å; W77-L129 HydrophobicContact CH2-CD2 3.97Å; W77-L129 HydrophobicContact CZ3-CD2 3.54Å; W77-L129 HydrophobicContact CZ3-CG 4.3Å; W77-R132 VanDerWaalsContact CE2-NH2 3.29Å
78	R	82.5	Confident	83.1	Confident	149 Å²	149	88.5 Å²	88.5	56%	0.562	42%	0.418	S	S	*	.	H	α-helix	trans	-57.2	-49	174.3	-85.5	-178.4	-87.4	145	-9.4	112.3	E74 Y76 H81 I82	E74-R78 WeakPolarHBondContact O-CB 3.44Å; E74-R78 PolarHBondContact O-N 3.24Å; E74-R78 PolarHBondContact O-NE 3.17Å; Y76-R78 PolarHBondContact O-N 3.42Å; R78-H81 PolarHBondContact O-N 3.08Å; R78-I82 WeakPolarHBondContact O-CD1 3.47Å; R78-I82 VanDerWaalsContact O-CG1 3.26Å; R78-I82 WeakPolarHBondContact O-CG1 3.49Å; R78-I82 PolarHBondContact O-N 3.08Å
79	R	87.3	Confident	82.9	Confident	162 Å²	162	86.7 Å²	86.7	61%	0.611	42%	0.415	S	S	*	.	H	α-helix	trans	-63.9	-43.1	179	-77.7	-173.9	-77	176.1	-2.8	112.2	K75 Y76 W77 I82 R83	K75-R79 PolarHBondContact O-N 2.93Å; K75-R79 PolarHBondContact O-NE 2.96Å; Y76-R79 PolarHBondContact O-N 3.06Å; W77-R79 PolarHBondContact O-N 3.34Å; R79-I82 PolarHBondContact O-N 2.83Å; R79-R83 PolarHBondContact O-N 3.21Å
80	R	85	Confident	82.7	Confident	58 Å²	58	91.2 Å²	91.2	22%	0.219	42%	0.416	C	S	.	.	H	α-helix	trans	-62.7	-45	177.2	-174.5	172.5	179.7	72.6	-4.5	111.5	Y76 W77 R83 L84 D126 E128	Y76-R80 WeakPolarHBondContact O-CB 3.44Å; Y76-R80 PolarHBondContact O-N 3.28Å; W77-R80 PolarHBondContact O-N 3.39Å; R80-R83 WeakPolarHBondContact O-CB 3.48Å; R80-R83 PolarHBondContact O-N 3.28Å; R80-L84 HydrophobicContact CG-CD1 4.14Å; R80-L84 WeakPolarHBondContact O-CG 3.41Å; R80-L84 PolarHBondContact O-N 3.12Å; R80-D126 IonicContact CZ-OD1 3.52Å; R80-D126 IonicContact CZ-OD2 2.8Å; R80-D126 IonicContact NE-OD1 3.17Å; R80-D126 IonicContact NH1-OD2 2.83Å; R80-D126 IonicContact NH2-OD1 2.97Å; R80-D126 PolarHBondContact NH2-OD1 3.07Å; R80-D126 IonicContact NH2-OD2 3.11Å; R80-D126 PolarHBondContact NH2-OD2 3.35Å; R80-E128 IonicContact NE-OE2 2.86Å; R80-E128 IonicContact NH2-OE2 2.69Å
81	H	81.3	Confident	82.4	Confident	76 Å²	76	91 Å²	91	35%	0.352	41%	0.41	S	S	.	.	H	α-helix	trans	-65.4	-40	179.6	-172.6	-116.8	0	0	0	112.6	W77 R78 R83 L84 K85 I122	W77-H81 WeakPolarHBondContact O-CB 3.35Å; W77-H81 PolarHBondContact O-N 3.37Å; R78-H81 PolarHBondContact O-N 3.08Å; H81-R83 VanDerWaalsContact C-N 3.33Å; H81-R83 PolarHBondContact O-N 2.9Å; H81-L84 PolarHBondContact O-N 3.47Å; H81-K85 WeakPolarHBondContact CE1-CE 3.47Å; H81-K85 PolarHBondContact CE1-NZ 3.17Å; H81-K85 WeakPolarHBondContact O-CB 3.33Å; H81-K85 WeakPolarHBondContact O-CG 3.13Å; H81-K85 PolarHBondContact O-N 2.92Å; H81-I122 VanDerWaalsContact CD2-CD1 3.48Å; H81-I122 WeakPolarHBondContact CD2-CD1 3.48Å
82	I	84	Confident	81.8	Confident	117 Å²	117	90.9 Å²	90.9	60%	0.6	42%	0.419	S	S	*	.	H	α-helix	trans	-59.4	-45.2	173.2	-69.5	163.9	0	0	0	110.6	R78 R79 K85 S86	R78-I82 WeakPolarHBondContact O-CD1 3.47Å; R78-I82 VanDerWaalsContact O-CG1 3.26Å; R78-I82 WeakPolarHBondContact O-CG1 3.49Å; R78-I82 PolarHBondContact O-N 3.08Å; R79-I82 PolarHBondContact O-N 2.83Å; I82-K85 PolarHBondContact O-N 3.27Å; I82-S86 PolarHBondContact O-N 3.49Å
83	R	87.4	Confident	81.2	Confident	172 Å²	172	90.2 Å²	90.2	65%	0.649	42%	0.416	S	S	*	.	H	α-helix	trans	-63.3	-45	178.2	-177	-177.3	-67.5	170.8	-2.4	112.3	R79 R80 H81 S86 Q87	R79-R83 PolarHBondContact O-N 3.21Å; R80-R83 WeakPolarHBondContact O-CB 3.48Å; R80-R83 PolarHBondContact O-N 3.28Å; H81-R83 VanDerWaalsContact C-N 3.33Å; H81-R83 PolarHBondContact O-N 2.9Å; R83-S86 PolarHBondContact O-N 2.86Å; R83-S86 PolarHBondContact O-OG 3.5Å; R83-Q87 WeakPolarHBondContact O-CG 3.27Å; R83-Q87 PolarHBondContact O-N 3.49Å; R83-Q87 VanDerWaalsContact O-N 3.07Å
84	L	84.5	Confident	80.7	Confident	11 Å²	11	87.4 Å²	87.4	6%	0.058	41%	0.414	C	S	.	.	H	α-helix	trans	-66.4	-42.2	178.7	-72.5	169	0	0	0	111.2	R80 H81 S86 Q87 V88 I122 D126 L129	R80-L84 HydrophobicContact CG-CD1 4.14Å; R80-L84 WeakPolarHBondContact O-CG 3.41Å; R80-L84 PolarHBondContact O-N 3.12Å; H81-L84 PolarHBondContact O-N 3.47Å; L84-S86 VanDerWaalsContact C-N 3.33Å; L84-S86 PolarHBondContact O-N 3.41Å; L84-Q87 WeakPolarHBondContact O-CB 3.05Å; L84-Q87 PolarHBondContact O-N 3.44Å; L84-V88 VanDerWaalsContact O-CG2 3.31Å; L84-V88 WeakPolarHBondContact O-CG2 3.3Å; L84-V88 PolarHBondContact O-N 3.44Å; L84-I122 HydrophobicContact CB-CD1 4.03Å; L84-I122 HydrophobicContact CB-CG1 3.86Å; L84-D126 HydrophobicContact CD1-CB 4.21Å; L84-D126 HydrophobicContact CD2-CB 4.27Å; L84-L129 HydrophobicContact CD1-CD1 3.56Å
85	K	81.9	Confident	80.1	Confident	124 Å²	124	86.2 Å²	86.2	54%	0.539	41%	0.407	S	S	.	.	H	α-helix	trans	-58.7	-42.1	174.5	-80.7	-173.7	163.5	-179.3	0	112.5	H81 I82 Q87 V88 G89 I122	H81-K85 WeakPolarHBondContact CE1-CE 3.47Å; H81-K85 PolarHBondContact CE1-NZ 3.17Å; H81-K85 WeakPolarHBondContact O-CB 3.33Å; H81-K85 WeakPolarHBondContact O-CG 3.13Å; H81-K85 PolarHBondContact O-N 2.92Å; I82-K85 PolarHBondContact O-N 3.27Å; K85-Q87 VanDerWaalsContact C-N 3.33Å; K85-V88 PolarHBondContact O-N 3.02Å; K85-G89 PolarHBondContact O-N 3.22Å; K85-I122 HydrophobicContact CG-CD1 3.63Å
86	S	84.1	Confident	79.2	Confident	67 Å²	67	88.4 Å²	88.4	47%	0.469	41%	0.413	S	S	.	.	H	α-helix	trans	-69.8	-30.6	177.9	73	0	0	0	0	112.7	I82 R83 L84	I82-S86 PolarHBondContact O-N 3.49Å; R83-S86 PolarHBondContact O-N 2.86Å; R83-S86 PolarHBondContact O-OG 3.5Å; L84-S86 VanDerWaalsContact C-N 3.33Å; L84-S86 PolarHBondContact O-N 3.41Å
87	Q	83	Confident	78.5	Confident	70 Å²	70	91.6 Å²	91.6	33%	0.327	42%	0.424	S	S	.	.	H	α-helix	trans	-68	-50.1	170.8	-73	176.3	-24.2	0	0	111.6	R83 L84 K85 G89 R90 L91 M125	R83-Q87 WeakPolarHBondContact O-CG 3.27Å; R83-Q87 PolarHBondContact O-N 3.49Å; R83-Q87 VanDerWaalsContact O-N 3.07Å; L84-Q87 WeakPolarHBondContact O-CB 3.05Å; L84-Q87 PolarHBondContact O-N 3.44Å; K85-Q87 VanDerWaalsContact C-N 3.33Å; Q87-G89 PolarHBondContact O-N 3.5Å; Q87-R90 WeakPolarHBondContact O-CB 3.44Å; Q87-R90 PolarHBondContact O-N 3.29Å; Q87-L91 PolarHBondContact O-N 3.14Å; Q87-M125 HydrophobicContact CB-CE 3.9Å
88	V	80.2	Confident	78.7	Confident	18 Å²	18	95.6 Å²	95.6	11%	0.109	45%	0.448	C	S	.	.	H	α-helix	trans	-56.6	-40.3	176.1	176.2	0	0	0	0	111.1	L84 K85 R90 L91 R96 P121 I122 M125	L84-V88 VanDerWaalsContact O-CG2 3.31Å; L84-V88 WeakPolarHBondContact O-CG2 3.3Å; L84-V88 PolarHBondContact O-N 3.44Å; K85-V88 PolarHBondContact O-N 3.02Å; V88-R90 PolarHBondContact O-N 2.78Å; V88-L91 WeakPolarHBondContact O-CB 3.39Å; V88-L91 PolarHBondContact O-N 3.29Å; V88-R96 HydrophobicContact CG1-CG 4.19Å; V88-R96 WeakPolarHBondContact O-CG 3.43Å; V88-P121 HydrophobicContact CG1-CB 4.27Å; V88-I122 HydrophobicContact CG2-CB 4.16Å; V88-I122 HydrophobicContact CG2-CG1 4.33Å; V88-M125 HydrophobicContact CB-SD 4.31Å; V88-M125 HydrophobicContact CG2-SD 3.28Å; V88-M125 WeakPolarHBondContact CG2-SD 3.41Å
89	G	76.9	Confident	79.1	Confident	38 Å²	38	91.7 Å²	91.7	39%	0.392	44%	0.44	S	S	.	.	H	α-helix	trans	-61	-23.2	178	0	0	0	0	0	114.4	K85 Q87	K85-G89 PolarHBondContact O-N 3.22Å; Q87-G89 PolarHBondContact O-N 3.5Å
90	R	78.8	Confident	79.4	Confident	193 Å²	193	86.3 Å²	86.3	73%	0.728	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-9.7	176	-68.9	-174.4	-71.9	155	-4.6	113.9	Q87 V88	Q87-R90 WeakPolarHBondContact O-CB 3.44Å; Q87-R90 PolarHBondContact O-N 3.29Å; V88-R90 PolarHBondContact O-N 2.78Å
91	L	75.7	Confident	79.9	Confident	63 Å²	63	84.4 Å²	84.4	33%	0.33	42%	0.416	S	S	.	.	S	Bend	trans	-78.4	157.9	178.3	-61.9	177.7	0	0	0	110.7	Q87 V88 F95 R96 M125	Q87-L91 PolarHBondContact O-N 3.14Å; V88-L91 WeakPolarHBondContact O-CB 3.39Å; V88-L91 PolarHBondContact O-N 3.29Å; L91-F95 HydrophobicContact CB-CB 4.14Å; L91-F95 HydrophobicContact CB-CD1 4.04Å; L91-F95 HydrophobicContact CB-CG 4.35Å; L91-F95 HydrophobicContact CD1-CD1 3.17Å; L91-F95 HydrophobicContact CD1-CE1 3.31Å; L91-F95 HydrophobicContact CD1-CG 3.92Å; L91-F95 HydrophobicContact CD1-CZ 4.14Å; L91-F95 HydrophobicContact CG-CD1 4.22Å; L91-R96 WeakPolarHBondContact O-CD 3.37Å; L91-M125 HydrophobicContact CD1-CE 3.88Å; L91-M125 HydrophobicContact CD1-SD 3.55Å; L91-M125 VanDerWaalsContact CD1-SD 3.55Å
92	S	72	Confident	80.7	Confident	87 Å²	87	80.8 Å²	80.8	61%	0.608	40%	0.399	S	S	*	.			trans	-55.6	147.7	176.9	63.5	0	0	0	0	110.7	G94 F95 R96	S92-G94 PolarHBondContact O-N 2.61Å; S92-G94 VanDerWaalsContact O-N 3.12Å; S92-F95 PolarHBondContact O-N 3.29Å; S92-R96 PolarHBondContact O-N 2.69Å; S92-R96 VanDerWaalsContact O-N 3.14Å
93	D	71.2	Confident	81.4	Confident	77 Å²	77	78.2 Å²	78.2	41%	0.412	38%	0.382	S	S	.	.	H	α-helix	trans	-54.9	-32.5	-178.9	-175.9	48.1	0	0	0	112.6	R96 R97	D93-R96 PolarHBondContact O-N 3.22Å; D93-R97 PolarHBondContact O-N 3.14Å; D93-R97 IonicContact OD1-CZ 3.41Å; D93-R97 IonicContact OD1-NE 3.17Å; D93-R97 PolarHBondContact OD1-NE 2.9Å; D93-R97 VanDerWaalsContact OD1-NE 3.17Å; D93-R97 IonicContact OD1-NH1 3.96Å; D93-R97 IonicContact OD1-NH2 3.69Å; D93-R97 PolarHBondContact OD1-NH2 3.19Å; D93-R97 IonicContact OD2-CZ 3.9Å; D93-R97 IonicContact OD2-NE 3.6Å; D93-R97 IonicContact OD2-NH1 2.93Å; D93-R97 PolarHBondContact OD2-NH1 3.04Å; D93-R97 IonicContact OD2-NH2 2.78Å; D93-R97 PolarHBondContact OD2-NH2 3.43Å
94	G	67.5	Low	81.8	Confident	36 Å²	36	70 Å²	70	37%	0.371	35%	0.351	S	S	.	.	H	α-helix	trans	-57.7	-49.9	171.4	0	0	0	0	0	112.8	S92 R96 R97 N98	S92-G94 PolarHBondContact O-N 2.61Å; S92-G94 VanDerWaalsContact O-N 3.12Å; G94-R96 VanDerWaalsContact C-N 3.27Å; G94-R96 PolarHBondContact O-N 2.8Å; G94-R97 PolarHBondContact O-N 3.12Å; G94-N98 WeakPolarHBondContact O-CB 3.17Å; G94-N98 PolarHBondContact O-N 2.88Å; G94-N98 PolarHBondContact O-ND2 3.42Å; G94-N98 VanDerWaalsContact O-ND2 3.12Å; G94-N98 PolarHBondContact O-OD1 3.39Å
95	F	68	Low	82.4	Confident	72 Å²	72	70.7 Å²	70.7	32%	0.316	35%	0.353	S	S	.	.	H	α-helix	trans	-65.5	-32.7	177.5	-169.9	-88.6	0	0	0	112.3	L91 S92 R97 P121 M125	L91-F95 HydrophobicContact CB-CB 4.14Å; L91-F95 HydrophobicContact CB-CD1 4.04Å; L91-F95 HydrophobicContact CB-CG 4.35Å; L91-F95 HydrophobicContact CD1-CD1 3.17Å; L91-F95 HydrophobicContact CD1-CE1 3.31Å; L91-F95 HydrophobicContact CD1-CG 3.92Å; L91-F95 HydrophobicContact CD1-CZ 4.14Å; L91-F95 HydrophobicContact CG-CD1 4.22Å; S92-F95 PolarHBondContact O-N 3.29Å; F95-R97 VanDerWaalsContact C-N 3.25Å; F95-R97 PolarHBondContact O-N 2.94Å; F95-P121 HydrophobicContact CD1-CB 4.19Å; F95-P121 HydrophobicContact CE1-CB 4Å; F95-P121 WeakPolarHBondContact O-CB 3.39Å; F95-P121 VanDerWaalsContact O-CG 3.3Å; F95-P121 WeakPolarHBondContact O-CG 3.49Å; F95-M125 HydrophobicContact CE1-CG 3.79Å; F95-M125 HydrophobicContact CE1-SD 3.95Å; F95-M125 HydrophobicContact CZ-CG 3.8Å
96	R	65.8	Low	83.1	Confident	132 Å²	132	68.1 Å²	68.1	50%	0.498	34%	0.341	S	S	.	.	H	α-helix	trans	-68.8	-22.1	179.9	-67.5	179.4	62.3	-171.7	-3.4	113.5	V88 L91 S92 D93 G94	V88-R96 HydrophobicContact CG1-CG 4.19Å; V88-R96 WeakPolarHBondContact O-CG 3.43Å; L91-R96 WeakPolarHBondContact O-CD 3.37Å; S92-R96 PolarHBondContact O-N 2.69Å; S92-R96 VanDerWaalsContact O-N 3.14Å; D93-R96 PolarHBondContact O-N 3.22Å; G94-R96 VanDerWaalsContact C-N 3.27Å; G94-R96 PolarHBondContact O-N 2.8Å
97	R	71.1	Confident	83.6	Confident	175 Å²	175	65.6 Å²	65.6	66%	0.66	32%	0.322	S	S	*	.	H	α-helix	trans	-103.8	-22.4	179.8	-63.8	-178.9	-170.4	152.5	6.8	113.4	D93 G94 F95 V99	D93-R97 PolarHBondContact O-N 3.14Å; D93-R97 IonicContact OD1-CZ 3.41Å; D93-R97 IonicContact OD1-NE 3.17Å; D93-R97 PolarHBondContact OD1-NE 2.9Å; D93-R97 VanDerWaalsContact OD1-NE 3.17Å; D93-R97 IonicContact OD1-NH1 3.96Å; D93-R97 IonicContact OD1-NH2 3.69Å; D93-R97 PolarHBondContact OD1-NH2 3.19Å; D93-R97 IonicContact OD2-CZ 3.9Å; D93-R97 IonicContact OD2-NE 3.6Å; D93-R97 IonicContact OD2-NH1 2.93Å; D93-R97 PolarHBondContact OD2-NH1 3.04Å; D93-R97 IonicContact OD2-NH2 2.78Å; D93-R97 PolarHBondContact OD2-NH2 3.43Å; G94-R97 PolarHBondContact O-N 3.12Å; F95-R97 VanDerWaalsContact C-N 3.25Å; F95-R97 PolarHBondContact O-N 2.94Å; R97-V99 PolarHBondContact O-N 3.46Å
98	N	83.8	Confident	84.1	Confident	111 Å²	111	64 Å²	64	59%	0.594	32%	0.323	S	S	*	.			trans	-81.5	110.9	-173.6	-67.2	-11.3	0	0	0	111.4	G94	G94-N98 WeakPolarHBondContact O-CB 3.17Å; G94-N98 PolarHBondContact O-N 2.88Å; G94-N98 PolarHBondContact O-ND2 3.42Å; G94-N98 VanDerWaalsContact O-ND2 3.12Å; G94-N98 PolarHBondContact O-OD1 3.39Å
99	V	91.1	Very high	84.7	Confident	67 Å²	67	64.7 Å²	64.7	41%	0.406	33%	0.327	S	S	.	.			trans	-81.1	126.9	168.7	176.9	0	0	0	0	108.1	R97 H118 L119	R97-V99 PolarHBondContact O-N 3.46Å; V99-H118 HydrophobicContact CG1-CB 3.83Å; V99-L119 WeakPolarHBondContact CG1-O 3.46Å
100	K	93.8	Very high	85.4	Confident	48 Å²	48	64 Å²	64	21%	0.209	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	127.2	174.9	-174.2	-177.7	-65.9	176.4	0	108.8	I102 L119 V163 D165	K100-I102 HydrophobicContact CG-CG2 4.42Å; K100-L119 HydrophobicContact CB-CB 4.22Å; K100-L119 HydrophobicContact CD-CD1 4.41Å; K100-L119 PolarHBondContact N-O 3.03Å; K100-L119 WeakPolarHBondContact O-CA 3.37Å; K100-L119 WeakPolarHBondContact O-CB 3.46Å; K100-L119 PolarHBondContact O-N 3.39Å; K100-V163 HydrophobicContact CD-CG1 4.01Å; K100-V163 WeakPolarHBondContact CD-O 3.34Å; K100-V163 WeakPolarHBondContact CE-O 3.3Å; K100-V163 PolarHBondContact NZ-O 3.49Å; K100-D165 WeakPolarHBondContact CA-OD1 3.47Å; K100-D165 HydrophobicContact CG-CB 3.91Å
101	V	96.4	Very high	85.8	Confident	18 Å²	18	59.2 Å²	59.2	11%	0.109	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	127.9	179.7	-177.2	0	0	0	0	108.8	R116 D165 H166	V101-R116 HydrophobicContact CG1-CG 3.5Å; V101-D165 PolarHBondContact N-OD1 3.01Å; V101-H166 WeakPolarHBondContact O-CA 3.33Å; V101-H166 PolarHBondContact O-N 3.19Å
102	I	97.5	Very high	86.6	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	156.9	175.4	65.1	169.9	0	0	0	110.7	K100 V104 V117 L119 I134 V163 Y169	K100-I102 HydrophobicContact CG-CG2 4.42Å; I102-V104 HydrophobicContact CD1-CG2 3.79Å; I102-V104 HydrophobicContact CG1-CG2 4Å; I102-V117 HydrophobicContact CD1-CB 4.38Å; I102-V117 HydrophobicContact CG1-CB 3.81Å; I102-V117 HydrophobicContact CG1-CG1 4.45Å; I102-V117 PolarHBondContact N-O 2.6Å; I102-V117 PolarHBondContact O-N 3.38Å; I102-L119 HydrophobicContact CD1-CD1 3.96Å; I102-L119 HydrophobicContact CD1-CG 4.43Å; I102-L119 HydrophobicContact CG1-CD1 4.27Å; I102-L119 HydrophobicContact CG1-CG 4.46Å; I102-L119 HydrophobicContact CG2-CD1 4.15Å; I102-I134 HydrophobicContact CD1-CD1 3.84Å; I102-I134 HydrophobicContact CD1-CG1 4.02Å; I102-V163 HydrophobicContact CD1-CG1 4.5Å; I102-V163 HydrophobicContact CG2-CG1 3.7Å; I102-Y169 HydrophobicContact CB-CD2 4.13Å; I102-Y169 HydrophobicContact CB-CE2 4.24Å; I102-Y169 HydrophobicContact CD1-CD2 4.45Å; I102-Y169 HydrophobicContact CG2-CD2 4.41Å; I102-Y169 HydrophobicContact CG2-CE2 4.04Å
103	Y	97.8	Very high	87.6	Confident	63 Å²	63	59 Å²	59	25%	0.247	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.9	178.9	-66	-81.9	0	0	0	109.1	A114 I115 R116 H167 F168 Y169	Y103-A114 HydrophobicContact CD1-CB 4.36Å; Y103-I115 WeakPolarHBondContact CA-O 3.28Å; Y103-R116 HydrophobicContact CD1-CB 4.26Å; Y103-R116 HydrophobicContact CD1-CG 4.3Å; Y103-R116 HydrophobicContact CE1-CB 4.08Å; Y103-R116 HydrophobicContact CE1-CG 3.82Å; Y103-H167 PolarHBondContact N-O 3.5Å; Y103-F168 HydrophobicContact CD1-CE1 4.47Å; Y103-F168 HydrophobicContact CD2-CE1 4.34Å; Y103-F168 HydrophobicContact CD2-CZ 4.32Å; Y103-F168 HydrophobicContact CG-CD1 4.21Å; Y103-F168 AromaticContact CG-CE1 3.88Å; Y103-F168 HydrophobicContact CG-CE1 3.88Å; Y103-F168 HydrophobicContact CG-CZ 4.28Å; Y103-F168 CarbonylContact O-C 3.6Å; Y103-F168 VanDerWaalsContact O-CA 3.27Å; Y103-F168 WeakPolarHBondContact O-CA 3.48Å; Y103-Y169 PolarHBondContact O-N 3.42Å
104	V	97.6	Very high	88.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	123.4	-170.8	-172.7	0	0	0	0	110.8	I102 I115 V117 I134 V138 L149 Y169 A171	I102-V104 HydrophobicContact CD1-CG2 3.79Å; I102-V104 HydrophobicContact CG1-CG2 4Å; V104-I115 PolarHBondContact N-O 3.4Å; V104-I115 PolarHBondContact O-N 3.17Å; V104-V117 HydrophobicContact CB-CG2 4.45Å; V104-V117 HydrophobicContact CG2-CG2 3.9Å; V104-I134 HydrophobicContact CG1-CG2 4.03Å; V104-I134 HydrophobicContact CG2-CD1 4.47Å; V104-I134 HydrophobicContact CG2-CG1 4.35Å; V104-I134 HydrophobicContact CG2-CG2 4.47Å; V104-V138 HydrophobicContact CB-CG2 3.99Å; V104-V138 HydrophobicContact CG1-CG2 3.95Å; V104-L149 HydrophobicContact CG1-CD1 4.4Å; V104-Y169 CarbonylContact C-O 3.46Å; V104-Y169 WeakPolarHBondContact CA-O 3.37Å; V104-A171 HydrophobicContact CG1-CB 3.6Å
105	Y	96.8	Very high	90.1	Very high	25 Å²	25	56.9 Å²	56.9	10%	0.098	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	157.9	169.5	-65.1	-74.7	0	0	0	111.1	A114 L152 F168 Y169 V170 A171 Y182	Y105-A114 HydrophobicContact CD1-CB 4Å; Y105-A114 HydrophobicContact CD2-CB 4.33Å; Y105-A114 HydrophobicContact CE1-CB 3.61Å; Y105-A114 VanDerWaalsContact CE1-N 3.3Å; Y105-A114 HydrophobicContact CE2-CB 4Å; Y105-A114 HydrophobicContact CG-CB 4.35Å; Y105-L152 HydrophobicContact CD2-CD2 3.9Å; Y105-L152 HydrophobicContact CE2-CD2 4.06Å; Y105-F168 HydrophobicContact CD2-CD1 4.45Å; Y105-F168 HydrophobicContact CE2-CB 4.36Å; Y105-F168 AromaticContact CE2-CD1 3.55Å; Y105-F168 HydrophobicContact CE2-CD1 3.55Å; Y105-F168 HydrophobicContact CE2-CE1 4.28Å; Y105-F168 HydrophobicContact CE2-CG 4.31Å; Y105-Y169 PolarHBondContact N-O 2.81Å; Y105-V170 CarbonylContact O-C 3.6Å; Y105-V170 WeakPolarHBondContact O-CA 3.47Å; Y105-A171 PolarHBondContact O-N 3.45Å; Y105-Y182 HydrophobicContact CD2-CG 4.31Å; Y105-Y182 HydrophobicContact CG-CD1 4.09Å; Y105-Y182 HydrophobicContact CG-CG 4.2Å
106	R	95.8	Very high	91.5	Very high	71 Å²	71	60.3 Å²	60.3	27%	0.268	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	132.7	170.7	-58.8	-176.8	-67.8	-165.5	-5.8	108.9	G108 D109 T112 V138 I139 L140 Y182	R106-G108 PolarHBondContact O-N 3.2Å; R106-D109 HydrophobicContact CB-CB 3.99Å; R106-D109 IonicContact CZ-OD2 3.11Å; R106-D109 IonicContact NE-OD2 2.86Å; R106-D109 PolarHBondContact NE-OD2 3.37Å; R106-D109 IonicContact NH2-OD2 2.64Å; R106-D109 PolarHBondContact NH2-OD2 3.34Å; R106-D109 PolarHBondContact O-N 3.17Å; R106-T112 PolarHBondContact NH2-OG1 3.49Å; R106-V138 HydrophobicContact CG-CG1 3.84Å; R106-I139 WeakPolarHBondContact CD-O 3.41Å; R106-L140 HydrophobicContact CB-CD2 4.3Å; R106-L140 HydrophobicContact CG-CD2 4.4Å; R106-Y182 WeakPolarHBondContact O-CE1 3Å
107	N	95.6	Very high	93	Very high	14 Å²	14	54.1 Å²	54.1	8%	0.075	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	125.3	179.4	-171.6	34.3	0	0	0	111.5	V170 A171 A172 E175 T176 L178 Y182	N107-V170 HydrophobicContact CB-CG1 3.82Å; N107-A171 VanDerWaalsContact CB-O 3.25Å; N107-A171 WeakPolarHBondContact CB-O 3.36Å; N107-A171 PolarHBondContact N-O 3.39Å; N107-A172 HydrophobicContact CB-CB 3.82Å; N107-E175 WeakPolarHBondContact ND2-CG 3.46Å; N107-T176 PolarHBondContact ND2-O 3.47Å; N107-L178 WeakPolarHBondContact OD1-CB 3.4Å; N107-L178 PolarHBondContact OD1-N 2.95Å; N107-Y182 PolarHBondContact OD1-OH 2.82Å; N107-Y182 VanDerWaalsContact OD1-OH 3.08Å
108	G	92.6	Very high	94.2	Very high	35 Å²	35	50.1 Å²	50.1	36%	0.361	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-3.8	-177.8	0	0	0	0	0	116.3	R106 Y182	R106-G108 PolarHBondContact O-N 3.2Å; G108-Y182 PolarHBondContact N-OH 3.23Å
109	D	92.5	Very high	94.8	Very high	33 Å²	33	44.8 Å²	44.8	18%	0.176	23%	0.23	C	C	.	.			trans	-106.6	103.1	179.2	-178.7	-1	0	0	0	111.2	R106 F111 T112 Y182	R106-D109 HydrophobicContact CB-CB 3.99Å; R106-D109 IonicContact CZ-OD2 3.11Å; R106-D109 IonicContact NE-OD2 2.86Å; R106-D109 PolarHBondContact NE-OD2 3.37Å; R106-D109 IonicContact NH2-OD2 2.64Å; R106-D109 PolarHBondContact NH2-OD2 3.34Å; R106-D109 PolarHBondContact O-N 3.17Å; D109-F111 PolarHBondContact OD1-N 2.86Å; D109-T112 WeakPolarHBondContact OD1-CB 3.37Å; D109-T112 PolarHBondContact OD1-N 2.94Å; D109-T112 VanDerWaalsContact OD1-N 3.09Å; D109-T112 PolarHBondContact OD1-OG1 2.86Å; D109-T112 WeakPolarHBondContact OD2-CB 3.31Å; D109-T112 PolarHBondContact OD2-OG1 2.83Å; D109-Y182 WeakPolarHBondContact O-CD1 3.48Å
110	T	91.4	Very high	94.8	Very high	25 Å²	25	48.5 Å²	48.5	15%	0.153	24%	0.236	C	C	.	.	S	Bend	trans	-84.4	-27.4	-174.3	47.1	0	0	0	0	114.2	R180 D181 G183 Q184	T110-R180 HydrophobicContact CG2-CB 3.39Å; T110-R180 HydrophobicContact CG2-CG 3.9Å; T110-D181 WeakPolarHBondContact CB-O 3.4Å; T110-D181 WeakPolarHBondContact CG2-O 3.21Å; T110-G183 PolarHBondContact O-N 2.94Å; T110-Q184 PolarHBondContact O-N 2.87Å
111	F	88.8	Confident	94.6	Very high	92 Å²	92	47.1 Å²	47.1	40%	0.404	23%	0.232	S	C	.	.	S	Bend	trans	-99.3	-19.3	-166.8	-57.8	-67.4	0	0	0	113	D109 Q184 L186 P187	D109-F111 PolarHBondContact OD1-N 2.86Å; F111-Q184 HydrophobicContact CD1-CB 4.33Å; F111-Q184 HydrophobicContact CE1-CB 4.47Å; F111-L186 HydrophobicContact CB-CD2 3.62Å; F111-L186 HydrophobicContact CB-CG 4.34Å; F111-L186 HydrophobicContact CG-CD2 4.18Å; F111-P187 HydrophobicContact CE1-CG 3.89Å; F111-P187 HydrophobicContact CZ-CG 4.27Å
112	T	91.5	Very high	94.3	Very high	45 Å²	45	47.3 Å²	47.3	28%	0.276	23%	0.232	S	C	.	.	S	Bend	trans	-75.8	130.3	175.5	-58.2	0	0	0	0	109.9	R106 D109	R106-T112 PolarHBondContact NH2-OG1 3.49Å; D109-T112 WeakPolarHBondContact OD1-CB 3.37Å; D109-T112 PolarHBondContact OD1-N 2.94Å; D109-T112 VanDerWaalsContact OD1-N 3.09Å; D109-T112 PolarHBondContact OD1-OG1 2.86Å; D109-T112 WeakPolarHBondContact OD2-CB 3.31Å; D109-T112 PolarHBondContact OD2-OG1 2.83Å
113	P	92.6	Very high	94	Very high	99 Å²	99	48 Å²	48	64%	0.643	24%	0.236	S	C	*	.	P	Polyproline II helix	trans	-62.7	155.1	176.7	27	-35.2	0	0	0	111.3	I115	P113-I115 PolarHBondContact O-N 2.88Å
114	A	95.5	Very high	93.7	Very high	22 Å²	22	45.4 Å²	45.4	18%	0.182	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-62.1	136	179	0	0	0	0	0	111.5	Y103 Y105 F168	Y103-A114 HydrophobicContact CD1-CB 4.36Å; Y105-A114 HydrophobicContact CD1-CB 4Å; Y105-A114 HydrophobicContact CD2-CB 4.33Å; Y105-A114 HydrophobicContact CE1-CB 3.61Å; Y105-A114 VanDerWaalsContact CE1-N 3.3Å; Y105-A114 HydrophobicContact CE2-CB 4Å; Y105-A114 HydrophobicContact CG-CB 4.35Å; A114-F168 HydrophobicContact CB-CD1 4.08Å; A114-F168 HydrophobicContact CB-CE1 4.02Å
115	I	96.8	Very high	93.2	Very high	47 Å²	47	47.9 Å²	47.9	24%	0.241	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	125.1	176.3	-62.2	164.1	0	0	0	108.3	Y103 V104 P113 V117 C137 V138	Y103-I115 WeakPolarHBondContact CA-O 3.28Å; V104-I115 PolarHBondContact N-O 3.4Å; V104-I115 PolarHBondContact O-N 3.17Å; P113-I115 PolarHBondContact O-N 2.88Å; I115-V117 HydrophobicContact CG2-CG2 4.4Å; I115-V117 PolarHBondContact O-N 2.94Å; I115-C137 HydrophobicContact CG2-CB 4.12Å; I115-V138 HydrophobicContact CB-CG2 4.07Å; I115-V138 HydrophobicContact CD1-CB 4.21Å; I115-V138 HydrophobicContact CD1-CG1 4.04Å; I115-V138 HydrophobicContact CD1-CG2 3.89Å; I115-V138 HydrophobicContact CG2-CG2 4.06Å
116	R	97.6	Very high	92.9	Very high	145 Å²	145	47.9 Å²	47.9	55%	0.547	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	113.8	179.4	-167.2	175.3	86.6	-157.4	0.5	110.5	V101 Y103 H118	V101-R116 HydrophobicContact CG1-CG 3.5Å; Y103-R116 HydrophobicContact CD1-CB 4.26Å; Y103-R116 HydrophobicContact CD1-CG 4.3Å; Y103-R116 HydrophobicContact CE1-CB 4.08Å; Y103-R116 HydrophobicContact CE1-CG 3.82Å; R116-H118 PolarHBondContact NE-CE1 3.11Å; R116-H118 VanDerWaalsContact NE-CE1 3.35Å; R116-H118 PolarHBondContact NE-NE2 2.88Å; R116-H118 VanDerWaalsContact NE-NE2 3.14Å; R116-H118 PolarHBondContact NH2-NE2 3.42Å
117	V	97.4	Very high	92.8	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	128.7	179.9	-176.1	0	0	0	0	109.9	I102 V104 I115 L119 A133 I134 C137 V138	I102-V117 HydrophobicContact CD1-CB 4.38Å; I102-V117 HydrophobicContact CG1-CB 3.81Å; I102-V117 HydrophobicContact CG1-CG1 4.45Å; I102-V117 PolarHBondContact N-O 2.6Å; I102-V117 PolarHBondContact O-N 3.38Å; V104-V117 HydrophobicContact CB-CG2 4.45Å; V104-V117 HydrophobicContact CG2-CG2 3.9Å; I115-V117 HydrophobicContact CG2-CG2 4.4Å; I115-V117 PolarHBondContact O-N 2.94Å; V117-L119 HydrophobicContact CG1-CD2 4.08Å; V117-A133 HydrophobicContact CG1-CB 4.43Å; V117-I134 HydrophobicContact CG1-CG1 4.32Å; V117-C137 HydrophobicContact CG2-CB 3.88Å; V117-V138 HydrophobicContact CG2-CG2 4.34Å
118	H	96	Very high	92.7	Very high	91 Å²	91	49.5 Å²	49.5	42%	0.421	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	113.1	177.8	-56.1	88.8	0	0	0	109.5	V99 R116	V99-H118 HydrophobicContact CG1-CB 3.83Å; R116-H118 PolarHBondContact NE-CE1 3.11Å; R116-H118 VanDerWaalsContact NE-CE1 3.35Å; R116-H118 PolarHBondContact NE-NE2 2.88Å; R116-H118 VanDerWaalsContact NE-NE2 3.14Å; R116-H118 PolarHBondContact NH2-NE2 3.42Å
119	L	95.3	Very high	92.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	109.4	177.8	-58.1	175.9	0	0	0	109.5	V99 K100 I102 V117 A124 I130 A133 V163	V99-L119 WeakPolarHBondContact CG1-O 3.46Å; K100-L119 HydrophobicContact CB-CB 4.22Å; K100-L119 HydrophobicContact CD-CD1 4.41Å; K100-L119 PolarHBondContact N-O 3.03Å; K100-L119 WeakPolarHBondContact O-CA 3.37Å; K100-L119 WeakPolarHBondContact O-CB 3.46Å; K100-L119 PolarHBondContact O-N 3.39Å; I102-L119 HydrophobicContact CD1-CD1 3.96Å; I102-L119 HydrophobicContact CD1-CG 4.43Å; I102-L119 HydrophobicContact CG1-CD1 4.27Å; I102-L119 HydrophobicContact CG1-CG 4.46Å; I102-L119 HydrophobicContact CG2-CD1 4.15Å; V117-L119 HydrophobicContact CG1-CD2 4.08Å; L119-A124 HydrophobicContact CB-CB 4.26Å; L119-I130 HydrophobicContact CD1-CD1 4.49Å; L119-I130 HydrophobicContact CD1-CG1 4.25Å; L119-I130 HydrophobicContact CD1-CG2 4.03Å; L119-I130 HydrophobicContact CD2-CB 4.5Å; L119-I130 HydrophobicContact CD2-CG1 4.5Å; L119-I130 HydrophobicContact CD2-CG2 4.16Å; L119-A133 HydrophobicContact CD2-CB 3.63Å; L119-V163 HydrophobicContact CD1-CG1 3.94Å
120	R	92.1	Very high	92.9	Very high	145 Å²	145	47.3 Å²	47.3	55%	0.547	23%	0.231	S	C	.	.			trans	-59.4	155.5	171.2	-64.1	-172.2	-65.8	-86.8	3.1	110	I122 Q123 A124	R120-I122 HydrophobicContact CB-CG2 4.24Å; R120-I122 PolarHBondContact O-N 3.39Å; R120-I122 VanDerWaalsContact O-N 3.08Å; R120-Q123 HydrophobicContact CB-CG 4.39Å; R120-Q123 WeakPolarHBondContact O-CA 3.49Å; R120-Q123 WeakPolarHBondContact O-CB 3.33Å; R120-Q123 PolarHBondContact O-N 2.91Å; R120-A124 PolarHBondContact O-N 3.46Å
121	P	89.8	Confident	93.1	Very high	18 Å²	18	47 Å²	47	12%	0.117	23%	0.228	C	C	.	.	H	α-helix	trans	-50.1	-40.6	178.5	-29.8	34.1	0	0	0	113.8	V88 F95 Q123 A124 M125	V88-P121 HydrophobicContact CG1-CB 4.27Å; F95-P121 HydrophobicContact CD1-CB 4.19Å; F95-P121 HydrophobicContact CE1-CB 4Å; F95-P121 WeakPolarHBondContact O-CB 3.39Å; F95-P121 VanDerWaalsContact O-CG 3.3Å; F95-P121 WeakPolarHBondContact O-CG 3.49Å; P121-Q123 PolarHBondContact O-N 3.29Å; P121-A124 PolarHBondContact O-N 3.01Å; P121-M125 WeakPolarHBondContact O-CG 3.16Å; P121-M125 PolarHBondContact O-N 3.19Å
122	I	88.5	Confident	93.3	Very high	23 Å²	23	46 Å²	46	12%	0.118	22%	0.221	C	C	.	.	H	α-helix	trans	-66.2	-36.1	176.6	-165.8	169.9	0	0	0	113.2	H81 L84 K85 V88 R120 L129	H81-I122 VanDerWaalsContact CD2-CD1 3.48Å; H81-I122 WeakPolarHBondContact CD2-CD1 3.48Å; L84-I122 HydrophobicContact CB-CD1 4.03Å; L84-I122 HydrophobicContact CB-CG1 3.86Å; K85-I122 HydrophobicContact CG-CD1 3.63Å; V88-I122 HydrophobicContact CG2-CB 4.16Å; V88-I122 HydrophobicContact CG2-CG1 4.33Å; R120-I122 HydrophobicContact CB-CG2 4.24Å; R120-I122 PolarHBondContact O-N 3.39Å; R120-I122 VanDerWaalsContact O-N 3.08Å; I122-L129 HydrophobicContact CG1-CD1 4.34Å; I122-L129 WeakPolarHBondContact O-CD1 3.38Å
123	Q	91.3	Very high	93.5	Very high	14 Å²	14	44 Å²	44	7%	0.065	21%	0.209	C	C	.	.	H	α-helix	trans	-73.3	-42.6	178.2	-67.6	168	-52.4	0	0	110.1	R120 P121 M125 D126 L129 I130	R120-Q123 HydrophobicContact CB-CG 4.39Å; R120-Q123 WeakPolarHBondContact O-CA 3.49Å; R120-Q123 WeakPolarHBondContact O-CB 3.33Å; R120-Q123 PolarHBondContact O-N 2.91Å; P121-Q123 PolarHBondContact O-N 3.29Å; Q123-M125 PolarHBondContact O-N 3.44Å; Q123-M125 VanDerWaalsContact O-N 3.08Å; Q123-D126 PolarHBondContact O-N 2.88Å; Q123-D126 VanDerWaalsContact O-O 3.07Å; Q123-L129 HydrophobicContact CB-CB 4.2Å; Q123-L129 HydrophobicContact CG-CB 4.29Å; Q123-I130 WeakPolarHBondContact O-CG1 3.43Å
124	A	91.7	Very high	93.7	Very high	9 Å²	9	39.3 Å²	39.3	7%	0.074	18%	0.179	C	C	.	.	H	α-helix	trans	-65.2	-12.1	-178.5	0	0	0	0	0	114.6	L119 R120 P121 P160	L119-A124 HydrophobicContact CB-CB 4.26Å; R120-A124 PolarHBondContact O-N 3.46Å; P121-A124 PolarHBondContact O-N 3.01Å; A124-P160 WeakPolarHBondContact O-CB 3.45Å
125	M	87.8	Confident	93.7	Very high	52 Å²	52	42.2 Å²	42.2	26%	0.256	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-17.2	177.2	-73.1	-176.2	71.4	0	0	114.1	Q87 V88 L91 F95 P121 Q123	Q87-M125 HydrophobicContact CB-CE 3.9Å; V88-M125 HydrophobicContact CB-SD 4.31Å; V88-M125 HydrophobicContact CG2-SD 3.28Å; V88-M125 WeakPolarHBondContact CG2-SD 3.41Å; L91-M125 HydrophobicContact CD1-CE 3.88Å; L91-M125 HydrophobicContact CD1-SD 3.55Å; L91-M125 VanDerWaalsContact CD1-SD 3.55Å; F95-M125 HydrophobicContact CE1-CG 3.79Å; F95-M125 HydrophobicContact CE1-SD 3.95Å; F95-M125 HydrophobicContact CZ-CG 3.8Å; P121-M125 WeakPolarHBondContact O-CG 3.16Å; P121-M125 PolarHBondContact O-N 3.19Å; Q123-M125 PolarHBondContact O-N 3.44Å; Q123-M125 VanDerWaalsContact O-N 3.08Å
126	D	90.7	Very high	93.6	Very high	25 Å²	25	46.2 Å²	46.2	13%	0.134	21%	0.211	C	C	.	.			trans	-134.2	120.4	-170.7	-167.4	-95.5	0	0	0	110.6	R80 L84 Q123 E128 L129 I130	R80-D126 IonicContact CZ-OD1 3.52Å; R80-D126 IonicContact CZ-OD2 2.8Å; R80-D126 IonicContact NE-OD1 3.17Å; R80-D126 IonicContact NH1-OD2 2.83Å; R80-D126 IonicContact NH2-OD1 2.97Å; R80-D126 PolarHBondContact NH2-OD1 3.07Å; R80-D126 IonicContact NH2-OD2 3.11Å; R80-D126 PolarHBondContact NH2-OD2 3.35Å; L84-D126 HydrophobicContact CD1-CB 4.21Å; L84-D126 HydrophobicContact CD2-CB 4.27Å; Q123-D126 PolarHBondContact O-N 2.88Å; Q123-D126 VanDerWaalsContact O-O 3.07Å; D126-E128 VanDerWaalsContact C-N 3.25Å; D126-E128 PolarHBondContact O-N 2.91Å; D126-E128 WeakPolarHBondContact OD1-CB 3.25Å; D126-E128 PolarHBondContact OD1-N 3.24Å; D126-L129 HydrophobicContact CB-CB 4.16Å; D126-L129 HydrophobicContact CB-CD1 4.05Å; D126-L129 HydrophobicContact CB-CG 4.1Å; D126-L129 WeakPolarHBondContact O-CB 3.38Å; D126-L129 PolarHBondContact O-N 3.17Å; D126-L129 PolarHBondContact OD1-N 3.01Å; D126-I130 WeakPolarHBondContact O-CG1 3.49Å; D126-I130 PolarHBondContact O-N 2.63Å
127	F	94.4	Very high	93.5	Very high	48 Å²	48	42.2 Å²	42.2	21%	0.211	20%	0.204	C	C	.	.	H	α-helix	trans	-60	-35.8	-173.7	-169.8	-108.3	0	0	0	112.7	L129 I130 M131 L149 V157	F127-L129 VanDerWaalsContact C-N 3.32Å; F127-L129 PolarHBondContact O-N 2.88Å; F127-I130 WeakPolarHBondContact O-CB 3.48Å; F127-I130 PolarHBondContact O-N 2.71Å; F127-M131 HydrophobicContact CD1-CG 4.05Å; F127-M131 HydrophobicContact CE1-CG 3.7Å; F127-M131 HydrophobicContact CE1-SD 3.95Å; F127-M131 HydrophobicContact CE2-SD 4.38Å; F127-M131 HydrophobicContact CZ-CG 3.94Å; F127-M131 HydrophobicContact CZ-SD 3.69Å; F127-M131 VanDerWaalsContact O-CG 3.27Å; F127-M131 WeakPolarHBondContact O-CG 3.48Å; F127-M131 PolarHBondContact O-N 3.22Å; F127-L149 HydrophobicContact CZ-CB 4.48Å; F127-V157 HydrophobicContact CE2-CB 4.28Å; F127-V157 HydrophobicContact CE2-CG1 3.72Å; F127-V157 HydrophobicContact CZ-CG1 4.43Å; F127-V157 WeakPolarHBondContact CZ-O 3.49Å
128	E	93.1	Very high	93.4	Very high	71 Å²	71	42.2 Å²	42.2	33%	0.332	20%	0.204	S	C	.	.	H	α-helix	trans	-64.8	-38.2	177	-165	-174.4	168.9	0	0	111.6	W77 R80 D126 M131 R132	W77-E128 HydrophobicContact CH2-CG 4.44Å; W77-E128 VanDerWaalsContact CZ2-OE1 3.3Å; W77-E128 WeakPolarHBondContact CZ2-OE1 3.49Å; R80-E128 IonicContact NE-OE2 2.86Å; R80-E128 IonicContact NH2-OE2 2.69Å; D126-E128 VanDerWaalsContact C-N 3.25Å; D126-E128 PolarHBondContact O-N 2.91Å; D126-E128 WeakPolarHBondContact OD1-CB 3.25Å; D126-E128 PolarHBondContact OD1-N 3.24Å; E128-M131 PolarHBondContact O-N 3.32Å; E128-R132 WeakPolarHBondContact O-CG 3.33Å; E128-R132 PolarHBondContact O-N 3.41Å; E128-R132 IonicContact OE1-CZ 3.56Å; E128-R132 IonicContact OE1-NE 3.59Å; E128-R132 IonicContact OE1-NH2 2.87Å; E128-R132 PolarHBondContact OE1-NH2 3.36Å
129	L	92.9	Very high	93.2	Very high	22 Å²	22	44 Å²	44	12%	0.115	22%	0.215	C	C	.	.	H	α-helix	trans	-70.2	-33.5	175	-71	-178.3	0	0	0	113	W77 L84 I122 Q123 D126 F127 A133	W77-L129 HydrophobicContact CH2-CD2 3.97Å; W77-L129 HydrophobicContact CZ3-CD2 3.54Å; W77-L129 HydrophobicContact CZ3-CG 4.3Å; L84-L129 HydrophobicContact CD1-CD1 3.56Å; I122-L129 HydrophobicContact CG1-CD1 4.34Å; I122-L129 WeakPolarHBondContact O-CD1 3.38Å; Q123-L129 HydrophobicContact CB-CB 4.2Å; Q123-L129 HydrophobicContact CG-CB 4.29Å; D126-L129 HydrophobicContact CB-CB 4.16Å; D126-L129 HydrophobicContact CB-CD1 4.05Å; D126-L129 HydrophobicContact CB-CG 4.1Å; D126-L129 WeakPolarHBondContact O-CB 3.38Å; D126-L129 PolarHBondContact O-N 3.17Å; D126-L129 PolarHBondContact OD1-N 3.01Å; F127-L129 VanDerWaalsContact C-N 3.32Å; F127-L129 PolarHBondContact O-N 2.88Å; L129-A133 WeakPolarHBondContact O-CB 3.48Å; L129-A133 PolarHBondContact O-N 3.32Å
130	I	95.5	Very high	93.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.6	-49.8	171.7	-63.1	177.9	0	0	0	109.4	L119 Q123 D126 F127 R132 A133 I134 P160 V163	L119-I130 HydrophobicContact CD1-CD1 4.49Å; L119-I130 HydrophobicContact CD1-CG1 4.25Å; L119-I130 HydrophobicContact CD1-CG2 4.03Å; L119-I130 HydrophobicContact CD2-CB 4.5Å; L119-I130 HydrophobicContact CD2-CG1 4.5Å; L119-I130 HydrophobicContact CD2-CG2 4.16Å; Q123-I130 WeakPolarHBondContact O-CG1 3.43Å; D126-I130 WeakPolarHBondContact O-CG1 3.49Å; D126-I130 PolarHBondContact O-N 2.63Å; F127-I130 WeakPolarHBondContact O-CB 3.48Å; F127-I130 PolarHBondContact O-N 2.71Å; I130-R132 VanDerWaalsContact C-N 3.32Å; I130-R132 PolarHBondContact O-N 3.46Å; I130-A133 WeakPolarHBondContact O-CB 3.04Å; I130-A133 PolarHBondContact O-N 3.46Å; I130-A133 VanDerWaalsContact O-N 3.17Å; I130-I134 HydrophobicContact CG2-CD1 3.82Å; I130-I134 HydrophobicContact CG2-CG1 4.45Å; I130-I134 VanDerWaalsContact O-CG1 3.31Å; I130-I134 WeakPolarHBondContact O-CG1 3.48Å; I130-I134 PolarHBondContact O-N 3.01Å; I130-P160 HydrophobicContact CD1-CB 3.75Å; I130-V163 HydrophobicContact CD1-CB 4.26Å; I130-V163 HydrophobicContact CD1-CG2 3.94Å; I130-V163 HydrophobicContact CG2-CG2 4.44Å
131	M	95.9	Very high	93.1	Very high	18 Å²	18	40.4 Å²	40.4	9%	0.089	21%	0.21	C	C	.	.	H	α-helix	trans	-59.2	-42.9	-179.8	-68	-64.7	-72.4	0	0	111.9	F127 E128 I134 E135 V146 R147 L149	F127-M131 HydrophobicContact CD1-CG 4.05Å; F127-M131 HydrophobicContact CE1-CG 3.7Å; F127-M131 HydrophobicContact CE1-SD 3.95Å; F127-M131 HydrophobicContact CE2-SD 4.38Å; F127-M131 HydrophobicContact CZ-CG 3.94Å; F127-M131 HydrophobicContact CZ-SD 3.69Å; F127-M131 VanDerWaalsContact O-CG 3.27Å; F127-M131 WeakPolarHBondContact O-CG 3.48Å; F127-M131 PolarHBondContact O-N 3.22Å; E128-M131 PolarHBondContact O-N 3.32Å; M131-I134 WeakPolarHBondContact O-CB 3.26Å; M131-I134 PolarHBondContact O-N 3.03Å; M131-E135 WeakPolarHBondContact O-CB 3.34Å; M131-E135 PolarHBondContact O-N 2.87Å; M131-V146 HydrophobicContact CE-CG1 3.77Å; M131-R147 WeakPolarHBondContact CE-O 3.41Å; M131-L149 HydrophobicContact SD-CB 3.88Å
132	R	93.7	Very high	93	Very high	71 Å²	71	50 Å²	50	27%	0.268	25%	0.246	S	C	.	.	H	α-helix	trans	-63.2	-44.1	174.2	-71.3	176	-172.2	-140.6	-11.1	112.9	W77 E128 I130 I134 E135 D136	W77-R132 VanDerWaalsContact CE2-NH2 3.29Å; E128-R132 WeakPolarHBondContact O-CG 3.33Å; E128-R132 PolarHBondContact O-N 3.41Å; E128-R132 IonicContact OE1-CZ 3.56Å; E128-R132 IonicContact OE1-NE 3.59Å; E128-R132 IonicContact OE1-NH2 2.87Å; E128-R132 PolarHBondContact OE1-NH2 3.36Å; I130-R132 VanDerWaalsContact C-N 3.32Å; I130-R132 PolarHBondContact O-N 3.46Å; R132-I134 PolarHBondContact O-N 3.21Å; R132-E135 PolarHBondContact O-N 3.28Å; R132-E135 VanDerWaalsContact O-N 3.14Å; R132-D136 VanDerWaalsContact O-CG 3.23Å; R132-D136 PolarHBondContact O-N 3.2Å
133	A	95.1	Very high	92.9	Very high	4 Å²	4	52.2 Å²	52.2	3%	0.033	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-33.5	177.1	0	0	0	0	0	112.2	V117 L119 L129 I130 C137	V117-A133 HydrophobicContact CG1-CB 4.43Å; L119-A133 HydrophobicContact CD2-CB 3.63Å; L129-A133 WeakPolarHBondContact O-CB 3.48Å; L129-A133 PolarHBondContact O-N 3.32Å; I130-A133 WeakPolarHBondContact O-CB 3.04Å; I130-A133 PolarHBondContact O-N 3.46Å; I130-A133 VanDerWaalsContact O-N 3.17Å; A133-C137 PolarHBondContact O-SG 3.03Å
134	I	96.8	Very high	93	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-71.3	-46.7	173.3	-66	169.2	0	0	0	110.2	I102 V104 V117 I130 M131 R132 D136 C137 V138 V146 L149 A171	I102-I134 HydrophobicContact CD1-CD1 3.84Å; I102-I134 HydrophobicContact CD1-CG1 4.02Å; V104-I134 HydrophobicContact CG1-CG2 4.03Å; V104-I134 HydrophobicContact CG2-CD1 4.47Å; V104-I134 HydrophobicContact CG2-CG1 4.35Å; V104-I134 HydrophobicContact CG2-CG2 4.47Å; V117-I134 HydrophobicContact CG1-CG1 4.32Å; I130-I134 HydrophobicContact CG2-CD1 3.82Å; I130-I134 HydrophobicContact CG2-CG1 4.45Å; I130-I134 VanDerWaalsContact O-CG1 3.31Å; I130-I134 WeakPolarHBondContact O-CG1 3.48Å; I130-I134 PolarHBondContact O-N 3.01Å; M131-I134 WeakPolarHBondContact O-CB 3.26Å; M131-I134 PolarHBondContact O-N 3.03Å; R132-I134 PolarHBondContact O-N 3.21Å; I134-D136 VanDerWaalsContact C-N 3.28Å; I134-D136 PolarHBondContact O-N 3.2Å; I134-C137 CarbonylContact O-C 3.5Å; I134-C137 PolarHBondContact O-N 3.2Å; I134-V138 HydrophobicContact CG2-CB 4.11Å; I134-V138 HydrophobicContact CG2-CG2 3.87Å; I134-V138 VanDerWaalsContact O-CB 3.31Å; I134-V138 WeakPolarHBondContact O-CB 3.39Å; I134-V138 WeakPolarHBondContact O-CG2 3.48Å; I134-V138 PolarHBondContact O-N 3.28Å; I134-V146 HydrophobicContact CG2-CG1 4.24Å; I134-V146 HydrophobicContact CG2-CG2 4.5Å; I134-L149 HydrophobicContact CD1-CD1 3.81Å; I134-L149 HydrophobicContact CD1-CD2 3.72Å; I134-L149 HydrophobicContact CD1-CG 4.36Å; I134-A171 HydrophobicContact CG2-CB 4.11Å
135	E	95.7	Very high	93.1	Very high	82 Å²	82	57.9 Å²	57.9	38%	0.383	30%	0.304	S	S	.	.	H	α-helix	trans	-59	-37.3	178.5	-172	168.8	-157.6	0	0	112.6	M131 R132 C137 A145 V146	M131-E135 WeakPolarHBondContact O-CB 3.34Å; M131-E135 PolarHBondContact O-N 2.87Å; R132-E135 PolarHBondContact O-N 3.28Å; R132-E135 VanDerWaalsContact O-N 3.14Å; E135-C137 PolarHBondContact O-N 3.43Å; E135-A145 VanDerWaalsContact OE1-CA 3.3Å; E135-A145 WeakPolarHBondContact OE1-CA 3.48Å; E135-A145 WeakPolarHBondContact OE1-CB 3.4Å; E135-V146 HydrophobicContact CB-CB 4.24Å; E135-V146 HydrophobicContact CB-CG2 4.17Å; E135-V146 HydrophobicContact CG-CG2 4.38Å
136	D	94.4	Very high	93.5	Very high	132 Å²	132	55.9 Å²	55.9	71%	0.706	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-26.3	175.3	-68.4	-22.2	0	0	0	112.9	R132 I134	R132-D136 VanDerWaalsContact O-CG 3.23Å; R132-D136 PolarHBondContact O-N 3.2Å; I134-D136 VanDerWaalsContact C-N 3.28Å; I134-D136 PolarHBondContact O-N 3.2Å
137	C	95	Very high	93.8	Very high	60 Å²	60	62.7 Å²	62.7	41%	0.405	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-31.3	-176.6	-58.5	0	0	0	0	113.3	I115 V117 A133 I134 E135	I115-C137 HydrophobicContact CG2-CB 4.12Å; V117-C137 HydrophobicContact CG2-CB 3.88Å; A133-C137 PolarHBondContact O-SG 3.03Å; I134-C137 CarbonylContact O-C 3.5Å; I134-C137 PolarHBondContact O-N 3.2Å; E135-C137 PolarHBondContact O-N 3.43Å
138	V	95.1	Very high	93.8	Very high	2 Å²	2	64.9 Å²	64.9	1%	0.012	33%	0.326	C	S	.	.			trans	-112.3	103.5	-168.6	-177.6	0	0	0	0	109.7	V104 R106 I115 V117 I134 L140 A171	V104-V138 HydrophobicContact CB-CG2 3.99Å; V104-V138 HydrophobicContact CG1-CG2 3.95Å; R106-V138 HydrophobicContact CG-CG1 3.84Å; I115-V138 HydrophobicContact CB-CG2 4.07Å; I115-V138 HydrophobicContact CD1-CB 4.21Å; I115-V138 HydrophobicContact CD1-CG1 4.04Å; I115-V138 HydrophobicContact CD1-CG2 3.89Å; I115-V138 HydrophobicContact CG2-CG2 4.06Å; V117-V138 HydrophobicContact CG2-CG2 4.34Å; I134-V138 HydrophobicContact CG2-CB 4.11Å; I134-V138 HydrophobicContact CG2-CG2 3.87Å; I134-V138 VanDerWaalsContact O-CB 3.31Å; I134-V138 WeakPolarHBondContact O-CB 3.39Å; I134-V138 WeakPolarHBondContact O-CG2 3.48Å; I134-V138 PolarHBondContact O-N 3.28Å; V138-L140 HydrophobicContact CG1-CD2 4.43Å; V138-L140 PolarHBondContact O-N 3.49Å; V138-A171 HydrophobicContact CG1-CB 4.07Å
139	I	93.4	Very high	94.1	Very high	128 Å²	128	61.5 Å²	61.5	66%	0.656	31%	0.31	S	S	*	.			trans	-87.4	112.3	176.8	-55.5	172.7	0	0	0	109.2	R106	R106-I139 WeakPolarHBondContact CD-O 3.41Å
140	L	93.9	Very high	94.3	Very high	3 Å²	3	61.5 Å²	61.5	2%	0.016	31%	0.309	C	S	.	.			trans	-76.6	152.5	172.3	-61.6	177.8	0	0	0	111	R106 V138 G143 K144 V146 A171	R106-L140 HydrophobicContact CB-CD2 4.3Å; R106-L140 HydrophobicContact CG-CD2 4.4Å; V138-L140 HydrophobicContact CG1-CD2 4.43Å; V138-L140 PolarHBondContact O-N 3.49Å; L140-G143 PolarHBondContact O-N 3.35Å; L140-K144 HydrophobicContact CB-CB 4.04Å; L140-K144 WeakPolarHBondContact CB-O 3.36Å; L140-K144 HydrophobicContact CD1-CB 4.33Å; L140-V146 HydrophobicContact CD1-CB 4.48Å; L140-V146 HydrophobicContact CD1-CG2 3.91Å; L140-V146 HydrophobicContact CG-CG2 4.07Å; L140-A171 HydrophobicContact CD2-CB 4.41Å
141	P	90	Very high	94.3	Very high	66 Å²	66	63.1 Å²	63.1	43%	0.429	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-54	145.5	176.4	-25.3	34.3	0	0	0	112.5	G143 K144	P141-G143 PolarHBondContact O-N 2.96Å; P141-K144 WeakPolarHBondContact O-CG 3.48Å
142	Y	87.7	Confident	94.3	Very high	221 Å²	221	66.1 Å²	66.1	87%	0.867	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	62.4	21.5	-179.5	-45.3	-78.7	0	0	0	115.1	K144	Y142-K144 VanDerWaalsContact C-N 3.25Å; Y142-K144 PolarHBondContact O-N 3.2Å
143	G	88	Confident	94.3	Very high	69 Å²	69	66 Å²	66	71%	0.711	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	67.6	25.4	178.1	0	0	0	0	0	113.5	L140 P141	L140-G143 PolarHBondContact O-N 3.35Å; P141-G143 PolarHBondContact O-N 2.96Å
144	K	92.7	Very high	94.3	Very high	102 Å²	102	67 Å²	67	44%	0.443	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-67.6	137.8	177.5	-69.9	175.6	177.4	-176.8	0	110.6	L140 P141 Y142 E175	L140-K144 HydrophobicContact CB-CB 4.04Å; L140-K144 WeakPolarHBondContact CB-O 3.36Å; L140-K144 HydrophobicContact CD1-CB 4.33Å; P141-K144 WeakPolarHBondContact O-CG 3.48Å; Y142-K144 VanDerWaalsContact C-N 3.25Å; Y142-K144 PolarHBondContact O-N 3.2Å; K144-E175 IonicContact NZ-OE2 3.61Å
145	A	94.3	Very high	94.2	Very high	39 Å²	39	73.7 Å²	73.7	32%	0.322	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-69.2	144.5	170.3	0	0	0	0	0	111.3	E135 R147 G173	E135-A145 VanDerWaalsContact OE1-CA 3.3Å; E135-A145 WeakPolarHBondContact OE1-CA 3.48Å; E135-A145 WeakPolarHBondContact OE1-CB 3.4Å; A145-R147 PolarHBondContact O-N 3.15Å; A145-G173 WeakPolarHBondContact O-CA 3.46Å
146	V	96.1	Very high	94.3	Very high	10 Å²	10	73 Å²	73	6%	0.061	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-74.8	117.3	173.7	-177.5	0	0	0	0	108.6	M131 I134 E135 L140 A171	M131-V146 HydrophobicContact CE-CG1 3.77Å; I134-V146 HydrophobicContact CG2-CG1 4.24Å; I134-V146 HydrophobicContact CG2-CG2 4.5Å; E135-V146 HydrophobicContact CB-CB 4.24Å; E135-V146 HydrophobicContact CB-CG2 4.17Å; E135-V146 HydrophobicContact CG-CG2 4.38Å; L140-V146 HydrophobicContact CD1-CB 4.48Å; L140-V146 HydrophobicContact CD1-CG2 3.91Å; L140-V146 HydrophobicContact CG-CG2 4.07Å; V146-A171 HydrophobicContact CG1-CB 3.91Å; V146-A171 HydrophobicContact CG2-CB 4.34Å
147	R	95.4	Very high	94.4	Very high	168 Å²	168	66.8 Å²	66.8	63%	0.634	36%	0.363	S	S	*	.			trans	-116.5	-21.7	-178.6	-62.4	-173.3	174.6	176.9	-8.4	113.7	M131 A145 A172 G173 S174	M131-R147 WeakPolarHBondContact CE-O 3.41Å; A145-R147 PolarHBondContact O-N 3.15Å; R147-A172 PolarHBondContact N-O 2.71Å; R147-G173 WeakPolarHBondContact CB-O 3.44Å; R147-S174 PolarHBondContact NH1-OG 3.44Å
148	R	96.2	Very high	94.4	Very high	95 Å²	95	71.1 Å²	71.1	36%	0.358	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	146.8	-178.8	-59.8	-176.5	-177.1	149.1	-3.7	110.4	Y150 L156 A172 S174 E175	R148-Y150 HydrophobicContact CB-CD2 4.32Å; R148-Y150 HydrophobicContact CB-CE2 3.62Å; R148-Y150 WeakPolarHBondContact CD-OH 3.49Å; R148-L156 HydrophobicContact CB-CD1 3.93Å; R148-L156 HydrophobicContact CG-CD1 4.28Å; R148-A172 HydrophobicContact CB-CB 4.37Å; R148-A172 PolarHBondContact N-O 3.28Å; R148-A172 PolarHBondContact O-N 3.36Å; R148-S174 PolarHBondContact NH1-O 3.11Å; R148-E175 PolarHBondContact NH1-O 2.84Å; R148-E175 VanDerWaalsContact NH1-O 3.13Å
149	L	97.7	Very high	94.5	Very high	0 Å²	0	72.5 Å²	72.5	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	126.4	174.8	-172.4	68.7	0	0	0	108.2	V104 F127 M131 I134 V157 Y169	V104-L149 HydrophobicContact CG1-CD1 4.4Å; F127-L149 HydrophobicContact CZ-CB 4.48Å; M131-L149 HydrophobicContact SD-CB 3.88Å; I134-L149 HydrophobicContact CD1-CD1 3.81Å; I134-L149 HydrophobicContact CD1-CD2 3.72Å; I134-L149 HydrophobicContact CD1-CG 4.36Å; L149-V157 HydrophobicContact CB-CB 4.22Å; L149-V157 HydrophobicContact CD2-CB 4.23Å; L149-V157 HydrophobicContact CD2-CG1 4.29Å; L149-V157 HydrophobicContact CD2-CG2 4.32Å; L149-V157 HydrophobicContact CG-CB 4.32Å; L149-V157 HydrophobicContact CG-CG2 4.22Å; L149-V157 WeakPolarHBondContact O-CB 3.23Å; L149-V157 PolarHBondContact O-N 3.31Å; L149-Y169 HydrophobicContact CD1-CG 4.41Å; L149-Y169 HydrophobicContact CD2-CD1 4.23Å; L149-Y169 HydrophobicContact CD2-CG 4.27Å; L149-Y169 HydrophobicContact CG-CD1 4.26Å; L149-Y169 HydrophobicContact CG-CG 4.33Å
150	Y	97.4	Very high	94.5	Very high	22 Å²	22	67.3 Å²	67.3	9%	0.086	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	152.9	-179.9	-65.1	-85.7	0	0	0	110.9	R148 G154 E155 L156 Y169 V170 A172 F177	R148-Y150 HydrophobicContact CB-CD2 4.32Å; R148-Y150 HydrophobicContact CB-CE2 3.62Å; R148-Y150 WeakPolarHBondContact CD-OH 3.49Å; Y150-G154 WeakPolarHBondContact CD1-O 3.42Å; Y150-E155 CarbonylContact C-O 3.59Å; Y150-E155 VanDerWaalsContact CA-O 3.24Å; Y150-E155 WeakPolarHBondContact CA-O 3.46Å; Y150-L156 HydrophobicContact CD1-CB 4.16Å; Y150-L156 HydrophobicContact CD1-CD1 4.2Å; Y150-L156 HydrophobicContact CE1-CB 3.94Å; Y150-L156 HydrophobicContact CE1-CD1 3.81Å; Y150-L156 HydrophobicContact CE1-CG 4.45Å; Y150-L156 HydrophobicContact CE2-CD1 4.44Å; Y150-Y169 CarbonylContact O-C 3.49Å; Y150-Y169 VanDerWaalsContact O-CA 3.24Å; Y150-Y169 WeakPolarHBondContact O-CA 3.24Å; Y150-Y169 WeakPolarHBondContact O-CB 3.37Å; Y150-V170 PolarHBondContact N-O 3.22Å; Y150-V170 PolarHBondContact O-N 3.09Å; Y150-A172 HydrophobicContact CD2-CB 4.1Å; Y150-A172 HydrophobicContact CE2-CB 3.84Å; Y150-F177 HydrophobicContact CD1-CB 3.96Å; Y150-F177 HydrophobicContact CD1-CD2 4.34Å; Y150-F177 HydrophobicContact CD1-CG 4.31Å; Y150-F177 HydrophobicContact CD2-CB 4.04Å; Y150-F177 HydrophobicContact CD2-CD2 4.03Å; Y150-F177 HydrophobicContact CD2-CG 4.48Å; Y150-F177 HydrophobicContact CE1-CB 3.94Å; Y150-F177 HydrophobicContact CE2-CB 4.02Å; Y150-F177 HydrophobicContact CG-CB 3.99Å; Y150-F177 AromaticContact CG-CD2 3.75Å; Y150-F177 HydrophobicContact CG-CD2 3.75Å; Y150-F177 HydrophobicContact CG-CG 4.15Å
151	T	96.7	Very high	94.4	Very high	33 Å²	33	73.9 Å²	73.9	20%	0.202	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	166.1	161.5	66.9	0	0	0	0	109.6	G153 G154 E155 V157 Y169	T151-G153 PolarHBondContact O-N 2.97Å; T151-G153 PolarHBondContact OG1-N 3.17Å; T151-G154 PolarHBondContact O-N 2.85Å; T151-E155 HydrophobicContact CG2-CB 4.23Å; T151-E155 PolarHBondContact N-O 3.31Å; T151-E155 WeakPolarHBondContact OG1-CB 3.31Å; T151-E155 PolarHBondContact OG1-N 3.4Å; T151-E155 VanDerWaalsContact OG1-N 3.14Å; T151-V157 HydrophobicContact CG2-CG2 4.09Å; T151-Y169 HydrophobicContact CG2-CE1 4.32Å
152	L	94.6	Very high	94.7	Very high	81 Å²	81	75.4 Å²	75.4	42%	0.424	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.8	172.6	-67	178.8	0	0	0	112.8	Y105 G154 F168 V170 Y182	Y105-L152 HydrophobicContact CD2-CD2 3.9Å; Y105-L152 HydrophobicContact CE2-CD2 4.06Å; L152-G154 VanDerWaalsContact C-N 3.27Å; L152-G154 PolarHBondContact O-N 3.08Å; L152-F168 HydrophobicContact CD1-CB 3.61Å; L152-F168 HydrophobicContact CD1-CG 4.29Å; L152-F168 HydrophobicContact CD2-CB 4.37Å; L152-F168 HydrophobicContact CG-CB 3.91Å; L152-V170 HydrophobicContact CD2-CG2 3.93Å; L152-Y182 HydrophobicContact CD2-CD2 4.11Å; L152-Y182 HydrophobicContact CD2-CG 4.38Å
153	G	93.8	Very high	95.1	Very high	70 Å²	70	65 Å²	65	72%	0.722	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-0.6	174.1	0	0	0	0	0	114.6	T151	T151-G153 PolarHBondContact O-N 2.97Å; T151-G153 PolarHBondContact OG1-N 3.17Å
154	G	95	Very high	95.4	Very high	24 Å²	24	67.5 Å²	67.5	25%	0.247	34%	0.343	C	S	.	.	S	Bend	trans	84.3	10.2	-179.6	0	0	0	0	0	115	Y150 T151 L152 F177	Y150-G154 WeakPolarHBondContact CD1-O 3.42Å; T151-G154 PolarHBondContact O-N 2.85Å; L152-G154 VanDerWaalsContact C-N 3.27Å; L152-G154 PolarHBondContact O-N 3.08Å; G154-F177 VanDerWaalsContact CA-CD1 3.47Å
155	E	96.2	Very high	95.5	Very high	140 Å²	140	66.1 Å²	66.1	65%	0.654	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-79.8	132.2	176.3	-56.2	-178.4	137.4	0	0	110.6	Y150 T151 V157	Y150-E155 CarbonylContact C-O 3.59Å; Y150-E155 VanDerWaalsContact CA-O 3.24Å; Y150-E155 WeakPolarHBondContact CA-O 3.46Å; T151-E155 HydrophobicContact CG2-CB 4.23Å; T151-E155 PolarHBondContact N-O 3.31Å; T151-E155 WeakPolarHBondContact OG1-CB 3.31Å; T151-E155 PolarHBondContact OG1-N 3.4Å; T151-E155 VanDerWaalsContact OG1-N 3.14Å; E155-V157 PolarHBondContact O-N 3.18Å
156	L	96.9	Very high	95.6	Very high	67 Å²	67	69.4 Å²	69.4	35%	0.351	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-74.5	119.7	178.8	-178.4	67.2	0	0	0	110.6	R148 Y150 K158	R148-L156 HydrophobicContact CB-CD1 3.93Å; R148-L156 HydrophobicContact CG-CD1 4.28Å; Y150-L156 HydrophobicContact CD1-CB 4.16Å; Y150-L156 HydrophobicContact CD1-CD1 4.2Å; Y150-L156 HydrophobicContact CE1-CB 3.94Å; Y150-L156 HydrophobicContact CE1-CD1 3.81Å; Y150-L156 HydrophobicContact CE1-CG 4.45Å; Y150-L156 HydrophobicContact CE2-CD1 4.44Å; L156-K158 HydrophobicContact CD2-CG 4.1Å; L156-K158 HydrophobicContact CG-CG 4.05Å; L156-K158 PolarHBondContact O-N 2.73Å
157	V	97.1	Very high	95.6	Very high	3 Å²	3	72.7 Å²	72.7	2%	0.018	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-74.8	118.7	171.3	-172.4	0	0	0	0	108.1	F127 L149 T151 E155 M162 V163 Y169	F127-V157 HydrophobicContact CE2-CB 4.28Å; F127-V157 HydrophobicContact CE2-CG1 3.72Å; F127-V157 HydrophobicContact CZ-CG1 4.43Å; F127-V157 WeakPolarHBondContact CZ-O 3.49Å; L149-V157 HydrophobicContact CB-CB 4.22Å; L149-V157 HydrophobicContact CD2-CB 4.23Å; L149-V157 HydrophobicContact CD2-CG1 4.29Å; L149-V157 HydrophobicContact CD2-CG2 4.32Å; L149-V157 HydrophobicContact CG-CB 4.32Å; L149-V157 HydrophobicContact CG-CG2 4.22Å; L149-V157 WeakPolarHBondContact O-CB 3.23Å; L149-V157 PolarHBondContact O-N 3.31Å; T151-V157 HydrophobicContact CG2-CG2 4.09Å; E155-V157 PolarHBondContact O-N 3.18Å; V157-M162 HydrophobicContact CG1-CB 3.78Å; V157-V163 HydrophobicContact CG1-CG2 3.8Å; V157-Y169 HydrophobicContact CG2-CD1 3.75Å; V157-Y169 HydrophobicContact CG2-CE1 3.77Å
158	K	95	Very high	95.7	Very high	150 Å²	150	68.9 Å²	68.9	65%	0.652	35%	0.352	S	S	*	.			trans	-113.4	-17.3	-177.1	-65.5	178.4	-177.6	174.7	0	113.8	L156	L156-K158 HydrophobicContact CD2-CG 4.1Å; L156-K158 HydrophobicContact CG-CG 4.05Å; L156-K158 PolarHBondContact O-N 2.73Å
159	S	95.4	Very high	95.8	Very high	31 Å²	31	64.7 Å²	64.7	22%	0.217	34%	0.336	C	S	.	.	S	Bend	trans	-138	153.1	-171	85.6	0	0	0	0	111.1	E161 M162	S159-E161 WeakPolarHBondContact CB-OE2 3.32Å; S159-E161 PolarHBondContact O-N 3.29Å; S159-E161 PolarHBondContact OG-OE2 3.39Å; S159-M162 PolarHBondContact O-N 3.2Å
160	P	93.6	Very high	95.8	Very high	19 Å²	19	64.7 Å²	64.7	12%	0.123	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-67.2	-21.8	-177.1	27.5	-32.3	0	0	0	113	A124 I130 M162 V163	A124-P160 WeakPolarHBondContact O-CB 3.45Å; I130-P160 HydrophobicContact CD1-CB 3.75Å; P160-M162 VanDerWaalsContact C-N 3.32Å; P160-M162 PolarHBondContact O-N 3.14Å; P160-V163 WeakPolarHBondContact O-CB 3.01Å; P160-V163 PolarHBondContact O-N 3.16Å
161	E	93.2	Very high	95.8	Very high	141 Å²	141	63.7 Å²	63.7	66%	0.659	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-71	-27.7	178.5	-53.4	75.9	-160.8	0	0	112.4	S159 V163	S159-E161 WeakPolarHBondContact CB-OE2 3.32Å; S159-E161 PolarHBondContact O-N 3.29Å; S159-E161 PolarHBondContact OG-OE2 3.39Å; E161-V163 PolarHBondContact O-N 3.04Å
162	M	95.4	Very high	95.7	Very high	99 Å²	99	62.1 Å²	62.1	49%	0.488	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-72.1	-16.2	175	-66.7	179	177.9	0	0	112.5	V157 S159 P160 K164 Y169	V157-M162 HydrophobicContact CG1-CB 3.78Å; S159-M162 PolarHBondContact O-N 3.2Å; P160-M162 VanDerWaalsContact C-N 3.32Å; P160-M162 PolarHBondContact O-N 3.14Å; M162-K164 PolarHBondContact O-N 3.42Å; M162-Y169 PolarHBondContact O-OH 3.3Å
163	V	95.7	Very high	95.8	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.006	30%	0.302	C	S	.	.			trans	-84.4	109.2	178	-175.2	0	0	0	0	109	K100 I102 L119 I130 V157 P160 E161 Y169	K100-V163 HydrophobicContact CD-CG1 4.01Å; K100-V163 WeakPolarHBondContact CD-O 3.34Å; K100-V163 WeakPolarHBondContact CE-O 3.3Å; K100-V163 PolarHBondContact NZ-O 3.49Å; I102-V163 HydrophobicContact CD1-CG1 4.5Å; I102-V163 HydrophobicContact CG2-CG1 3.7Å; L119-V163 HydrophobicContact CD1-CG1 3.94Å; I130-V163 HydrophobicContact CD1-CB 4.26Å; I130-V163 HydrophobicContact CD1-CG2 3.94Å; I130-V163 HydrophobicContact CG2-CG2 4.44Å; V157-V163 HydrophobicContact CG1-CG2 3.8Å; P160-V163 WeakPolarHBondContact O-CB 3.01Å; P160-V163 PolarHBondContact O-N 3.16Å; E161-V163 PolarHBondContact O-N 3.04Å; V163-Y169 WeakPolarHBondContact CA-OH 3.44Å; V163-Y169 HydrophobicContact CG1-CE2 4.3Å
164	K	95	Very high	95.8	Very high	123 Å²	123	58.3 Å²	58.3	54%	0.535	29%	0.292	S	S	.	.			trans	-100.3	152.4	-178.8	-66.5	179.6	-178.5	177.9	0	110.6	M162 H167 Y169	M162-K164 PolarHBondContact O-N 3.42Å; K164-H167 HydrophobicContact CB-CB 4.13Å; K164-H167 VanDerWaalsContact CB-ND1 3.31Å; K164-H167 WeakPolarHBondContact CB-ND1 3.04Å; K164-H167 WeakPolarHBondContact CD-NE2 3.49Å; K164-Y169 PolarHBondContact N-OH 3.26Å
165	D	94.6	Very high	95.7	Very high	72 Å²	72	59.5 Å²	59.5	39%	0.385	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	139.5	177.6	-166.4	39.1	0	0	0	110.8	K100 V101 H167	K100-D165 WeakPolarHBondContact CA-OD1 3.47Å; K100-D165 HydrophobicContact CG-CB 3.91Å; V101-D165 PolarHBondContact N-OD1 3.01Å; D165-H167 VanDerWaalsContact C-N 3.27Å; D165-H167 PolarHBondContact O-N 3.46Å; D165-H167 PolarHBondContact O-ND1 3.05Å
166	H	96.3	Very high	95.6	Very high	108 Å²	108	57.8 Å²	57.8	50%	0.5	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	30.7	-177	-60	83.3	0	0	0	115.1	V101	V101-H166 WeakPolarHBondContact O-CA 3.33Å; V101-H166 PolarHBondContact O-N 3.19Å
167	H	96.8	Very high	95.5	Very high	80 Å²	80	56.4 Å²	56.4	37%	0.37	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	159.6	178.3	-76.7	61.8	0	0	0	113.3	Y103 K164 D165 Y169	Y103-H167 PolarHBondContact N-O 3.5Å; K164-H167 HydrophobicContact CB-CB 4.13Å; K164-H167 VanDerWaalsContact CB-ND1 3.31Å; K164-H167 WeakPolarHBondContact CB-ND1 3.04Å; K164-H167 WeakPolarHBondContact CD-NE2 3.49Å; D165-H167 VanDerWaalsContact C-N 3.27Å; D165-H167 PolarHBondContact O-N 3.46Å; D165-H167 PolarHBondContact O-ND1 3.05Å; H167-Y169 HydrophobicContact CB-CE2 3.7Å
168	F	97	Very high	95.4	Very high	88 Å²	88	59.7 Å²	59.7	39%	0.386	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	138.2	-178.8	-66.1	-90.2	0	0	0	112.6	Y103 Y105 A114 L152	Y103-F168 HydrophobicContact CD1-CE1 4.47Å; Y103-F168 HydrophobicContact CD2-CE1 4.34Å; Y103-F168 HydrophobicContact CD2-CZ 4.32Å; Y103-F168 HydrophobicContact CG-CD1 4.21Å; Y103-F168 AromaticContact CG-CE1 3.88Å; Y103-F168 HydrophobicContact CG-CE1 3.88Å; Y103-F168 HydrophobicContact CG-CZ 4.28Å; Y103-F168 CarbonylContact O-C 3.6Å; Y103-F168 VanDerWaalsContact O-CA 3.27Å; Y103-F168 WeakPolarHBondContact O-CA 3.48Å; Y105-F168 HydrophobicContact CD2-CD1 4.45Å; Y105-F168 HydrophobicContact CE2-CB 4.36Å; Y105-F168 AromaticContact CE2-CD1 3.55Å; Y105-F168 HydrophobicContact CE2-CD1 3.55Å; Y105-F168 HydrophobicContact CE2-CE1 4.28Å; Y105-F168 HydrophobicContact CE2-CG 4.31Å; A114-F168 HydrophobicContact CB-CD1 4.08Å; A114-F168 HydrophobicContact CB-CE1 4.02Å; L152-F168 HydrophobicContact CD1-CB 3.61Å; L152-F168 HydrophobicContact CD1-CG 4.29Å; L152-F168 HydrophobicContact CD2-CB 4.37Å; L152-F168 HydrophobicContact CG-CB 3.91Å
169	Y	97.7	Very high	95.4	Very high	7 Å²	7	57.3 Å²	57.3	3%	0.027	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	165.7	-179.1	-61.3	-82.7	0	0	0	111.2	I102 Y103 V104 Y105 L149 Y150 T151 V157 M162 V163 K164 H167	I102-Y169 HydrophobicContact CB-CD2 4.13Å; I102-Y169 HydrophobicContact CB-CE2 4.24Å; I102-Y169 HydrophobicContact CD1-CD2 4.45Å; I102-Y169 HydrophobicContact CG2-CD2 4.41Å; I102-Y169 HydrophobicContact CG2-CE2 4.04Å; Y103-Y169 PolarHBondContact O-N 3.42Å; V104-Y169 CarbonylContact C-O 3.46Å; V104-Y169 WeakPolarHBondContact CA-O 3.37Å; Y105-Y169 PolarHBondContact N-O 2.81Å; L149-Y169 HydrophobicContact CD1-CG 4.41Å; L149-Y169 HydrophobicContact CD2-CD1 4.23Å; L149-Y169 HydrophobicContact CD2-CG 4.27Å; L149-Y169 HydrophobicContact CG-CD1 4.26Å; L149-Y169 HydrophobicContact CG-CG 4.33Å; Y150-Y169 CarbonylContact O-C 3.49Å; Y150-Y169 VanDerWaalsContact O-CA 3.24Å; Y150-Y169 WeakPolarHBondContact O-CA 3.24Å; Y150-Y169 WeakPolarHBondContact O-CB 3.37Å; T151-Y169 HydrophobicContact CG2-CE1 4.32Å; V157-Y169 HydrophobicContact CG2-CD1 3.75Å; V157-Y169 HydrophobicContact CG2-CE1 3.77Å; M162-Y169 PolarHBondContact O-OH 3.3Å; V163-Y169 WeakPolarHBondContact CA-OH 3.44Å; V163-Y169 HydrophobicContact CG1-CE2 4.3Å; K164-Y169 PolarHBondContact N-OH 3.26Å; H167-Y169 HydrophobicContact CB-CE2 3.7Å
170	V	97.3	Very high	95.2	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	117.7	177.7	-175.4	0	0	0	0	109.3	Y105 N107 Y150 L152 F177 Y182	Y105-V170 CarbonylContact O-C 3.6Å; Y105-V170 WeakPolarHBondContact O-CA 3.47Å; N107-V170 HydrophobicContact CB-CG1 3.82Å; Y150-V170 PolarHBondContact N-O 3.22Å; Y150-V170 PolarHBondContact O-N 3.09Å; L152-V170 HydrophobicContact CD2-CG2 3.93Å; V170-F177 HydrophobicContact CB-CD2 4.43Å; V170-F177 HydrophobicContact CB-CE2 4.06Å; V170-F177 HydrophobicContact CG1-CD2 4.41Å; V170-F177 HydrophobicContact CG1-CE2 4.25Å; V170-F177 HydrophobicContact CG2-CE2 3.93Å; V170-Y182 HydrophobicContact CG1-CE1 4.1Å; V170-Y182 HydrophobicContact CG1-CE2 4.31Å; V170-Y182 HydrophobicContact CG2-CD2 3.92Å; V170-Y182 HydrophobicContact CG2-CE1 4.47Å; V170-Y182 HydrophobicContact CG2-CE2 3.8Å; V170-Y182 HydrophobicContact CG2-CG 4.32Å
171	A	97.5	Very high	95.1	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	129.7	175.2	0	0	0	0	0	110.4	V104 Y105 N107 I134 V138 L140 V146	V104-A171 HydrophobicContact CG1-CB 3.6Å; Y105-A171 PolarHBondContact O-N 3.45Å; N107-A171 VanDerWaalsContact CB-O 3.25Å; N107-A171 WeakPolarHBondContact CB-O 3.36Å; N107-A171 PolarHBondContact N-O 3.39Å; I134-A171 HydrophobicContact CG2-CB 4.11Å; V138-A171 HydrophobicContact CG1-CB 4.07Å; L140-A171 HydrophobicContact CD2-CB 4.41Å; V146-A171 HydrophobicContact CG1-CB 3.91Å; V146-A171 HydrophobicContact CG2-CB 4.34Å
172	A	96.4	Very high	95.1	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	150.2	176.5	0	0	0	0	0	110.8	N107 R147 R148 Y150 E175	N107-A172 HydrophobicContact CB-CB 3.82Å; R147-A172 PolarHBondContact N-O 2.71Å; R148-A172 HydrophobicContact CB-CB 4.37Å; R148-A172 PolarHBondContact N-O 3.28Å; R148-A172 PolarHBondContact O-N 3.36Å; Y150-A172 HydrophobicContact CD2-CB 4.1Å; Y150-A172 HydrophobicContact CE2-CB 3.84Å; A172-E175 HydrophobicContact CB-CG 4.48Å
173	G	95.3	Very high	94.8	Very high	1 Å²	1	59 Å²	59	1%	0.01	31%	0.308	C	S	.	.	S	Bend	trans	-80.3	-122.9	169.5	0	0	0	0	0	111	A145 R147 E175	A145-G173 WeakPolarHBondContact O-CA 3.46Å; R147-G173 WeakPolarHBondContact CB-O 3.44Å; G173-E175 WeakPolarHBondContact CA-OE2 3.47Å; G173-E175 VanDerWaalsContact N-CD 3.33Å; G173-E175 PolarHBondContact N-OE1 3.13Å
174	S	93.4	Very high	94.4	Very high	71 Å²	71	63.3 Å²	63.3	50%	0.497	33%	0.328	S	S	.	.	S	Bend	trans	-89	-12	179.4	-55.4	0	0	0	0	113.2	R147 R148	R147-S174 PolarHBondContact NH1-OG 3.44Å; R148-S174 PolarHBondContact NH1-O 3.11Å
175	E	93	Very high	93.9	Very high	49 Å²	49	62.4 Å²	62.4	23%	0.229	33%	0.334	C	S	.	.	S	Bend	trans	-67.9	165	178.7	64	-82	178.5	0	0	113.4	N107 K144 R148 A172 G173	N107-E175 WeakPolarHBondContact ND2-CG 3.46Å; K144-E175 IonicContact NZ-OE2 3.61Å; R148-E175 PolarHBondContact NH1-O 2.84Å; R148-E175 VanDerWaalsContact NH1-O 3.13Å; A172-E175 HydrophobicContact CB-CG 4.48Å; G173-E175 WeakPolarHBondContact CA-OE2 3.47Å; G173-E175 VanDerWaalsContact N-CD 3.33Å; G173-E175 PolarHBondContact N-OE1 3.13Å
176	T	94	Very high	93.3	Very high	103 Å²	103	65.1 Å²	65.1	63%	0.632	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-76.9	155.1	171.4	50.4	0	0	0	0	110.5	N107 L178	N107-T176 PolarHBondContact ND2-O 3.47Å; T176-L178 PolarHBondContact O-N 2.86Å
177	F	95.7	Very high	92.4	Very high	39 Å²	39	64.4 Å²	64.4	17%	0.171	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-59.5	129.1	172.7	174.5	-103.3	0	0	0	110.5	Y150 G154 V170 Y182	Y150-F177 HydrophobicContact CD1-CB 3.96Å; Y150-F177 HydrophobicContact CD1-CD2 4.34Å; Y150-F177 HydrophobicContact CD1-CG 4.31Å; Y150-F177 HydrophobicContact CD2-CB 4.04Å; Y150-F177 HydrophobicContact CD2-CD2 4.03Å; Y150-F177 HydrophobicContact CD2-CG 4.48Å; Y150-F177 HydrophobicContact CE1-CB 3.94Å; Y150-F177 HydrophobicContact CE2-CB 4.02Å; Y150-F177 HydrophobicContact CG-CB 3.99Å; Y150-F177 AromaticContact CG-CD2 3.75Å; Y150-F177 HydrophobicContact CG-CD2 3.75Å; Y150-F177 HydrophobicContact CG-CG 4.15Å; G154-F177 VanDerWaalsContact CA-CD1 3.47Å; V170-F177 HydrophobicContact CB-CD2 4.43Å; V170-F177 HydrophobicContact CB-CE2 4.06Å; V170-F177 HydrophobicContact CG1-CD2 4.41Å; V170-F177 HydrophobicContact CG1-CE2 4.25Å; V170-F177 HydrophobicContact CG2-CE2 3.93Å; F177-Y182 HydrophobicContact CE2-CE2 4.04Å; F177-Y182 HydrophobicContact CZ-CE2 4.14Å
178	L	95.2	Very high	91.5	Very high	72 Å²	72	71.7 Å²	71.7	38%	0.377	38%	0.377	S	S	.	.			trans	-98.6	109	173.7	-63.1	176.2	0	0	0	108.1	N107 T176 R180 Y182	N107-L178 WeakPolarHBondContact OD1-CB 3.4Å; N107-L178 PolarHBondContact OD1-N 2.95Å; T176-L178 PolarHBondContact O-N 2.86Å; L178-R180 HydrophobicContact CB-CG 4.34Å; L178-R180 PolarHBondContact O-N 3.27Å; L178-Y182 WeakPolarHBondContact O-CE2 3.5Å; L178-Y182 PolarHBondContact O-OH 2.71Å
179	S	93.9	Very high	90.4	Very high	100 Å²	100	74.7 Å²	74.7	70%	0.699	40%	0.397	S	S	*	.			trans	-68.3	116.6	173.8	-168.7	0	0	0	0	109.2
180	R	92.1	Very high	89.1	Confident	151 Å²	151	81.7 Å²	81.7	57%	0.57	43%	0.433	S	S	*	.			trans	-148.9	160.5	-178	-62.6	-69	-173.3	178.1	-0.4	109.3	T110 L178 Y182	T110-R180 HydrophobicContact CG2-CB 3.39Å; T110-R180 HydrophobicContact CG2-CG 3.9Å; L178-R180 HydrophobicContact CB-CG 4.34Å; L178-R180 PolarHBondContact O-N 3.27Å; R180-Y182 VanDerWaalsContact C-N 3.3Å; R180-Y182 HydrophobicContact CB-CD2 4.41Å; R180-Y182 HydrophobicContact CB-CE2 4.07Å; R180-Y182 WeakPolarHBondContact O-CD2 3.25Å; R180-Y182 PolarHBondContact O-N 2.88Å
181	D	91.6	Very high	87.5	Confident	118 Å²	118	86.9 Å²	86.9	63%	0.631	47%	0.465	S	S	*	.			trans	-75.9	86.6	169.2	-57.4	-45.5	0	0	0	109.1	T110 Q184	T110-D181 WeakPolarHBondContact CB-O 3.4Å; T110-D181 WeakPolarHBondContact CG2-O 3.21Å; D181-Q184 HydrophobicContact CB-CG 3.58Å; D181-Q184 WeakPolarHBondContact O-CG 3.47Å
182	Y	93.6	Very high	85.7	Confident	22 Å²	22	91 Å²	91	9%	0.086	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	138.1	177	-68.4	-76.7	0	0	0	111.1	Y105 R106 N107 G108 D109 L152 V170 F177 L178 R180	Y105-Y182 HydrophobicContact CD2-CG 4.31Å; Y105-Y182 HydrophobicContact CG-CD1 4.09Å; Y105-Y182 HydrophobicContact CG-CG 4.2Å; R106-Y182 WeakPolarHBondContact O-CE1 3Å; N107-Y182 PolarHBondContact OD1-OH 2.82Å; N107-Y182 VanDerWaalsContact OD1-OH 3.08Å; G108-Y182 PolarHBondContact N-OH 3.23Å; D109-Y182 WeakPolarHBondContact O-CD1 3.48Å; L152-Y182 HydrophobicContact CD2-CD2 4.11Å; L152-Y182 HydrophobicContact CD2-CG 4.38Å; V170-Y182 HydrophobicContact CG1-CE1 4.1Å; V170-Y182 HydrophobicContact CG1-CE2 4.31Å; V170-Y182 HydrophobicContact CG2-CD2 3.92Å; V170-Y182 HydrophobicContact CG2-CE1 4.47Å; V170-Y182 HydrophobicContact CG2-CE2 3.8Å; V170-Y182 HydrophobicContact CG2-CG 4.32Å; F177-Y182 HydrophobicContact CE2-CE2 4.04Å; F177-Y182 HydrophobicContact CZ-CE2 4.14Å; L178-Y182 WeakPolarHBondContact O-CE2 3.5Å; L178-Y182 PolarHBondContact O-OH 2.71Å; R180-Y182 VanDerWaalsContact C-N 3.3Å; R180-Y182 HydrophobicContact CB-CD2 4.41Å; R180-Y182 HydrophobicContact CB-CE2 4.07Å; R180-Y182 WeakPolarHBondContact O-CD2 3.25Å; R180-Y182 PolarHBondContact O-N 2.88Å
183	G	89	Confident	83.9	Confident	34 Å²	34	96.1 Å²	96.1	35%	0.351	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	21.2	178.7	0	0	0	0	0	114.3	T110	T110-G183 PolarHBondContact O-N 2.94Å
184	Q	87.5	Confident	82.1	Confident	92 Å²	92	107 Å²	107	43%	0.43	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-66.7	140.1	173.5	-71.3	-69.5	-41.5	0	0	110.1	T110 F111 D181	T110-Q184 PolarHBondContact O-N 2.87Å; F111-Q184 HydrophobicContact CD1-CB 4.33Å; F111-Q184 HydrophobicContact CE1-CB 4.47Å; D181-Q184 HydrophobicContact CB-CG 3.58Å; D181-Q184 WeakPolarHBondContact O-CG 3.47Å
185	P	84	Confident	80.3	Confident	103 Å²	103	112.6 Å²	112.6	67%	0.669	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-60.2	143.8	172	26.6	-32.8	0	0	0	109.5
186	L	81.2	Confident	78.5	Confident	129 Å²	129	115.7 Å²	115.7	68%	0.675	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-54.6	133.7	172.5	-77.9	164.9	0	0	0	109.2	F111 R188	F111-L186 HydrophobicContact CB-CD2 3.62Å; F111-L186 HydrophobicContact CB-CG 4.34Å; F111-L186 HydrophobicContact CG-CD2 4.18Å; L186-R188 PolarHBondContact O-N 3.17Å; L186-R188 VanDerWaalsContact O-N 3.12Å
187	P	78.2	Confident	76.7	Confident	93 Å²	93	116.4 Å²	116.4	60%	0.604	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-53.3	124.9	173.1	-23.5	32.6	0	0	0	108.5	F111 L189	F111-P187 HydrophobicContact CE1-CG 3.89Å; F111-P187 HydrophobicContact CZ-CG 4.27Å; P187-L189 PolarHBondContact O-N 2.84Å; P187-L189 VanDerWaalsContact O-N 3.08Å
188	R	77.7	Confident	74.7	Confident	234 Å²	234	121.2 Å²	121.2	88%	0.883	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-60.9	119.2	172.3	-68.2	-176.1	-179.3	-177.4	0.5	106.5	L186 I190	L186-R188 PolarHBondContact O-N 3.17Å; L186-R188 VanDerWaalsContact O-N 3.12Å; R188-I190 PolarHBondContact O-N 3.4Å
189	L	74.7	Confident	72.8	Confident	151 Å²	151	125.2 Å²	125.2	79%	0.791	66%	0.663	S	S	*	*			trans	-58.3	113.2	171.2	-172.6	71.7	0	0	0	106.5	P187 T191	P187-L189 PolarHBondContact O-N 2.84Å; P187-L189 VanDerWaalsContact O-N 3.08Å; L189-T191 HydrophobicContact CD2-CG2 4.1Å; L189-T191 HydrophobicContact CG-CG2 4.45Å; L189-T191 PolarHBondContact O-N 2.81Å
190	I	70.4	Confident	70.5	Confident	153 Å²	153	127.8 Å²	127.8	79%	0.785	66%	0.658	S	S	*	*			trans	-69.1	87.3	165.5	-56.1	174.4	0	0	0	104	R188 A192	R188-I190 PolarHBondContact O-N 3.4Å; I190-A192 PolarHBondContact O-N 3.38Å
191	T	64	Low	68.8	Low	110 Å²	110	124.7 Å²	124.7	68%	0.675	66%	0.664	S	S	*	*			trans	-56.6	115.2	159.7	52.6	0	0	0	0	104	L189 S193	L189-T191 HydrophobicContact CD2-CG2 4.1Å; L189-T191 HydrophobicContact CG-CG2 4.45Å; L189-T191 PolarHBondContact O-N 2.81Å; T191-S193 PolarHBondContact O-N 3.32Å
192	A	59.7	Low	67.1	Low	87 Å²	87	126.9 Å²	126.9	72%	0.719	68%	0.676	S	S	*	*			trans	-44.6	124.3	-177.3	0	0	0	0	0	107.5	I190 R194	I190-A192 PolarHBondContact O-N 3.38Å; A192-R194 PolarHBondContact O-N 2.98Å
193	S	57.9	Low	65.4	Low	107 Å²	107	130.1 Å²	130.1	75%	0.748	70%	0.698	S	S	*	*			trans	-35.3	119.1	170.7	175.8	0	0	0	0	107.4	T191 K195	T191-S193 PolarHBondContact O-N 3.32Å; S193-K195 PolarHBondContact O-N 2.84Å
194	R	56.5	Low	63.5	Low	230 Å²	230	137.7 Å²	137.7	87%	0.868	72%	0.724	S	S	*	*			trans	-44	113.5	176.9	-77.2	174.7	73.2	167.8	2.4	105.4	A192 P196	A192-R194 PolarHBondContact O-N 2.98Å; R194-P196 VanDerWaalsContact O-N 3.17Å
195	K	56.5	Low	61.9	Low	188 Å²	188	141.1 Å²	141.1	82%	0.817	74%	0.738	S	S	*	*			trans	-48.9	130.2	176.9	-70.8	-177.4	-180	-179.9	0	106	S193 T197	S193-K195 PolarHBondContact O-N 2.84Å; K195-T197 PolarHBondContact O-N 2.78Å
196	P	54.6	Low	60.5	Low	113 Å²	113	142.4 Å²	142.4	73%	0.734	74%	0.738	S	S	*	*			trans	-55.9	118.8	179.8	21.8	-30.1	0	0	0	107.1	R194 H198	R194-P196 VanDerWaalsContact O-N 3.17Å; P196-H198 PolarHBondContact O-N 3.02Å
197	T	56.7	Low	59.1	Low	119 Å²	119	143.5 Å²	143.5	73%	0.73	74%	0.744	S	S	*	*			trans	-54.5	108.9	167.5	36.9	0	0	0	0	106.5	K195 I199	K195-T197 PolarHBondContact O-N 2.78Å; T197-I199 PolarHBondContact O-N 3.4Å
198	H	53.5	Low	57.9	Low	140 Å²	140	144.9 Å²	144.9	65%	0.648	75%	0.747	S	S	*	*			trans	-63.6	104.3	170.9	-121.2	-97.3	0	0	0	106.7	P196 Y200	P196-H198 PolarHBondContact O-N 3.02Å; H198-Y200 VanDerWaalsContact C-N 3.31Å; H198-Y200 HydrophobicContact CB-CD2 3.96Å; H198-Y200 HydrophobicContact CB-CE2 3.73Å; H198-Y200 AromaticContact CE1-CZ 3.99Å; H198-Y200 AromaticContact CG-CE2 3.72Å; H198-Y200 AromaticContact ND1-CD2 3.9Å; H198-Y200 AromaticContact ND1-CE2 3.2Å; H198-Y200 WeakPolarHBondContact ND1-CE2 3.4Å; H198-Y200 AromaticContact ND1-CZ 3.39Å; H198-Y200 PolarHBondContact ND1-OH 2.91Å; H198-Y200 PolarHBondContact O-N 3.47Å; H198-Y200 VanDerWaalsContact O-N 3.07Å
199	I	55.2	Low	56.8	Low	156 Å²	156	140.3 Å²	140.3	80%	0.8	74%	0.738	S	S	*	*			trans	-76.3	91.7	169.8	-56.8	173.5	0	0	0	105.4	T197 A201	T197-I199 PolarHBondContact O-N 3.4Å; I199-A201 PolarHBondContact O-N 3.17Å
200	Y	46.4	Very low	55.6	Low	153 Å²	153	138.1 Å²	138.1	60%	0.6	73%	0.733	S	S	*	*			trans	-77.7	116.4	160.6	-75.9	-85.2	0	0	0	106.8	H198 N202	H198-Y200 VanDerWaalsContact C-N 3.31Å; H198-Y200 HydrophobicContact CB-CD2 3.96Å; H198-Y200 HydrophobicContact CB-CE2 3.73Å; H198-Y200 AromaticContact CE1-CZ 3.99Å; H198-Y200 AromaticContact CG-CE2 3.72Å; H198-Y200 AromaticContact ND1-CD2 3.9Å; H198-Y200 AromaticContact ND1-CE2 3.2Å; H198-Y200 WeakPolarHBondContact ND1-CE2 3.4Å; H198-Y200 AromaticContact ND1-CZ 3.39Å; H198-Y200 PolarHBondContact ND1-OH 2.91Å; H198-Y200 PolarHBondContact O-N 3.47Å; H198-Y200 VanDerWaalsContact O-N 3.07Å; Y200-N202 PolarHBondContact O-N 3.45Å; Y200-N202 VanDerWaalsContact O-N 3.12Å
201	A	55.5	Low	54.8	Low	86 Å²	86	138.1 Å²	138.1	71%	0.711	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.9	121.9	169.9	0	0	0	0	0	108.9	I199	I199-A201 PolarHBondContact O-N 3.17Å
202	N	55.1	Low	54	Low	165 Å²	165	140.9 Å²	140.9	88%	0.882	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	86.4	23.4	170.3	-50.1	-29.5	0	0	0	119.9	Y200	Y200-N202 PolarHBondContact O-N 3.45Å; Y200-N202 VanDerWaalsContact O-N 3.12Å
203	V	58.3	Low	53.5	Low	90 Å²	90	143 Å²	143	55%	0.545	75%	0.748	S	S	.	*			trans	-134.2	114.7	164.9	-167.2	0	0	0	0	111.6	F205	V203-F205 HydrophobicContact CB-CD2 4.49Å; V203-F205 HydrophobicContact CB-CE2 4.06Å; V203-F205 HydrophobicContact CG1-CD2 4.16Å; V203-F205 HydrophobicContact CG1-CE2 3.77Å; V203-F205 HydrophobicContact CG1-CZ 4Å; V203-F205 PolarHBondContact O-N 3.3Å
204	H	50.3	Low	52.9	Low	193 Å²	193	147.9 Å²	147.9	89%	0.894	75%	0.752	S	S	*	*			trans	-76.1	111	166.1	-81.7	-97.8	0	0	0	108.7
205	F	52.7	Low	52.7	Low	163 Å²	163	143.7 Å²	143.7	72%	0.715	75%	0.752	S	S	*	*			trans	-89	117.9	162.2	-71.2	-84.6	0	0	0	108.3	V203 N207	V203-F205 HydrophobicContact CB-CD2 4.49Å; V203-F205 HydrophobicContact CB-CE2 4.06Å; V203-F205 HydrophobicContact CG1-CD2 4.16Å; V203-F205 HydrophobicContact CG1-CE2 3.77Å; V203-F205 HydrophobicContact CG1-CZ 4Å; V203-F205 PolarHBondContact O-N 3.3Å; F205-N207 PolarHBondContact O-N 2.79Å
206	I	56.1	Low	52.3	Low	130 Å²	130	143.3 Å²	143.3	67%	0.667	75%	0.753	S	S	*	*			trans	-73.2	122.5	161.1	-49.3	175.2	0	0	0	104.8	D208	I206-D208 WeakPolarHBondContact CB-OD2 3.32Å; I206-D208 WeakPolarHBondContact CG2-OD2 3.21Å; I206-D208 PolarHBondContact O-N 3.41Å
207	N	51.8	Low	51.9	Low	152 Å²	152	150 Å²	150	81%	0.813	76%	0.763	S	S	*	*			trans	-71.9	67.4	167	-70.5	-36.7	0	0	0	107.8	F205 I209	F205-N207 PolarHBondContact O-N 2.79Å; N207-I209 VanDerWaalsContact C-N 3.33Å; N207-I209 PolarHBondContact O-N 3.39Å; N207-I209 VanDerWaalsContact O-N 3.13Å
208	D	51.5	Low	51.3	Low	123 Å²	123	148 Å²	148	66%	0.658	77%	0.766	S	S	*	*			trans	-75.6	94.1	164	-76	-52.1	0	0	0	106.2	I206 P210	I206-D208 WeakPolarHBondContact CB-OD2 3.32Å; I206-D208 WeakPolarHBondContact CG2-OD2 3.21Å; I206-D208 PolarHBondContact O-N 3.41Å; D208-P210 WeakPolarHBondContact O-CD 3.32Å
209	I	55.9	Low	51.1	Low	137 Å²	137	149.7 Å²	149.7	70%	0.703	77%	0.774	S	S	*	*			trans	-70.6	117.6	159.2	-60.5	172.3	0	0	0	104.5	N207 D211	N207-I209 VanDerWaalsContact C-N 3.33Å; N207-I209 PolarHBondContact O-N 3.39Å; N207-I209 VanDerWaalsContact O-N 3.13Å; I209-D211 PolarHBondContact O-N 3.49Å; I209-D211 VanDerWaalsContact O-N 3.09Å
210	P	49.7	Very low	50.7	Low	106 Å²	106	151.2 Å²	151.2	69%	0.688	78%	0.778	S	S	*	*			trans	-66.5	114.7	169.3	4.1	8.3	0	0	0	107.1	D208 E212	D208-P210 WeakPolarHBondContact O-CD 3.32Å; P210-E212 PolarHBondContact O-N 3.19Å
211	D	53	Low	51.1	Low	153 Å²	153	150.9 Å²	150.9	82%	0.818	78%	0.781	S	S	*	*			trans	-67.5	71.7	164.3	-81.8	-38.3	0	0	0	108.9	I209	I209-D211 PolarHBondContact O-N 3.49Å; I209-D211 VanDerWaalsContact O-N 3.09Å
212	E	47.8	Very low	51.1	Low	167 Å²	167	157.7 Å²	157.7	78%	0.78	79%	0.79	S	S	*	*			trans	-117.9	78.1	167	-79.7	-157.2	153.6	0	0	110.1	P210	P210-E212 PolarHBondContact O-N 3.19Å
213	C	48.5	Very low	51.4	Low	132 Å²	132	159.6 Å²	159.6	89%	0.892	79%	0.787	S	S	*	*			trans	-114.9	61.7	155.5	-68.3	0	0	0	0	108.7
214	Y	45.3	Very low	51.4	Low	210 Å²	210	163.7 Å²	163.7	82%	0.824	80%	0.799	S	S	*	*			trans	-89.2	105.8	163	-86.5	-83.4	0	0	0	109
215	T	51.7	Low	52	Low	141 Å²	141	165.5 Å²	165.5	87%	0.865	82%	0.816	S	S	*	*			trans	-122	123	150	49.1	0	0	0	0	109.3
216	H	49.2	Very low	51.9	Low	181 Å²	181	165.7 Å²	165.7	84%	0.838	82%	0.821	S	S	*	*			trans	-42	139.2	-174.7	-78.1	2.4	0	0	0	117.2
217	R	45.7	Very low	51.7	Low	253 Å²	253	167.5 Å²	167.5	96%	0.955	83%	0.829	S	S	*	*				-172.3	126.2	121.7	-113.7	174.1	174.5	177.4	-1.4	113.6
218	G	43.9	Very low	51.7	Low	77 Å²	77	168.4 Å²	168.4	79%	0.794	83%	0.83	S	S	*	*			trans	106	82.1	142.5	0	0	0	0	0	117.1
219	Q	49.1	Very low	51.7	Low	175 Å²	175	171.1 Å²	171.1	82%	0.818	84%	0.84	S	S	*	*			trans	-59.5	146.5	157.4	-66.6	176.7	-29.6	0	0	110.6
220	H	48.3	Very low	51.5	Low	189 Å²	189	173.2 Å²	173.2	88%	0.875	85%	0.848	S	S	*	*				-165.4	134.3	129.9	-116.8	-115.8	0	0	0	111.5
221	H	54.2	Low	51.6	Low	146 Å²	146	177.7 Å²	177.7	68%	0.676	86%	0.859	S	S	*	*			trans	-63.1	150.3	-168.8	-68.1	175.8	0	0	0	116.4
222	Y	54.9	Low	51.5	Low	228 Å²	228	179.4 Å²	179.4	89%	0.894	86%	0.862	S	S	*	*			trans	-117.2	120.9	147.9	-90.8	-91.3	0	0	0	108.5
223	Y	61.3	Low	51.8	Low	206 Å²	206	180.4 Å²	180.4	81%	0.808	87%	0.868	S	S	*	*			trans	-82.7	136.1	164.5	-97.8	-97.2	0	0	0	108.8
224	H	59.4	Low	52.1	Low	175 Å²	175	184.4 Å²	184.4	81%	0.81	87%	0.866	S	S	*	*			trans	-102.8	129.5	163.9	-111.7	78	0	0	0	107.8
225	D	61.8	Low	52.7	Low	232 Å²	232	182.1 Å²	182.1	100%	1.241	87%	0.87	S	S	*	*			trans	-139.1	0	141.8	-110	-65.1	0	0	0	105.9

Retrieved 225 of 225 residues in 400.8 ms (Link to these results)

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