A0A096LWV6_POEFO Loading...

N(6)-L-threonylcarbamoyladenine synthase

Required for the formation of a threonylcarbamoyl group on adenosine at position 37 (t(6)A37) in mitochondrial tRNAs that read codons beginning with adenine. Probably involved in the transfer of the threonylcarbamoyl moiety of threonylcarbamoyl-AMP (TC-AMP) to the N6 group of A37. Involved in mitochondrial genome maintenance.

AlphaFold DB , UniProt , Accession A0A096LWV6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 432 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure 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	36.8	Very low	37.4	Very low	257 Å²	257	130.9 Å²	130.9	100%	1.266	70%	0.702	S	S	*	*				0	114.1	0	-73.7	175.9	-174.3	0	0	107.5
2	A	32.8	Very low	38	Very low	86 Å²	86	136.6 Å²	136.6	71%	0.711	71%	0.707	S	S	*	*			trans	-108.1	157.4	-176.3	0	0	0	0	0	110.4
3	F	27.3	Very low	38.6	Very low	168 Å²	168	133.8 Å²	133.8	74%	0.737	69%	0.692	S	S	*	*			trans	80.2	138.3	-179.9	-68.9	-90.1	0	0	0	116.2	M6	F3-M6 HydrophobicContact CE1-CB 4.24Å; F3-M6 HydrophobicContact CE1-SD 4.32Å
4	P	39.6	Very low	38.5	Very low	100 Å²	100	132.1 Å²	132.1	65%	0.649	68%	0.684	S	S	*	*			cis	-138.1	120.5	26.3	35.4	-13.7	0	0	0	116.1
5	T	39.6	Very low	38.6	Very low	139 Å²	139	130.9 Å²	130.9	85%	0.853	68%	0.678	S	S	*	*	S	Bend	trans	-121	1.3	163.1	45.6	0	0	0	0	113.1
6	M	33.3	Very low	38.8	Very low	114 Å²	114	135.4 Å²	135.4	56%	0.562	68%	0.683	S	S	*	*	S	Bend	trans	-91.3	-8.3	-173.7	-131.3	-172.7	-155.2	0	0	114.9	F3 S9	F3-M6 HydrophobicContact CE1-CB 4.24Å; F3-M6 HydrophobicContact CE1-SD 4.32Å; M6-S9 PolarHBondContact O-OG 3.44Å
7	I	38	Very low	38.6	Very low	122 Å²	122	133.7 Å²	133.7	63%	0.626	68%	0.676	S	S	*	*	H	α-helix	trans	-88	-30.5	-174.8	-62.1	175.4	0	0	0	111.5	S9	I7-S9 PolarHBondContact O-N 2.94Å
8	Q	38.9	Very low	38.3	Very low	171 Å²	171	132.7 Å²	132.7	80%	0.799	67%	0.672	S	S	*	*	H	α-helix	trans	-74.8	-23.1	179	-72	-170.6	-15.7	0	0	113.9
9	S	41.1	Very low	38.1	Very low	57 Å²	57	137.2 Å²	137.2	40%	0.399	68%	0.68	S	S	.	*	H	α-helix	trans	-78.6	-35	177.6	61.5	0	0	0	0	113	M6 I7 R12 I13	M6-S9 PolarHBondContact O-OG 3.44Å; I7-S9 PolarHBondContact O-N 2.94Å; S9-R12 PolarHBondContact O-N 3.37Å; S9-I13 WeakPolarHBondContact O-CG1 3.26Å; S9-I13 PolarHBondContact O-N 3.49Å
10	K	39.5	Very low	37.9	Very low	142 Å²	142	135.5 Å²	135.5	62%	0.617	68%	0.681	S	S	*	*	H	α-helix	trans	-72.3	-33.7	179.9	-71.8	-174.2	175.7	-176.6	0	113.1	I13 L14	K10-I13 PolarHBondContact O-N 2.82Å; K10-L14 PolarHBondContact O-N 2.74Å
11	V	45.1	Very low	37.6	Very low	84 Å²	84	137.8 Å²	137.8	51%	0.509	69%	0.686	S	S	.	*	H	α-helix	trans	-67.1	-35.7	176.5	177.3	0	0	0	0	111.6	L14 L15	V11-L14 PolarHBondContact O-N 3.06Å; V11-L15 HydrophobicContact CG1-CD1 4.12Å; V11-L15 PolarHBondContact O-N 3.36Å; V11-L15 VanDerWaalsContact O-N 3.15Å
12	R	44.7	Very low	37.6	Very low	199 Å²	199	133.9 Å²	133.9	75%	0.751	67%	0.665	S	S	*	*	H	α-helix	trans	-68.1	-33.4	173.6	-81.8	-178.1	166.5	-173.5	-3.4	113.4	S9 R16	S9-R12 PolarHBondContact O-N 3.37Å; R12-R16 PolarHBondContact O-N 3.37Å
13	I	45.6	Very low	37.9	Very low	100 Å²	100	134.6 Å²	134.6	51%	0.513	66%	0.661	S	S	.	*	H	α-helix	trans	-73.2	-38.9	177.3	-68.7	164.2	0	0	0	111	S9 K10 R16 L17	S9-I13 WeakPolarHBondContact O-CG1 3.26Å; S9-I13 PolarHBondContact O-N 3.49Å; K10-I13 PolarHBondContact O-N 2.82Å; I13-R16 PolarHBondContact O-N 3.01Å; I13-L17 HydrophobicContact CG2-CD1 4.11Å; I13-L17 PolarHBondContact O-N 3.11Å; I13-L17 VanDerWaalsContact O-N 3.08Å
14	L	36.9	Very low	38.3	Very low	111 Å²	111	131.8 Å²	131.8	58%	0.581	67%	0.669	S	S	*	*	H	α-helix	trans	-68.5	-38.3	178.6	-143.4	78.6	0	0	0	112.1	K10 V11 L17 L18	K10-L14 PolarHBondContact O-N 2.74Å; V11-L14 PolarHBondContact O-N 3.06Å; L14-L17 PolarHBondContact O-N 3.5Å; L14-L18 PolarHBondContact O-N 2.86Å
15	L	40.1	Very low	37.9	Very low	114 Å²	114	129.6 Å²	129.6	60%	0.597	66%	0.664	S	S	*	*	H	α-helix	trans	-66.8	-33.4	173.5	-77.6	161.8	0	0	0	112.7	V11 W19	V11-L15 HydrophobicContact CG1-CD1 4.12Å; V11-L15 PolarHBondContact O-N 3.36Å; V11-L15 VanDerWaalsContact O-N 3.15Å; L15-W19 PolarHBondContact O-N 2.88Å; L15-W19 VanDerWaalsContact O-N 3.14Å
16	R	42.4	Very low	38	Very low	203 Å²	203	129 Å²	129	77%	0.766	67%	0.666	S	S	*	*	H	α-helix	trans	-66	-38.3	171.4	-83.9	-178.2	172.6	-166.1	-3.1	112.7	R12 I13 C20	R12-R16 PolarHBondContact O-N 3.37Å; I13-R16 PolarHBondContact O-N 3.01Å; R16-C20 WeakPolarHBondContact O-CB 3.32Å; R16-C20 PolarHBondContact O-N 3.4Å
17	L	34.8	Very low	38.2	Very low	106 Å²	106	131.8 Å²	131.8	56%	0.555	68%	0.675	S	S	*	*	H	α-helix	trans	-72.7	-31.1	178.6	-77.9	160.9	0	0	0	112.8	I13 L14	I13-L17 HydrophobicContact CG2-CD1 4.11Å; I13-L17 PolarHBondContact O-N 3.11Å; I13-L17 VanDerWaalsContact O-N 3.08Å; L14-L17 PolarHBondContact O-N 3.5Å
18	L	32.4	Very low	38.3	Very low	116 Å²	116	130.1 Å²	130.1	61%	0.607	68%	0.679	S	S	*	*	H	α-helix	trans	-76	-33.6	176.1	-84.1	150.1	0	0	0	112.8	L14 C20	L14-L18 PolarHBondContact O-N 2.86Å; L18-C20 VanDerWaalsContact C-N 3.32Å
19	W	35.9	Very low	38.5	Very low	217 Å²	217	130.8 Å²	130.8	82%	0.822	68%	0.68	S	S	*	*	H	α-helix	trans	-67.9	-32.8	171.4	-159.4	-62.2	0	0	0	112.2	L15 K21	L15-W19 PolarHBondContact O-N 2.88Å; L15-W19 VanDerWaalsContact O-N 3.14Å; W19-K21 VanDerWaalsContact C-N 3.29Å; W19-K21 PolarHBondContact O-N 3.2Å
20	C	33.5	Very low	39.2	Very low	103 Å²	103	138.4 Å²	138.4	70%	0.696	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-15.1	-176.7	-141.3	0	0	0	0	114	R16 L18	R16-C20 WeakPolarHBondContact O-CB 3.32Å; R16-C20 PolarHBondContact O-N 3.4Å; L18-C20 VanDerWaalsContact C-N 3.32Å
21	K	31.9	Very low	40.3	Very low	184 Å²	184	134.6 Å²	134.6	80%	0.8	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-3.9	-176.3	-82.9	-170.5	173.9	-174.6	0	115.9	W19	W19-K21 VanDerWaalsContact C-N 3.29Å; W19-K21 PolarHBondContact O-N 3.2Å
22	Q	36.4	Very low	42.3	Very low	175 Å²	175	136 Å²	136	82%	0.818	69%	0.687	S	S	*	*	S	Bend	trans	-104.8	12.2	-176.8	-102.4	178.8	-7.9	0	0	115.9
23	T	38.4	Very low	44.8	Very low	101 Å²	101	127 Å²	127	62%	0.62	65%	0.654	S	S	*	*			trans	-136.3	44.1	173.6	53.5	0	0	0	0	113	G25	T23-G25 PolarHBondContact O-N 3.38Å; T23-G25 VanDerWaalsContact O-N 3.11Å
24	A	37.3	Very low	47.3	Very low	110 Å²	110	122.2 Å²	122.2	91%	0.909	63%	0.629	S	S	*	*			trans	-82.7	70.9	160.7	0	0	0	0	0	109
25	G	30.8	Very low	50.3	Low	53 Å²	53	117 Å²	117	55%	0.546	60%	0.602	S	S	.	*	S	Bend	trans	-152.5	119.4	175.6	0	0	0	0	0	108.1	T23 K27	T23-G25 PolarHBondContact O-N 3.38Å; T23-G25 VanDerWaalsContact O-N 3.11Å; G25-K27 PolarHBondContact O-N 2.62Å
26	S	41	Very low	53.1	Low	128 Å²	128	111.5 Å²	111.5	90%	0.895	57%	0.573	S	S	*	*			trans	-29.3	102.9	-176.7	57	0	0	0	0	114.5
27	K	37.5	Very low	55.8	Low	172 Å²	172	102 Å²	102	75%	0.748	54%	0.537	S	S	*	.			trans	-110.2	109.4	160.3	-86.3	179.9	177.9	173.6	0	107.2	G25 F29	G25-K27 PolarHBondContact O-N 2.62Å; K27-F29 PolarHBondContact O-N 3.28Å
28	A	40.4	Very low	58.8	Low	86 Å²	86	96.9 Å²	96.9	71%	0.711	51%	0.511	S	S	*	.			trans	-41.1	134.9	154.4	0	0	0	0	0	108.2	R30	A28-R30 VanDerWaalsContact C-N 3.28Å; A28-R30 PolarHBondContact O-N 3.43Å
29	F	41.8	Very low	62	Low	186 Å²	186	91.4 Å²	91.4	82%	0.816	48%	0.482	S	S	*	.			trans	-50	96.2	173	-113.8	-100.1	0	0	0	107.7	K27 S31 E51	K27-F29 PolarHBondContact O-N 3.28Å; F29-S31 VanDerWaalsContact C-N 3.34Å; F29-S31 PolarHBondContact O-N 3.31Å; F29-E51 VanDerWaalsContact CD1-OE1 3.31Å; F29-E51 WeakPolarHBondContact CD1-OE1 3.44Å; F29-E51 WeakPolarHBondContact CE1-OE1 3.4Å
30	R	55.9	Low	64.9	Low	216 Å²	216	81.2 Å²	81.2	82%	0.815	44%	0.444	S	S	*	.			trans	-72.8	102.4	169.3	-79.7	-170	177.3	-170.1	-1.1	103.8	A28 R32	A28-R30 VanDerWaalsContact C-N 3.28Å; A28-R30 PolarHBondContact O-N 3.43Å; R30-R32 PolarHBondContact O-N 3.02Å; R30-R32 VanDerWaalsContact O-N 3.14Å
31	S	62.4	Low	67.8	Low	62 Å²	62	77.8 Å²	77.8	43%	0.434	42%	0.421	S	S	.	.			trans	-43.3	121.3	173.7	55.1	0	0	0	0	109	F29 L33	F29-S31 VanDerWaalsContact C-N 3.34Å; F29-S31 PolarHBondContact O-N 3.31Å; S31-L33 VanDerWaalsContact C-N 3.29Å; S31-L33 PolarHBondContact O-N 3.1Å
32	R	88.1	Confident	70.7	Confident	114 Å²	114	70.5 Å²	70.5	43%	0.43	39%	0.391	S	S	.	.			trans	-78.6	81.9	-179.1	-63.5	-179.5	-178.5	-169.2	2.1	110	R30 E51 A105 L387	R30-R32 PolarHBondContact O-N 3.02Å; R30-R32 VanDerWaalsContact O-N 3.14Å; R32-E51 HydrophobicContact CB-CB 4.3Å; R32-E51 PolarHBondContact N-OE2 3.19Å; R32-E51 VanDerWaalsContact N-OE2 3.1Å; R32-A105 HydrophobicContact CB-CB 4.27Å; R32-L387 HydrophobicContact CB-CD1 4.28Å; R32-L387 PolarHBondContact NH1-O 3.08Å
33	L	97.6	Very high	73.5	Confident	10 Å²	10	63.1 Å²	63.1	5%	0.052	36%	0.356	C	S	.	.			trans	-77.6	130.9	178.6	-56.9	-179.8	0	0	0	110.7	S31 M49 D50 L56 V99 Q103 L104 A105	S31-L33 VanDerWaalsContact C-N 3.29Å; S31-L33 PolarHBondContact O-N 3.1Å; L33-M49 CarbonylContact C-O 3.02Å; L33-M49 WeakPolarHBondContact CA-O 3.48Å; L33-D50 HydrophobicContact CD2-CB 3.74Å; L33-L56 HydrophobicContact CD2-CD1 3.57Å; L33-V99 HydrophobicContact CD1-CB 4.42Å; L33-V99 HydrophobicContact CD1-CG1 3.62Å; L33-V99 HydrophobicContact CD1-CG2 3.81Å; L33-Q103 HydrophobicContact CD1-CB 4.43Å; L33-L104 HydrophobicContact CB-CD2 4.26Å; L33-A105 WeakPolarHBondContact O-CB 3.36Å; L33-A105 PolarHBondContact O-N 3.11Å
34	V	98.4	Very high	76.4	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	131	178.7	179.3	0	0	0	0	109.8	V48 M49 A108 V384 L387	V34-V48 WeakPolarHBondContact O-CA 3.19Å; V34-M49 PolarHBondContact N-O 3.28Å; V34-M49 PolarHBondContact O-N 3.19Å; V34-A108 HydrophobicContact CG1-CB 3.88Å; V34-V384 HydrophobicContact CB-CG2 3.9Å; V34-V384 HydrophobicContact CG2-CG2 3.64Å; V34-L387 HydrophobicContact CG2-CD1 3.38Å; V34-L387 HydrophobicContact CG2-CG 4.29Å
35	L	98.8	Very high	79.3	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	118	165.2	172.6	64.3	0	0	0	108.7	I37 A46 A47 V48 V90 L104 A106 V107 A108 F129	L35-I37 HydrophobicContact CD2-CD1 4.21Å; L35-I37 HydrophobicContact CG-CD1 4.41Å; L35-I37 HydrophobicContact CG-CG1 4.2Å; L35-A46 HydrophobicContact CD1-CB 4.44Å; L35-A47 CarbonylContact C-O 3.03Å; L35-A47 WeakPolarHBondContact CA-O 3.49Å; L35-V48 HydrophobicContact CD1-CG2 3.95Å; L35-V90 HydrophobicContact CD2-CG1 3.93Å; L35-L104 HydrophobicContact CB-CD1 3.84Å; L35-L104 HydrophobicContact CB-CD2 4.05Å; L35-L104 HydrophobicContact CD2-CD1 4.21Å; L35-A106 PolarHBondContact N-O 3.36Å; L35-V107 HydrophobicContact CB-CG1 4.49Å; L35-V107 HydrophobicContact CB-CG2 4.37Å; L35-V107 HydrophobicContact CD2-CG1 4.25Å; L35-V107 HydrophobicContact CD2-CG2 4.35Å; L35-V107 HydrophobicContact CG-CG1 4.38Å; L35-V107 CarbonylContact O-C 3.58Å; L35-V107 WeakPolarHBondContact O-CA 3.31Å; L35-A108 PolarHBondContact O-N 3.31Å; L35-F129 HydrophobicContact CD2-CE1 3.96Å; L35-F129 HydrophobicContact CD2-CZ 3.96Å
36	G	98.8	Very high	82.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	137.1	172.4	0	0	0	0	0	111.8	A46 A47 A108	G36-A46 CarbonylContact O-C 3.54Å; G36-A46 WeakPolarHBondContact O-CA 3.47Å; G36-A47 PolarHBondContact N-O 3.4Å; G36-A47 PolarHBondContact O-N 2.96Å; G36-A108 CarbonylContact C-O 3.54Å; G36-A108 VanDerWaalsContact CA-O 3.28Å; G36-A108 WeakPolarHBondContact CA-O 3.46Å
37	I	98.9	Very high	85.3	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	123.8	179.8	-57.8	174.2	0	0	0	110.2	L35 T39 G45 I86 V90 V107 A108 A109 T110 F125 S126	L35-I37 HydrophobicContact CD2-CD1 4.21Å; L35-I37 HydrophobicContact CG-CD1 4.41Å; L35-I37 HydrophobicContact CG-CG1 4.2Å; I37-T39 HydrophobicContact CG2-CG2 4.43Å; I37-G45 WeakPolarHBondContact CA-O 3.41Å; I37-I86 HydrophobicContact CG2-CD1 4.32Å; I37-V90 HydrophobicContact CD1-CG2 4.02Å; I37-V90 HydrophobicContact CG1-CG2 4.12Å; I37-V107 HydrophobicContact CD1-CG1 3.94Å; I37-A108 PolarHBondContact N-O 3.44Å; I37-A109 HydrophobicContact CB-CB 4.13Å; I37-A109 WeakPolarHBondContact O-CA 3.46Å; I37-T110 PolarHBondContact O-N 3.21Å; I37-F125 HydrophobicContact CD1-CD1 4.01Å; I37-F125 HydrophobicContact CD1-CE1 3.95Å; I37-S126 WeakPolarHBondContact CD1-OG 3.38Å
38	E	98.8	Very high	88.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	122.6	-177.4	179.1	50.9	-111.3	0	0	110.6	S40 E43 G45 T110 H142 D374 M378 V379	E38-S40 WeakPolarHBondContact OE1-CA 3.47Å; E38-S40 WeakPolarHBondContact OE1-CB 3.35Å; E38-S40 PolarHBondContact OE1-N 3.44Å; E38-S40 PolarHBondContact OE1-OG 3.36Å; E38-E43 VanDerWaalsContact O-O 3.14Å; E38-G45 PolarHBondContact N-O 3.27Å; E38-G45 PolarHBondContact O-N 2.82Å; E38-T110 WeakPolarHBondContact OE2-CB 3.46Å; E38-T110 PolarHBondContact OE2-OG1 3.5Å; E38-H142 IonicContact OE1-CE1 2.75Å; E38-H142 IonicContact OE1-ND1 3.97Å; E38-H142 IonicContact OE2-CE1 3.88Å; E38-H142 IonicContact OE2-ND1 3.9Å; E38-H142 PolarHBondContact OE2-ND1 3.11Å; E38-D374 HydrophobicContact CG-CB 4.15Å; E38-M378 HydrophobicContact CG-CE 3.85Å; E38-M378 WeakPolarHBondContact OE2-CE 3.34Å; E38-V379 HydrophobicContact CB-CG2 3.81Å; E38-V379 HydrophobicContact CG-CG2 4.36Å; E38-V379 WeakPolarHBondContact OE2-CG2 3.29Å
39	T	98.4	Very high	90.9	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.006	15%	0.147	C	C	.	.			trans	-149.3	31.6	177.4	68	0	0	0	0	112.3	I37 T44 I86 S118 L119 G122	I37-T39 HydrophobicContact CG2-CG2 4.43Å; T39-T44 HydrophobicContact CG2-CG2 4.2Å; T39-I86 HydrophobicContact CG2-CD1 4.02Å; T39-S118 CarbonylContact O-C 3.43Å; T39-S118 WeakPolarHBondContact O-CB 2.97Å; T39-S118 PolarHBondContact OG1-O 3.49Å; T39-L119 PolarHBondContact O-N 2.72Å; T39-G122 WeakPolarHBondContact OG1-CA 3.3Å; T39-G122 PolarHBondContact OG1-N 3.13Å
40	S	97.3	Very high	93.5	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.014	12%	0.116	C	C	.	.	S	Bend	trans	-73.1	-26.7	-175.3	61.1	0	0	0	0	113.6	E38 G114 L115 H142	E38-S40 WeakPolarHBondContact OE1-CA 3.47Å; E38-S40 WeakPolarHBondContact OE1-CB 3.35Å; E38-S40 PolarHBondContact OE1-N 3.44Å; E38-S40 PolarHBondContact OE1-OG 3.36Å; S40-G114 CarbonylContact O-C 3.58Å; S40-G114 WeakPolarHBondContact O-CA 3.47Å; S40-L115 PolarHBondContact O-N 2.93Å; S40-H142 PolarHBondContact OG-CE1 3.18Å; S40-H142 VanDerWaalsContact OG-CE1 3.25Å; S40-H142 PolarHBondContact OG-ND1 2.91Å
41	C	94.4	Very high	95.2	Very high	32 Å²	32	17.5 Å²	17.5	22%	0.216	9%	0.09	C	C	.	.	S	Bend	trans	-134.2	-103.2	-171.7	-167.1	0	0	0	0	112.7	I73 H82 S118	C41-I73 WeakPolarHBondContact SG-CD1 3.43Å; C41-H82 PolarHBondContact O-NE2 2.85Å; C41-S118 PolarHBondContact O-OG 2.66Å
42	D	93.3	Very high	96.7	Very high	30 Å²	30	18.4 Å²	18.4	16%	0.16	10%	0.096	C	C	.	.	S	Bend	trans	-125.9	10.6	-174.6	63.7	-42.2	0	0	0	113.2	Q63 I73	D42-Q63 HydrophobicContact CB-CB 4.19Å; D42-Q63 WeakPolarHBondContact O-CB 3.45Å; D42-Q63 VanDerWaalsContact O-CD 3.3Å; D42-Q63 WeakPolarHBondContact O-CG 3.39Å; D42-Q63 PolarHBondContact O-N 3.06Å; D42-I73 HydrophobicContact CB-CD1 3.97Å; D42-I73 HydrophobicContact CB-CG1 4.34Å
43	E	95.9	Very high	96.9	Very high	21 Å²	21	13.5 Å²	13.5	10%	0.098	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127.4	174	-68	-61.7	152.2	0	0	109.6	E38 L60 S62 H82 D374	E38-E43 VanDerWaalsContact O-O 3.14Å; E43-L60 HydrophobicContact CB-CD1 4.13Å; E43-L60 WeakPolarHBondContact OE2-CD1 3.32Å; E43-L60 WeakPolarHBondContact OE2-CG 3.44Å; E43-S62 WeakPolarHBondContact OE1-CA 3.33Å; E43-S62 WeakPolarHBondContact OE1-CB 3.29Å; E43-S62 PolarHBondContact OE1-OG 3.16Å; E43-S62 WeakPolarHBondContact OE2-CA 3.45Å; E43-S62 WeakPolarHBondContact OE2-CB 3.43Å; E43-H82 PolarHBondContact O-CE1 2.6Å; E43-H82 VanDerWaalsContact O-CE1 3.24Å; E43-D374 HydrophobicContact CB-CB 4Å; E43-D374 HydrophobicContact CG-CB 4.11Å
44	T	98.6	Very high	96.8	Very high	1 Å²	1	15 Å²	15	1%	0.006	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	102.9	167.7	-44.7	0	0	0	0	107.3	T39 L60 H61 H82 I86 V89	T39-T44 HydrophobicContact CG2-CG2 4.2Å; T44-L60 CarbonylContact O-C 3.45Å; T44-L60 WeakPolarHBondContact O-CA 3.32Å; T44-H61 PolarHBondContact N-O 3.21Å; T44-H61 PolarHBondContact O-N 2.9Å; T44-H82 PolarHBondContact OG1-ND1 3.48Å; T44-I86 HydrophobicContact CG2-CB 4.15Å; T44-I86 HydrophobicContact CG2-CG1 4.46Å; T44-V89 HydrophobicContact CG2-CB 4.24Å; T44-V89 HydrophobicContact CG2-CG1 4.35Å; T44-V89 HydrophobicContact CG2-CG2 4.17Å
45	G	98.5	Very high	96.7	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.01	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	140.6	-175.6	0	0	0	0	0	112.4	I37 E38	I37-G45 WeakPolarHBondContact CA-O 3.41Å; E38-G45 PolarHBondContact N-O 3.27Å; E38-G45 PolarHBondContact O-N 2.82Å
46	A	98.9	Very high	96.7	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.008	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	143.5	167.8	0	0	0	0	0	111	L35 G36 E58 S59 V89 V90 A93	L35-A46 HydrophobicContact CD1-CB 4.44Å; G36-A46 CarbonylContact O-C 3.54Å; G36-A46 WeakPolarHBondContact O-CA 3.47Å; A46-E58 CarbonylContact O-C 3.42Å; A46-E58 WeakPolarHBondContact O-CA 3.38Å; A46-S59 PolarHBondContact N-O 2.83Å; A46-S59 PolarHBondContact O-N 3.45Å; A46-V89 HydrophobicContact CB-CG1 3.79Å; A46-V90 HydrophobicContact CB-CB 4.44Å; A46-V90 HydrophobicContact CB-CG2 3.84Å; A46-A93 HydrophobicContact CB-CB 3.8Å
47	A	98.8	Very high	96.7	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	142.4	173.5	0	0	0	0	0	112	L35 G36 G57 E58 A377	L35-A47 CarbonylContact C-O 3.03Å; L35-A47 WeakPolarHBondContact CA-O 3.49Å; G36-A47 PolarHBondContact N-O 3.4Å; G36-A47 PolarHBondContact O-N 2.96Å; A47-G57 CarbonylContact C-O 3.57Å; A47-G57 VanDerWaalsContact CA-O 3.25Å; A47-G57 WeakPolarHBondContact CA-O 3.42Å; A47-E58 HydrophobicContact CB-CB 4.03Å; A47-A377 HydrophobicContact CB-CB 4.03Å
48	V	98.7	Very high	96.6	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.5	169.6	-177.3	0	0	0	0	108.2	V34 L35 L56 G57 L94 V99 L104	V34-V48 WeakPolarHBondContact O-CA 3.19Å; L35-V48 HydrophobicContact CD1-CG2 3.95Å; V48-L56 HydrophobicContact CG1-CB 4.46Å; V48-L56 HydrophobicContact CG1-CD1 4.48Å; V48-L56 PolarHBondContact O-N 3.03Å; V48-G57 PolarHBondContact N-O 2.8Å; V48-G57 PolarHBondContact O-N 3.44Å; V48-L94 HydrophobicContact CG2-CD2 3.92Å; V48-V99 HydrophobicContact CG1-CB 4.24Å; V48-V99 HydrophobicContact CG1-CG1 4.44Å; V48-V99 HydrophobicContact CG1-CG2 4.04Å; V48-L104 HydrophobicContact CG1-CD2 4.2Å
49	M	97	Very high	96.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.7	-174.6	-168.6	174.4	-76	0	0	111.3	L33 V34 A54 I55 M152 A377 A380 W381 V384	L33-M49 CarbonylContact C-O 3.02Å; L33-M49 WeakPolarHBondContact CA-O 3.48Å; V34-M49 PolarHBondContact N-O 3.28Å; V34-M49 PolarHBondContact O-N 3.19Å; M49-A54 WeakPolarHBondContact CA-O 3.49Å; M49-A54 WeakPolarHBondContact CG-O 3.45Å; M49-I55 HydrophobicContact CE-CD1 4.36Å; M49-I55 HydrophobicContact CE-CG1 3.58Å; M49-M152 HydrophobicContact CE-CG 4.11Å; M49-M152 HydrophobicContact CE-SD 3.25Å; M49-M152 WeakPolarHBondContact CE-SD 3.23Å; M49-M152 HydrophobicContact SD-CG 4.22Å; M49-M152 HydrophobicContact SD-SD 4.06Å; M49-A377 HydrophobicContact CE-CB 3.89Å; M49-A380 HydrophobicContact CB-CB 3.82Å; M49-A380 HydrophobicContact CE-CB 4.48Å; M49-A380 HydrophobicContact SD-CB 4.48Å; M49-W381 HydrophobicContact CE-CB 4.35Å; M49-W381 HydrophobicContact SD-CB 3.77Å; M49-W381 HydrophobicContact SD-CD2 4.42Å; M49-W381 HydrophobicContact SD-CE3 3.73Å; M49-W381 HydrophobicContact SD-CG 4.49Å; M49-V384 HydrophobicContact CG-CG2 4.49Å
50	D	95.5	Very high	96.6	Very high	34 Å²	34	28.2 Å²	28.2	18%	0.182	16%	0.164	C	C	.	.			trans	-91.8	177.5	172.1	77.2	9.9	0	0	0	113.2	L33 S52 G53 A54 L56	L33-D50 HydrophobicContact CD2-CB 3.74Å; D50-S52 PolarHBondContact O-N 3.01Å; D50-S52 WeakPolarHBondContact OD1-CA 3.07Å; D50-S52 WeakPolarHBondContact OD1-CB 3.39Å; D50-S52 PolarHBondContact OD1-N 2.92Å; D50-S52 PolarHBondContact OD1-OG 2.84Å; D50-S52 PolarHBondContact OD2-OG 3.2Å; D50-G53 PolarHBondContact O-N 3.4Å; D50-G53 PolarHBondContact OD1-N 2.81Å; D50-G53 VanDerWaalsContact OD1-N 3.11Å; D50-A54 PolarHBondContact N-O 3.35Å; D50-A54 VanDerWaalsContact N-O 3.09Å; D50-A54 WeakPolarHBondContact OD1-CB 3.43Å; D50-A54 PolarHBondContact OD1-N 3.12Å; D50-L56 HydrophobicContact CB-CD1 4.43Å
51	E	92.9	Very high	96.5	Very high	57 Å²	57	30.4 Å²	30.4	27%	0.266	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	1.8	179.6	71.5	-165.4	-164.1	0	0	114.5	F29 R32 R388	F29-E51 VanDerWaalsContact CD1-OE1 3.31Å; F29-E51 WeakPolarHBondContact CD1-OE1 3.44Å; F29-E51 WeakPolarHBondContact CE1-OE1 3.4Å; R32-E51 HydrophobicContact CB-CB 4.3Å; R32-E51 PolarHBondContact N-OE2 3.19Å; R32-E51 VanDerWaalsContact N-OE2 3.1Å; E51-R388 PolarHBondContact O-NH2 3.34Å
52	S	92.3	Very high	96.5	Very high	80 Å²	80	31.5 Å²	31.5	56%	0.559	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-17	170.4	77.9	0	0	0	0	111.9	D50 A54	D50-S52 PolarHBondContact O-N 3.01Å; D50-S52 WeakPolarHBondContact OD1-CA 3.07Å; D50-S52 WeakPolarHBondContact OD1-CB 3.39Å; D50-S52 PolarHBondContact OD1-N 2.92Å; D50-S52 PolarHBondContact OD1-OG 2.84Å; D50-S52 PolarHBondContact OD2-OG 3.2Å; S52-A54 PolarHBondContact OG-N 2.89Å
53	G	92.4	Very high	96.5	Very high	12 Å²	12	30.1 Å²	30.1	12%	0.124	18%	0.175	C	C	.	.	S	Bend	trans	97.4	7.1	-170.5	0	0	0	0	0	113	D50 I55	D50-G53 PolarHBondContact O-N 3.4Å; D50-G53 PolarHBondContact OD1-N 2.81Å; D50-G53 VanDerWaalsContact OD1-N 3.11Å; G53-I55 PolarHBondContact O-N 3.16Å
54	A	95.7	Very high	96	Very high	40 Å²	40	32.3 Å²	32.3	33%	0.331	18%	0.184	S	C	.	.			trans	-73.8	125.8	176	0	0	0	0	0	110.2	M49 D50 S52 L56	M49-A54 WeakPolarHBondContact CA-O 3.49Å; M49-A54 WeakPolarHBondContact CG-O 3.45Å; D50-A54 PolarHBondContact N-O 3.35Å; D50-A54 VanDerWaalsContact N-O 3.09Å; D50-A54 WeakPolarHBondContact OD1-CB 3.43Å; D50-A54 PolarHBondContact OD1-N 3.12Å; S52-A54 PolarHBondContact OG-N 2.89Å; A54-L56 PolarHBondContact O-N 3.48Å
55	I	97.5	Very high	95.4	Very high	46 Å²	46	38.2 Å²	38.2	24%	0.236	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	110.8	172.9	-60.2	169.5	0	0	0	107.3	M49 G53 E58 F371 A377	M49-I55 HydrophobicContact CE-CD1 4.36Å; M49-I55 HydrophobicContact CE-CG1 3.58Å; G53-I55 PolarHBondContact O-N 3.16Å; I55-E58 HydrophobicContact CG2-CB 3.86Å; I55-E58 HydrophobicContact CG2-CG 4.03Å; I55-F371 HydrophobicContact CD1-CE1 3.61Å; I55-F371 HydrophobicContact CD1-CZ 3.62Å; I55-A377 HydrophobicContact CD1-CB 3.77Å; I55-A377 HydrophobicContact CG1-CB 4.22Å
56	L	98	Very high	94.9	Very high	70 Å²	70	41 Å²	41	37%	0.366	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-34.8	178.6	-56.7	-175.4	0	0	0	111.2	L33 V48 D50 A54 S97 V99	L33-L56 HydrophobicContact CD2-CD1 3.57Å; V48-L56 HydrophobicContact CG1-CB 4.46Å; V48-L56 HydrophobicContact CG1-CD1 4.48Å; V48-L56 PolarHBondContact O-N 3.03Å; D50-L56 HydrophobicContact CB-CD1 4.43Å; A54-L56 PolarHBondContact O-N 3.48Å; L56-S97 WeakPolarHBondContact O-CA 3.49Å; L56-V99 HydrophobicContact CD1-CG2 4.08Å
57	G	98.2	Very high	94.2	Very high	5 Å²	5	41.4 Å²	41.4	5%	0.052	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	142.2	173.3	0	0	0	0	0	110.7	A47 V48	A47-G57 CarbonylContact C-O 3.57Å; A47-G57 VanDerWaalsContact CA-O 3.25Å; A47-G57 WeakPolarHBondContact CA-O 3.42Å; V48-G57 PolarHBondContact N-O 2.8Å; V48-G57 PolarHBondContact O-N 3.44Å
58	E	98.1	Very high	93.2	Very high	70 Å²	70	42.8 Å²	42.8	33%	0.327	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	148.4	176.7	63.2	-177.2	162.5	0	0	110.8	A46 A47 I55 R96 R370	A46-E58 CarbonylContact O-C 3.42Å; A46-E58 WeakPolarHBondContact O-CA 3.38Å; A47-E58 HydrophobicContact CB-CB 4.03Å; I55-E58 HydrophobicContact CG2-CB 3.86Å; I55-E58 HydrophobicContact CG2-CG 4.03Å; E58-R96 VanDerWaalsContact O-CD 3.31Å; E58-R96 WeakPolarHBondContact O-CD 3.45Å; E58-R96 PolarHBondContact O-NH1 3.05Å; E58-R370 IonicContact OE1-NH1 2.66Å; E58-R370 PolarHBondContact OE1-NH1 2.89Å
59	S	98.4	Very high	92.3	Very high	7 Å²	7	51.8 Å²	51.8	5%	0.049	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	147.6	167.7	-174.9	0	0	0	0	110	A46 V89 E92	A46-S59 PolarHBondContact N-O 2.83Å; A46-S59 PolarHBondContact O-N 3.45Å; S59-V89 WeakPolarHBondContact CB-O 3.36Å; S59-E92 PolarHBondContact OG-OE2 3.39Å
60	L	97.6	Very high	91.3	Very high	84 Å²	84	55.2 Å²	55.2	44%	0.44	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	130.4	-177.6	-173.7	70.6	0	0	0	109	E43 T44	E43-L60 HydrophobicContact CB-CD1 4.13Å; E43-L60 WeakPolarHBondContact OE2-CD1 3.32Å; E43-L60 WeakPolarHBondContact OE2-CG 3.44Å; T44-L60 CarbonylContact O-C 3.45Å; T44-L60 WeakPolarHBondContact O-CA 3.32Å
61	H	96.9	Very high	90.2	Very high	48 Å²	48	54.8 Å²	54.8	22%	0.222	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	106.1	166.3	179.8	77.8	0	0	0	109.7	T44 N85 R88 V89	T44-H61 PolarHBondContact N-O 3.21Å; T44-H61 PolarHBondContact O-N 2.9Å; H61-N85 HydrophobicContact CB-CB 4.25Å; H61-N85 VanDerWaalsContact CD2-CG 3.41Å; H61-N85 PolarHBondContact CD2-ND2 2.68Å; H61-N85 VanDerWaalsContact CD2-ND2 3.31Å; H61-N85 PolarHBondContact NE2-ND2 2.65Å; H61-N85 VanDerWaalsContact NE2-ND2 3.17Å; H61-R88 PolarHBondContact ND1-NH2 2.74Å; H61-V89 HydrophobicContact CB-CG2 3.75Å
62	S	93.9	Very high	89.5	Confident	55 Å²	55	53.5 Å²	53.5	39%	0.385	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	130	178.8	-178.4	0	0	0	0	111.8	E43 K64	E43-S62 WeakPolarHBondContact OE1-CA 3.33Å; E43-S62 WeakPolarHBondContact OE1-CB 3.29Å; E43-S62 PolarHBondContact OE1-OG 3.16Å; E43-S62 WeakPolarHBondContact OE2-CA 3.45Å; E43-S62 WeakPolarHBondContact OE2-CB 3.43Å; S62-K64 VanDerWaalsContact C-N 3.32Å; S62-K64 VanDerWaalsContact OG-CB 3.26Å; S62-K64 WeakPolarHBondContact OG-CB 3.48Å; S62-K64 PolarHBondContact OG-N 3.04Å
63	Q	92.6	Very high	89.2	Confident	1 Å²	1	53 Å²	53	1%	0.005	29%	0.288	C	S	.	.			trans	-93.7	6.1	174.6	-50.4	167.2	16.6	0	0	111.9	D42 E65 V66 H67 A78 L81 H82	D42-Q63 HydrophobicContact CB-CB 4.19Å; D42-Q63 WeakPolarHBondContact O-CB 3.45Å; D42-Q63 VanDerWaalsContact O-CD 3.3Å; D42-Q63 WeakPolarHBondContact O-CG 3.39Å; D42-Q63 PolarHBondContact O-N 3.06Å; Q63-E65 VanDerWaalsContact C-N 3.31Å; Q63-E65 PolarHBondContact O-N 3Å; Q63-V66 WeakPolarHBondContact O-CB 3.32Å; Q63-V66 PolarHBondContact O-N 3.3Å; Q63-H67 PolarHBondContact O-CD2 3.32Å; Q63-H67 PolarHBondContact O-N 3.46Å; Q63-H67 VanDerWaalsContact O-N 3.09Å; Q63-H67 PolarHBondContact OE1-NE2 3.18Å; Q63-A78 PolarHBondContact NE2-O 2.94Å; Q63-L81 HydrophobicContact CB-CD1 3.85Å; Q63-L81 HydrophobicContact CG-CB 3.85Å; Q63-L81 HydrophobicContact CG-CD1 3.65Å; Q63-L81 HydrophobicContact CG-CG 4.37Å; Q63-H82 PolarHBondContact NE2-CE1 2.85Å; Q63-H82 PolarHBondContact NE2-ND1 3.08Å; Q63-H82 PolarHBondContact NE2-NE2 3.23Å
64	K	85.9	Confident	89.2	Confident	67 Å²	67	55.6 Å²	55.6	29%	0.291	30%	0.298	S	S	.	.	H	α-helix	trans	-50.8	-47.8	-174.5	-178.5	-177.7	-180	-175.7	0	112.2	S62 V66 H67 L68	S62-K64 VanDerWaalsContact C-N 3.32Å; S62-K64 VanDerWaalsContact OG-CB 3.26Å; S62-K64 WeakPolarHBondContact OG-CB 3.48Å; S62-K64 PolarHBondContact OG-N 3.04Å; K64-V66 VanDerWaalsContact C-N 3.31Å; K64-V66 PolarHBondContact O-N 3.25Å; K64-H67 PolarHBondContact O-N 3.3Å; K64-L68 HydrophobicContact CD-CD1 4.46Å; K64-L68 HydrophobicContact CG-CD1 3.85Å; K64-L68 HydrophobicContact CG-CG 4.09Å; K64-L68 VanDerWaalsContact O-CB 3.23Å; K64-L68 WeakPolarHBondContact O-CB 3.48Å; K64-L68 WeakPolarHBondContact O-CG 3.39Å; K64-L68 PolarHBondContact O-N 3.32Å
65	E	85.5	Confident	89.1	Confident	125 Å²	125	56.5 Å²	56.5	58%	0.584	30%	0.301	S	S	*	.	H	α-helix	trans	-62	-39.6	-178.2	-171.7	177.4	178.2	0	0	112.5	Q63 R69	Q63-E65 VanDerWaalsContact C-N 3.31Å; Q63-E65 PolarHBondContact O-N 3Å; E65-R69 WeakPolarHBondContact O-CG 3.47Å; E65-R69 PolarHBondContact O-N 3.29Å; E65-R69 VanDerWaalsContact O-N 3.13Å; E65-R69 IonicContact OE1-CZ 2.78Å; E65-R69 IonicContact OE1-NE 3.82Å; E65-R69 IonicContact OE1-NH2 2.98Å; E65-R69 PolarHBondContact OE1-NH2 2.69Å
66	V	87.7	Confident	89	Confident	60 Å²	60	58.5 Å²	58.5	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-64	-52.5	178.5	180	0	0	0	0	110.2	Q63 K64 L68 R69 T70 V77 L81	Q63-V66 WeakPolarHBondContact O-CB 3.32Å; Q63-V66 PolarHBondContact O-N 3.3Å; K64-V66 VanDerWaalsContact C-N 3.31Å; K64-V66 PolarHBondContact O-N 3.25Å; V66-L68 VanDerWaalsContact C-N 3.29Å; V66-L68 PolarHBondContact O-N 2.87Å; V66-R69 PolarHBondContact O-N 3.42Å; V66-R69 VanDerWaalsContact O-N 3.11Å; V66-T70 PolarHBondContact O-N 3.07Å; V66-T70 PolarHBondContact O-OG1 3.01Å; V66-V77 HydrophobicContact CG1-CG1 4.01Å; V66-L81 HydrophobicContact CB-CD1 4.28Å; V66-L81 HydrophobicContact CG1-CD1 4.17Å; V66-L81 HydrophobicContact CG2-CD1 4.2Å
67	H	84.1	Confident	88.9	Confident	8 Å²	8	57.4 Å²	57.4	4%	0.037	31%	0.311	C	S	.	.	H	α-helix	trans	-73	-24.5	-177.5	-64.5	-55.5	0	0	0	113	Q63 K64 T70 G71 G72 I73 I74	Q63-H67 PolarHBondContact O-CD2 3.32Å; Q63-H67 PolarHBondContact O-N 3.46Å; Q63-H67 VanDerWaalsContact O-N 3.09Å; Q63-H67 PolarHBondContact OE1-NE2 3.18Å; K64-H67 PolarHBondContact O-N 3.3Å; H67-T70 WeakPolarHBondContact CA-OG1 3.39Å; H67-T70 PolarHBondContact O-OG1 2.76Å; H67-G71 PolarHBondContact O-N 3.23Å; H67-G72 PolarHBondContact O-N 3.22Å; H67-I73 HydrophobicContact CB-CG1 4.14Å; H67-I74 PolarHBondContact ND1-N 3.46Å
68	L	78.3	Confident	88.8	Confident	30 Å²	30	57.1 Å²	57.1	16%	0.157	31%	0.309	C	S	.	.	H	α-helix	trans	-58.6	-58.6	165.9	-77.4	175.5	0	0	0	107.7	K64 V66 T70 G71 R206	K64-L68 HydrophobicContact CD-CD1 4.46Å; K64-L68 HydrophobicContact CG-CD1 3.85Å; K64-L68 HydrophobicContact CG-CG 4.09Å; K64-L68 VanDerWaalsContact O-CB 3.23Å; K64-L68 WeakPolarHBondContact O-CB 3.48Å; K64-L68 WeakPolarHBondContact O-CG 3.39Å; K64-L68 PolarHBondContact O-N 3.32Å; V66-L68 VanDerWaalsContact C-N 3.29Å; V66-L68 PolarHBondContact O-N 2.87Å; L68-T70 PolarHBondContact O-N 2.96Å; L68-T70 VanDerWaalsContact O-N 3.09Å; L68-G71 PolarHBondContact O-N 2.82Å; L68-R206 VanDerWaalsContact CB-NH2 3.31Å; L68-R206 PolarHBondContact O-NH1 2.78Å; L68-R206 PolarHBondContact O-NH2 2.78Å
69	R	79.3	Confident	88.7	Confident	189 Å²	189	55.7 Å²	55.7	71%	0.713	30%	0.302	S	S	*	.	H	α-helix	trans	-55.4	-32.8	-176	-68.2	174	-172.7	-168.5	2.6	114	E65 V66	E65-R69 WeakPolarHBondContact O-CG 3.47Å; E65-R69 PolarHBondContact O-N 3.29Å; E65-R69 VanDerWaalsContact O-N 3.13Å; E65-R69 IonicContact OE1-CZ 2.78Å; E65-R69 IonicContact OE1-NE 3.82Å; E65-R69 IonicContact OE1-NH2 2.98Å; E65-R69 PolarHBondContact OE1-NH2 2.69Å; V66-R69 PolarHBondContact O-N 3.42Å; V66-R69 VanDerWaalsContact O-N 3.11Å
70	T	77.4	Confident	88.7	Confident	71 Å²	71	57.9 Å²	57.9	44%	0.436	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-2.7	178.8	55.2	0	0	0	0	114.7	V66 H67 L68 G72 I74	V66-T70 PolarHBondContact O-N 3.07Å; V66-T70 PolarHBondContact O-OG1 3.01Å; H67-T70 WeakPolarHBondContact CA-OG1 3.39Å; H67-T70 PolarHBondContact O-OG1 2.76Å; L68-T70 PolarHBondContact O-N 2.96Å; L68-T70 VanDerWaalsContact O-N 3.09Å; T70-G72 PolarHBondContact OG1-O 3.32Å; T70-I74 HydrophobicContact CG2-CD1 3.88Å
71	G	71	Confident	88.7	Confident	26 Å²	26	55.9 Å²	55.9	27%	0.268	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	23.9	179.5	0	0	0	0	0	113.9	H67 L68 R201	H67-G71 PolarHBondContact O-N 3.23Å; L68-G71 PolarHBondContact O-N 2.82Å; G71-R201 PolarHBondContact O-NE 2.88Å; G71-R201 PolarHBondContact O-NH1 2.94Å; G71-R201 VanDerWaalsContact O-NH1 3.09Å; G71-R201 PolarHBondContact O-NH2 3.11Å
72	G	78.6	Confident	88.8	Confident	30 Å²	30	53.6 Å²	53.6	31%	0.309	30%	0.3	S	S	.	.	S	Bend	trans	147.6	167.6	179.6	0	0	0	0	0	112.3	H67 T70 I74	H67-G72 PolarHBondContact O-N 3.22Å; T70-G72 PolarHBondContact OG1-O 3.32Å; G72-I74 PolarHBondContact O-N 2.93Å
73	I	86.6	Confident	89	Confident	69 Å²	69	58 Å²	58	35%	0.354	31%	0.308	S	S	.	.			trans	-74	120.7	-177.5	-57.7	173.7	0	0	0	109.8	C41 D42 H67 A78 L115	C41-I73 WeakPolarHBondContact SG-CD1 3.43Å; D42-I73 HydrophobicContact CB-CD1 3.97Å; D42-I73 HydrophobicContact CB-CG1 4.34Å; H67-I73 HydrophobicContact CB-CG1 4.14Å; I73-A78 HydrophobicContact CG2-CB 4.21Å; I73-L115 HydrophobicContact CG2-CD1 3.76Å
74	I	91.4	Very high	89.3	Confident	66 Å²	66	61 Å²	61	34%	0.338	34%	0.339	S	S	.	.			trans	-97.5	113.3	173	-58	177.9	0	0	0	108.3	H67 T70 G72 T76 V77 A78	H67-I74 PolarHBondContact ND1-N 3.46Å; T70-I74 HydrophobicContact CG2-CD1 3.88Å; G72-I74 PolarHBondContact O-N 2.93Å; I74-T76 VanDerWaalsContact C-N 3.32Å; I74-T76 PolarHBondContact O-N 2.94Å; I74-V77 HydrophobicContact CB-CB 4.07Å; I74-V77 HydrophobicContact CB-CG2 3.91Å; I74-V77 HydrophobicContact CD1-CG2 4.46Å; I74-V77 HydrophobicContact CG2-CB 4.31Å; I74-V77 HydrophobicContact CG2-CG2 3.8Å; I74-V77 PolarHBondContact O-N 3.31Å; I74-V77 VanDerWaalsContact O-N 3.09Å; I74-A78 PolarHBondContact O-N 2.85Å
75	P	93.3	Very high	89.9	Confident	59 Å²	59	58.9 Å²	58.9	38%	0.383	33%	0.331	S	S	.	.	H	α-helix	trans	-57.8	-36.2	-171.1	-29.3	36.1	0	0	0	115.4	A78 Q79 L117	P75-A78 PolarHBondContact O-N 3.41Å; P75-Q79 WeakPolarHBondContact O-CB 3.13Å; P75-Q79 PolarHBondContact O-N 3.08Å; P75-L117 HydrophobicContact CB-CD1 4.29Å
76	T	95.6	Very high	90.5	Very high	88 Å²	88	53.4 Å²	53.4	54%	0.54	31%	0.305	S	S	.	.	H	α-helix	trans	-70.9	-37.7	178.7	50.1	0	0	0	0	112.2	I74 A80 L117	I74-T76 VanDerWaalsContact C-N 3.32Å; I74-T76 PolarHBondContact O-N 2.94Å; T76-A80 PolarHBondContact O-N 3.01Å; T76-A80 VanDerWaalsContact O-N 3.1Å; T76-L117 HydrophobicContact CG2-CD1 4.1Å
77	V	95.8	Very high	91	Very high	47 Å²	47	57.6 Å²	57.6	29%	0.285	32%	0.321	S	S	.	.	H	α-helix	trans	-66.8	-45	173.5	177.4	0	0	0	0	109.9	V66 I74 Q79 A80 L81	V66-V77 HydrophobicContact CG1-CG1 4.01Å; I74-V77 HydrophobicContact CB-CB 4.07Å; I74-V77 HydrophobicContact CB-CG2 3.91Å; I74-V77 HydrophobicContact CD1-CG2 4.46Å; I74-V77 HydrophobicContact CG2-CB 4.31Å; I74-V77 HydrophobicContact CG2-CG2 3.8Å; I74-V77 PolarHBondContact O-N 3.31Å; I74-V77 VanDerWaalsContact O-N 3.09Å; V77-Q79 VanDerWaalsContact C-N 3.33Å; V77-Q79 PolarHBondContact O-N 2.94Å; V77-A80 PolarHBondContact O-N 3.47Å; V77-A80 VanDerWaalsContact O-N 3.16Å; V77-L81 HydrophobicContact CG1-CD1 3.91Å; V77-L81 HydrophobicContact CG1-CG 4.4Å; V77-L81 WeakPolarHBondContact O-CG 3.39Å; V77-L81 PolarHBondContact O-N 3.1Å
78	A	96.1	Very high	91.7	Very high	0 Å²	0	62 Å²	62	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-59.1	-44.7	177.8	0	0	0	0	0	111.8	Q63 I73 I74 P75 A80 L81 H82 L115	Q63-A78 PolarHBondContact NE2-O 2.94Å; I73-A78 HydrophobicContact CG2-CB 4.21Å; I74-A78 PolarHBondContact O-N 2.85Å; P75-A78 PolarHBondContact O-N 3.41Å; A78-A80 PolarHBondContact O-N 3.19Å; A78-L81 PolarHBondContact O-N 3.48Å; A78-H82 PolarHBondContact O-CD2 3.25Å; A78-H82 PolarHBondContact O-N 3.45Å; A78-L115 HydrophobicContact CB-CD1 4.48Å
79	Q	97.8	Very high	92.7	Very high	40 Å²	40	60.6 Å²	60.6	19%	0.187	33%	0.33	C	S	.	.	H	α-helix	trans	-56.9	-48.6	173.7	-178	-174	73.8	0	0	112.5	P75 V77 L81 H82 R83 L117 V121	P75-Q79 WeakPolarHBondContact O-CB 3.13Å; P75-Q79 PolarHBondContact O-N 3.08Å; V77-Q79 VanDerWaalsContact C-N 3.33Å; V77-Q79 PolarHBondContact O-N 2.94Å; Q79-L81 VanDerWaalsContact C-N 3.3Å; Q79-L81 PolarHBondContact O-N 2.88Å; Q79-H82 PolarHBondContact O-N 3.24Å; Q79-R83 VanDerWaalsContact CD-NH2 3.26Å; Q79-R83 WeakPolarHBondContact O-CB 3.49Å; Q79-R83 PolarHBondContact O-N 3.25Å; Q79-L117 HydrophobicContact CB-CB 3.9Å; Q79-L117 HydrophobicContact CG-CB 4.16Å; Q79-L117 PolarHBondContact NE2-O 2.88Å; Q79-V121 HydrophobicContact CG-CG2 3.79Å
80	A	97.8	Very high	93.6	Very high	53 Å²	53	51.8 Å²	51.8	44%	0.438	30%	0.297	S	S	.	.	H	α-helix	trans	-61.2	-41.9	-178.7	0	0	0	0	0	111.2	T76 V77 A78 R83 G84	T76-A80 PolarHBondContact O-N 3.01Å; T76-A80 VanDerWaalsContact O-N 3.1Å; V77-A80 PolarHBondContact O-N 3.47Å; V77-A80 VanDerWaalsContact O-N 3.16Å; A78-A80 PolarHBondContact O-N 3.19Å; A80-R83 PolarHBondContact O-N 3Å; A80-G84 PolarHBondContact O-N 2.91Å
81	L	97.9	Very high	94.7	Very high	42 Å²	42	53 Å²	53	22%	0.22	30%	0.298	C	S	.	.	H	α-helix	trans	-66.8	-41.2	177.3	-68.7	172.6	0	0	0	112.2	Q63 V66 V77 A78 Q79 G84 N85	Q63-L81 HydrophobicContact CB-CD1 3.85Å; Q63-L81 HydrophobicContact CG-CB 3.85Å; Q63-L81 HydrophobicContact CG-CD1 3.65Å; Q63-L81 HydrophobicContact CG-CG 4.37Å; V66-L81 HydrophobicContact CB-CD1 4.28Å; V66-L81 HydrophobicContact CG1-CD1 4.17Å; V66-L81 HydrophobicContact CG2-CD1 4.2Å; V77-L81 HydrophobicContact CG1-CD1 3.91Å; V77-L81 HydrophobicContact CG1-CG 4.4Å; V77-L81 WeakPolarHBondContact O-CG 3.39Å; V77-L81 PolarHBondContact O-N 3.1Å; A78-L81 PolarHBondContact O-N 3.48Å; Q79-L81 VanDerWaalsContact C-N 3.3Å; Q79-L81 PolarHBondContact O-N 2.88Å; L81-G84 PolarHBondContact O-N 3.38Å; L81-N85 WeakPolarHBondContact O-CB 3.35Å; L81-N85 PolarHBondContact O-N 3.36Å; L81-N85 PolarHBondContact O-ND2 2.91Å
82	H	98.6	Very high	96	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.2	-47.3	171.5	-70.5	-57.7	0	0	0	111.6	C41 E43 T44 Q63 A78 Q79 G84 N85 I86 S118 V121	C41-H82 PolarHBondContact O-NE2 2.85Å; E43-H82 PolarHBondContact O-CE1 2.6Å; E43-H82 VanDerWaalsContact O-CE1 3.24Å; T44-H82 PolarHBondContact OG1-ND1 3.48Å; Q63-H82 PolarHBondContact NE2-CE1 2.85Å; Q63-H82 PolarHBondContact NE2-ND1 3.08Å; Q63-H82 PolarHBondContact NE2-NE2 3.23Å; A78-H82 PolarHBondContact O-CD2 3.25Å; A78-H82 PolarHBondContact O-N 3.45Å; Q79-H82 PolarHBondContact O-N 3.24Å; H82-G84 VanDerWaalsContact C-N 3.3Å; H82-G84 PolarHBondContact O-N 3.3Å; H82-N85 PolarHBondContact O-N 2.89Å; H82-N85 VanDerWaalsContact O-N 3.14Å; H82-I86 WeakPolarHBondContact O-CB 3.4Å; H82-I86 WeakPolarHBondContact O-CG2 3.47Å; H82-I86 PolarHBondContact O-N 3.47Å; H82-S118 VanDerWaalsContact CD2-CB 3.42Å; H82-S118 WeakPolarHBondContact CD2-CB 3.48Å; H82-S118 PolarHBondContact CD2-OG 3.07Å; H82-S118 PolarHBondContact NE2-OG 2.86Å; H82-V121 HydrophobicContact CB-CB 4.12Å; H82-V121 HydrophobicContact CB-CG1 3.83Å; H82-V121 HydrophobicContact CB-CG2 4.38Å
83	R	98.4	Very high	96.9	Very high	148 Å²	148	52.8 Å²	52.8	56%	0.558	28%	0.281	S	S	*	.	H	α-helix	trans	-61.2	-39.6	-178	-172.7	-179.1	-65.4	128.3	1.9	111.9	Q79 A80 N85 V121	Q79-R83 VanDerWaalsContact CD-NH2 3.26Å; Q79-R83 WeakPolarHBondContact O-CB 3.49Å; Q79-R83 PolarHBondContact O-N 3.25Å; A80-R83 PolarHBondContact O-N 3Å; R83-N85 VanDerWaalsContact C-N 3.32Å; R83-V121 HydrophobicContact CB-CG1 4.42Å
84	G	98.3	Very high	97.5	Very high	63 Å²	63	49.7 Å²	49.7	65%	0.649	27%	0.266	S	S	*	.	H	α-helix	trans	-74.8	-16	178.5	0	0	0	0	0	114.8	A80 L81 H82	A80-G84 PolarHBondContact O-N 2.91Å; L81-G84 PolarHBondContact O-N 3.38Å; H82-G84 VanDerWaalsContact C-N 3.3Å; H82-G84 PolarHBondContact O-N 3.3Å
85	N	98.6	Very high	97.9	Very high	23 Å²	23	51.6 Å²	51.6	12%	0.123	28%	0.276	C	S	.	.	H	α-helix	trans	-119.9	-22.5	-172	-73.2	-79.7	0	0	0	115.2	H61 L81 H82 R83 E87 R88 V89	H61-N85 HydrophobicContact CB-CB 4.25Å; H61-N85 VanDerWaalsContact CD2-CG 3.41Å; H61-N85 PolarHBondContact CD2-ND2 2.68Å; H61-N85 VanDerWaalsContact CD2-ND2 3.31Å; H61-N85 PolarHBondContact NE2-ND2 2.65Å; H61-N85 VanDerWaalsContact NE2-ND2 3.17Å; L81-N85 WeakPolarHBondContact O-CB 3.35Å; L81-N85 PolarHBondContact O-N 3.36Å; L81-N85 PolarHBondContact O-ND2 2.91Å; H82-N85 PolarHBondContact O-N 2.89Å; H82-N85 VanDerWaalsContact O-N 3.14Å; R83-N85 VanDerWaalsContact C-N 3.32Å; N85-E87 VanDerWaalsContact C-N 3.33Å; N85-E87 PolarHBondContact O-N 2.93Å; N85-R88 PolarHBondContact O-N 3.46Å; N85-R88 PolarHBondContact OD1-NH2 3.21Å; N85-V89 HydrophobicContact CB-CG2 4.37Å; N85-V89 WeakPolarHBondContact O-CB 3.37Å; N85-V89 WeakPolarHBondContact O-CG2 3.39Å; N85-V89 PolarHBondContact O-N 3.07Å
86	I	98.8	Very high	98.1	Very high	10 Å²	10	56.3 Å²	56.3	5%	0.051	29%	0.287	C	S	.	.	H	α-helix	trans	-57.6	-42.1	-170	-172.3	165.3	0	0	0	113.5	I37 T39 T44 H82 V89 V90 V121 F125	I37-I86 HydrophobicContact CG2-CD1 4.32Å; T39-I86 HydrophobicContact CG2-CD1 4.02Å; T44-I86 HydrophobicContact CG2-CB 4.15Å; T44-I86 HydrophobicContact CG2-CG1 4.46Å; H82-I86 WeakPolarHBondContact O-CB 3.4Å; H82-I86 WeakPolarHBondContact O-CG2 3.47Å; H82-I86 PolarHBondContact O-N 3.47Å; I86-V89 PolarHBondContact O-N 3.34Å; I86-V90 HydrophobicContact CG1-CG2 4.4Å; I86-V90 WeakPolarHBondContact O-CB 3.22Å; I86-V90 WeakPolarHBondContact O-CG2 3.47Å; I86-V90 PolarHBondContact O-N 3.4Å; I86-V121 HydrophobicContact CD1-CG1 4.25Å; I86-V121 HydrophobicContact CG2-CG1 4.2Å; I86-F125 HydrophobicContact CD1-CB 3.45Å; I86-F125 VanDerWaalsContact CD1-CB 3.45Å; I86-F125 HydrophobicContact CD1-CD1 3.89Å; I86-F125 HydrophobicContact CD1-CD2 4.31Å; I86-F125 HydrophobicContact CD1-CG 3.61Å; I86-F125 HydrophobicContact CG1-CB 4.17Å; I86-F125 HydrophobicContact CG1-CD1 3.99Å; I86-F125 HydrophobicContact CG1-CD2 4.1Å; I86-F125 HydrophobicContact CG1-CE1 4.48Å; I86-F125 HydrophobicContact CG1-CG 3.8Å; I86-F125 HydrophobicContact CG2-CB 4.47Å; I86-F125 HydrophobicContact CG2-CD2 3.97Å; I86-F125 HydrophobicContact CG2-CG 4.33Å
87	E	98.6	Very high	98.2	Very high	147 Å²	147	53.1 Å²	53.1	69%	0.687	27%	0.268	S	S	*	.	H	α-helix	trans	-64.6	-49	179.4	-175.5	168.8	-170.4	0	0	111.3	N85 V89 V90 Q91 F125	N85-E87 VanDerWaalsContact C-N 3.33Å; N85-E87 PolarHBondContact O-N 2.93Å; E87-V89 PolarHBondContact O-N 2.89Å; E87-V90 PolarHBondContact O-N 3.11Å; E87-Q91 WeakPolarHBondContact O-CB 3.39Å; E87-Q91 PolarHBondContact O-N 2.95Å; E87-F125 HydrophobicContact CB-CE2 4.16Å; E87-F125 HydrophobicContact CG-CE2 4.48Å
88	R	98.6	Very high	98.3	Very high	101 Å²	101	54 Å²	54	38%	0.381	29%	0.287	S	S	.	.	H	α-helix	trans	-58.5	-47.7	175.8	-178.2	-176.4	63.5	76	3.1	111.7	H61 N85 Q91 E92	H61-R88 PolarHBondContact ND1-NH2 2.74Å; N85-R88 PolarHBondContact O-N 3.46Å; N85-R88 PolarHBondContact OD1-NH2 3.21Å; R88-Q91 PolarHBondContact O-N 2.71Å; R88-E92 WeakPolarHBondContact CD-OE1 3.31Å; R88-E92 HydrophobicContact CG-CG 4.33Å; R88-E92 VanDerWaalsContact CG-OE1 3.24Å; R88-E92 WeakPolarHBondContact CG-OE1 3.41Å; R88-E92 IonicContact CZ-OE1 3.6Å; R88-E92 VanDerWaalsContact NH1-CD 3.27Å; R88-E92 IonicContact NH1-OE1 3.89Å; R88-E92 PolarHBondContact NH1-OE1 2.81Å; R88-E92 IonicContact NH1-OE2 3.9Å; R88-E92 PolarHBondContact NH1-OE2 3.49Å; R88-E92 VanDerWaalsContact NH1-OE2 3.17Å; R88-E92 WeakPolarHBondContact O-CB 3.26Å; R88-E92 VanDerWaalsContact O-CG 3.27Å; R88-E92 WeakPolarHBondContact O-CG 3.41Å; R88-E92 PolarHBondContact O-N 3.08Å
89	V	98.8	Very high	98.4	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-44.5	-178.1	166.8	0	0	0	0	111.3	T44 A46 S59 H61 N85 I86 E87 A93	T44-V89 HydrophobicContact CG2-CB 4.24Å; T44-V89 HydrophobicContact CG2-CG1 4.35Å; T44-V89 HydrophobicContact CG2-CG2 4.17Å; A46-V89 HydrophobicContact CB-CG1 3.79Å; S59-V89 WeakPolarHBondContact CB-O 3.36Å; H61-V89 HydrophobicContact CB-CG2 3.75Å; N85-V89 HydrophobicContact CB-CG2 4.37Å; N85-V89 WeakPolarHBondContact O-CB 3.37Å; N85-V89 WeakPolarHBondContact O-CG2 3.39Å; N85-V89 PolarHBondContact O-N 3.07Å; I86-V89 PolarHBondContact O-N 3.34Å; E87-V89 PolarHBondContact O-N 2.89Å; V89-A93 PolarHBondContact O-N 2.9Å; V89-A93 VanDerWaalsContact O-N 3.08Å
90	V	98.8	Very high	98.3	Very high	3 Å²	3	55 Å²	55	2%	0.018	30%	0.301	C	S	.	.	H	α-helix	trans	-67.5	-43	178.3	170.8	0	0	0	0	111.2	L35 I37 A46 I86 E87 A93 L94 F125 F129	L35-V90 HydrophobicContact CD2-CG1 3.93Å; I37-V90 HydrophobicContact CD1-CG2 4.02Å; I37-V90 HydrophobicContact CG1-CG2 4.12Å; A46-V90 HydrophobicContact CB-CB 4.44Å; A46-V90 HydrophobicContact CB-CG2 3.84Å; I86-V90 HydrophobicContact CG1-CG2 4.4Å; I86-V90 WeakPolarHBondContact O-CB 3.22Å; I86-V90 WeakPolarHBondContact O-CG2 3.47Å; I86-V90 PolarHBondContact O-N 3.4Å; E87-V90 PolarHBondContact O-N 3.11Å; V90-A93 PolarHBondContact O-N 3.38Å; V90-L94 HydrophobicContact CG1-CD1 4.05Å; V90-L94 WeakPolarHBondContact O-CG 3.28Å; V90-L94 PolarHBondContact O-N 3.44Å; V90-F125 HydrophobicContact CB-CE1 3.95Å; V90-F125 HydrophobicContact CB-CZ 3.82Å; V90-F125 HydrophobicContact CG1-CE1 3.89Å; V90-F125 HydrophobicContact CG1-CZ 3.88Å; V90-F125 HydrophobicContact CG2-CD1 4.41Å; V90-F125 HydrophobicContact CG2-CE1 3.63Å; V90-F125 HydrophobicContact CG2-CZ 3.95Å; V90-F129 HydrophobicContact CG1-CE2 4.39Å
91	Q	98.6	Very high	98.2	Very high	98 Å²	98	54 Å²	54	46%	0.458	29%	0.289	S	S	.	.	H	α-helix	trans	-62	-46.1	177.5	-170.8	60.2	51.1	0	0	111.4	E87 R88 A93 L94 D95	E87-Q91 WeakPolarHBondContact O-CB 3.39Å; E87-Q91 PolarHBondContact O-N 2.95Å; R88-Q91 PolarHBondContact O-N 2.71Å; Q91-A93 VanDerWaalsContact C-N 3.31Å; Q91-A93 PolarHBondContact O-N 3.34Å; Q91-L94 PolarHBondContact O-N 3.35Å; Q91-L94 VanDerWaalsContact O-N 3.17Å; Q91-D95 PolarHBondContact NE2-OD1 3Å; Q91-D95 WeakPolarHBondContact O-CB 3.39Å; Q91-D95 PolarHBondContact O-N 2.77Å
92	E	98.8	Very high	98.1	Very high	50 Å²	50	55.8 Å²	55.8	23%	0.234	31%	0.31	C	S	.	.	H	α-helix	trans	-60.4	-38.3	176.5	-76.8	173.1	-171.1	0	0	112.7	S59 R88 R96	S59-E92 PolarHBondContact OG-OE2 3.39Å; R88-E92 WeakPolarHBondContact CD-OE1 3.31Å; R88-E92 HydrophobicContact CG-CG 4.33Å; R88-E92 VanDerWaalsContact CG-OE1 3.24Å; R88-E92 WeakPolarHBondContact CG-OE1 3.41Å; R88-E92 IonicContact CZ-OE1 3.6Å; R88-E92 VanDerWaalsContact NH1-CD 3.27Å; R88-E92 IonicContact NH1-OE1 3.89Å; R88-E92 PolarHBondContact NH1-OE1 2.81Å; R88-E92 IonicContact NH1-OE2 3.9Å; R88-E92 PolarHBondContact NH1-OE2 3.49Å; R88-E92 VanDerWaalsContact NH1-OE2 3.17Å; R88-E92 WeakPolarHBondContact O-CB 3.26Å; R88-E92 VanDerWaalsContact O-CG 3.27Å; R88-E92 WeakPolarHBondContact O-CG 3.41Å; R88-E92 PolarHBondContact O-N 3.08Å; E92-R96 VanDerWaalsContact O-CB 3.3Å; E92-R96 WeakPolarHBondContact O-CB 3.26Å; E92-R96 WeakPolarHBondContact O-CD 3.23Å; E92-R96 WeakPolarHBondContact O-CG 3.46Å; E92-R96 PolarHBondContact O-N 3.13Å
93	A	98.8	Very high	98	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-66	-40.9	176.4	0	0	0	0	0	111.7	A46 V89 V90 Q91 S97	A46-A93 HydrophobicContact CB-CB 3.8Å; V89-A93 PolarHBondContact O-N 2.9Å; V89-A93 VanDerWaalsContact O-N 3.08Å; V90-A93 PolarHBondContact O-N 3.38Å; Q91-A93 VanDerWaalsContact C-N 3.31Å; Q91-A93 PolarHBondContact O-N 3.34Å; A93-S97 WeakPolarHBondContact O-CB 3.46Å; A93-S97 PolarHBondContact O-N 3.48Å; A93-S97 VanDerWaalsContact O-N 3.15Å; A93-S97 PolarHBondContact O-OG 3.3Å
94	L	98.7	Very high	98	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.026	31%	0.309	C	S	.	.	H	α-helix	trans	-66	-47.7	174.9	-71.4	165.6	0	0	0	111.4	V48 V90 Q91 R96 S97 G98 P101 L104 F129	V48-L94 HydrophobicContact CG2-CD2 3.92Å; V90-L94 HydrophobicContact CG1-CD1 4.05Å; V90-L94 WeakPolarHBondContact O-CG 3.28Å; V90-L94 PolarHBondContact O-N 3.44Å; Q91-L94 PolarHBondContact O-N 3.35Å; Q91-L94 VanDerWaalsContact O-N 3.17Å; L94-R96 PolarHBondContact O-N 2.88Å; L94-S97 PolarHBondContact O-N 2.87Å; L94-S97 VanDerWaalsContact O-N 3.1Å; L94-S97 PolarHBondContact O-OG 2.99Å; L94-G98 PolarHBondContact O-N 3.43Å; L94-P101 HydrophobicContact CD1-CG 4.35Å; L94-L104 HydrophobicContact CD2-CD1 4.27Å; L94-F129 HydrophobicContact CD1-CE2 4.04Å; L94-F129 HydrophobicContact CD1-CZ 4.02Å
95	D	98.6	Very high	98	Very high	105 Å²	105	52.9 Å²	52.9	56%	0.561	29%	0.292	S	S	*	.	H	α-helix	trans	-60.2	-46.8	179.9	-67.8	-16.9	0	0	0	111.4	Q91 S97 G98	Q91-D95 PolarHBondContact NE2-OD1 3Å; Q91-D95 WeakPolarHBondContact O-CB 3.39Å; Q91-D95 PolarHBondContact O-N 2.77Å; D95-S97 PolarHBondContact O-N 3.09Å; D95-G98 PolarHBondContact O-N 3.08Å; D95-G98 VanDerWaalsContact O-N 3.14Å
96	R	98.6	Very high	98	Very high	159 Å²	159	51.8 Å²	51.8	60%	0.6	29%	0.286	S	S	*	.	H	α-helix	trans	-62.2	-32.3	176.4	-73.2	172	-174.5	-179.3	3.3	112.6	E58 E92 L94	E58-R96 VanDerWaalsContact O-CD 3.31Å; E58-R96 WeakPolarHBondContact O-CD 3.45Å; E58-R96 PolarHBondContact O-NH1 3.05Å; E92-R96 VanDerWaalsContact O-CB 3.3Å; E92-R96 WeakPolarHBondContact O-CB 3.26Å; E92-R96 WeakPolarHBondContact O-CD 3.23Å; E92-R96 WeakPolarHBondContact O-CG 3.46Å; E92-R96 PolarHBondContact O-N 3.13Å; L94-R96 PolarHBondContact O-N 2.88Å
97	S	98.2	Very high	98	Very high	20 Å²	20	51.3 Å²	51.3	14%	0.14	28%	0.284	C	S	.	.	H	α-helix	trans	-77.7	-20.8	177.3	75.2	0	0	0	0	114	L56 A93 L94 D95 V99	L56-S97 WeakPolarHBondContact O-CA 3.49Å; A93-S97 WeakPolarHBondContact O-CB 3.46Å; A93-S97 PolarHBondContact O-N 3.48Å; A93-S97 VanDerWaalsContact O-N 3.15Å; A93-S97 PolarHBondContact O-OG 3.3Å; L94-S97 PolarHBondContact O-N 2.87Å; L94-S97 VanDerWaalsContact O-N 3.1Å; L94-S97 PolarHBondContact O-OG 2.99Å; D95-S97 PolarHBondContact O-N 3.09Å; S97-V99 PolarHBondContact O-N 2.92Å; S97-V99 VanDerWaalsContact OG-CB 3.29Å; S97-V99 WeakPolarHBondContact OG-CB 2.81Å; S97-V99 WeakPolarHBondContact OG-CG2 3.38Å; S97-V99 PolarHBondContact OG-N 3.48Å; S97-V99 VanDerWaalsContact OG-N 3.13Å
98	G	97.6	Very high	98	Very high	67 Å²	67	44.3 Å²	44.3	69%	0.691	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	12.1	-169.3	0	0	0	0	0	114	L94 D95	L94-G98 PolarHBondContact O-N 3.43Å; D95-G98 PolarHBondContact O-N 3.08Å; D95-G98 VanDerWaalsContact O-N 3.14Å
99	V	96.9	Very high	98	Very high	14 Å²	14	39.5 Å²	39.5	9%	0.085	23%	0.233	C	C	.	.			trans	-93.2	118.8	-176.7	179.2	0	0	0	0	109.6	L33 V48 L56 S97 Q103 L104	L33-V99 HydrophobicContact CD1-CB 4.42Å; L33-V99 HydrophobicContact CD1-CG1 3.62Å; L33-V99 HydrophobicContact CD1-CG2 3.81Å; V48-V99 HydrophobicContact CG1-CB 4.24Å; V48-V99 HydrophobicContact CG1-CG1 4.44Å; V48-V99 HydrophobicContact CG1-CG2 4.04Å; L56-V99 HydrophobicContact CD1-CG2 4.08Å; S97-V99 PolarHBondContact O-N 2.92Å; S97-V99 VanDerWaalsContact OG-CB 3.29Å; S97-V99 WeakPolarHBondContact OG-CB 2.81Å; S97-V99 WeakPolarHBondContact OG-CG2 3.38Å; S97-V99 PolarHBondContact OG-N 3.48Å; S97-V99 VanDerWaalsContact OG-N 3.13Å; V99-Q103 HydrophobicContact CG1-CB 3.87Å; V99-L104 HydrophobicContact CG1-CD2 4.07Å; V99-L104 HydrophobicContact CG1-CG 4.48Å
100	A	96.6	Very high	98	Very high	47 Å²	47	39.5 Å²	39.5	39%	0.388	23%	0.233	S	C	.	.			trans	-69.5	144.9	170.8	0	0	0	0	0	110.3	A102 Q103	A100-A102 PolarHBondContact O-N 3.28Å; A100-Q103 HydrophobicContact CB-CG 4.45Å; A100-Q103 WeakPolarHBondContact O-CB 3.3Å; A100-Q103 PolarHBondContact O-N 3.06Å
101	P	96.6	Very high	98	Very high	31 Å²	31	39.6 Å²	39.6	20%	0.201	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-51.1	-35.6	178	-30.5	35.8	0	0	0	113.8	L94 Q103 L104 F129 H133 K135	L94-P101 HydrophobicContact CD1-CG 4.35Å; P101-Q103 PolarHBondContact O-N 3.44Å; P101-L104 WeakPolarHBondContact O-CB 3.44Å; P101-L104 PolarHBondContact O-N 3.41Å; P101-L104 VanDerWaalsContact O-N 3.12Å; P101-F129 HydrophobicContact CB-CZ 3.97Å; P101-F129 HydrophobicContact CG-CZ 4.12Å; P101-H133 HydrophobicContact CB-CB 4.27Å; P101-K135 WeakPolarHBondContact O-CE 3.33Å
102	A	95.4	Very high	97.9	Very high	79 Å²	79	37.6 Å²	37.6	65%	0.653	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-62	-20.8	177.4	0	0	0	0	0	114.4	A100 K135	A100-A102 PolarHBondContact O-N 3.28Å; A102-K135 VanDerWaalsContact C-NZ 3.34Å; A102-K135 PolarHBondContact O-NZ 2.87Å
103	Q	96.5	Very high	97.8	Very high	113 Å²	113	35.5 Å²	35.5	53%	0.528	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-86.4	-15.2	178	-63.6	172.1	-74.8	0	0	113	L33 V99 A100 P101	L33-Q103 HydrophobicContact CD1-CB 4.43Å; V99-Q103 HydrophobicContact CG1-CB 3.87Å; A100-Q103 HydrophobicContact CB-CG 4.45Å; A100-Q103 WeakPolarHBondContact O-CB 3.3Å; A100-Q103 PolarHBondContact O-N 3.06Å; P101-Q103 PolarHBondContact O-N 3.44Å
104	L	97.9	Very high	97.7	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.016	22%	0.224	C	C	.	.			trans	-63.5	136.7	176.9	-62.5	172.2	0	0	0	110.8	L33 L35 V48 L94 V99 P101 V107 F129 K135	L33-L104 HydrophobicContact CB-CD2 4.26Å; L35-L104 HydrophobicContact CB-CD1 3.84Å; L35-L104 HydrophobicContact CB-CD2 4.05Å; L35-L104 HydrophobicContact CD2-CD1 4.21Å; V48-L104 HydrophobicContact CG1-CD2 4.2Å; L94-L104 HydrophobicContact CD2-CD1 4.27Å; V99-L104 HydrophobicContact CG1-CD2 4.07Å; V99-L104 HydrophobicContact CG1-CG 4.48Å; P101-L104 WeakPolarHBondContact O-CB 3.44Å; P101-L104 PolarHBondContact O-N 3.41Å; P101-L104 VanDerWaalsContact O-N 3.12Å; L104-V107 HydrophobicContact CD1-CG2 4.34Å; L104-F129 HydrophobicContact CD1-CE1 4.01Å; L104-F129 HydrophobicContact CD1-CZ 4.23Å; L104-K135 WeakPolarHBondContact O-CD 3.44Å; L104-K135 WeakPolarHBondContact O-CE 3.41Å; L104-K135 PolarHBondContact O-NZ 3.15Å
105	A	97.9	Very high	97.6	Very high	34 Å²	34	38.7 Å²	38.7	28%	0.281	24%	0.236	S	C	.	.	S	Bend	trans	-81.5	-34.4	171.7	0	0	0	0	0	111.6	R32 L33 P136 L387	R32-A105 HydrophobicContact CB-CB 4.27Å; L33-A105 WeakPolarHBondContact O-CB 3.36Å; L33-A105 PolarHBondContact O-N 3.11Å; A105-P136 WeakPolarHBondContact O-CD 3.44Å; A105-P136 WeakPolarHBondContact O-CG 3.4Å; A105-L387 HydrophobicContact CB-CD1 3.91Å
106	A	98.1	Very high	97.5	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	166	174.6	0	0	0	0	0	111.6	L35 P136 I138 L387	L35-A106 PolarHBondContact N-O 3.36Å; A106-P136 WeakPolarHBondContact CA-O 3.41Å; A106-P136 HydrophobicContact CB-CB 4.26Å; A106-I138 HydrophobicContact CB-CD1 3.64Å; A106-I138 HydrophobicContact CB-CG1 4.06Å; A106-L387 HydrophobicContact CB-CD1 4.09Å; A106-L387 HydrophobicContact CB-CD2 4.07Å; A106-L387 HydrophobicContact CB-CG 4.34Å
107	V	98.7	Very high	97.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	123.9	166.6	-178.2	0	0	0	0	108.5	L35 I37 L104 F129 V130 K135 P136 F137 I138	L35-V107 HydrophobicContact CB-CG1 4.49Å; L35-V107 HydrophobicContact CB-CG2 4.37Å; L35-V107 HydrophobicContact CD2-CG1 4.25Å; L35-V107 HydrophobicContact CD2-CG2 4.35Å; L35-V107 HydrophobicContact CG-CG1 4.38Å; L35-V107 CarbonylContact O-C 3.58Å; L35-V107 WeakPolarHBondContact O-CA 3.31Å; I37-V107 HydrophobicContact CD1-CG1 3.94Å; L104-V107 HydrophobicContact CD1-CG2 4.34Å; V107-F129 HydrophobicContact CG2-CD1 3.79Å; V107-F129 HydrophobicContact CG2-CE1 3.77Å; V107-V130 HydrophobicContact CB-CG1 3.56Å; V107-V130 HydrophobicContact CG1-CG1 4.21Å; V107-V130 HydrophobicContact CG2-CG1 3.73Å; V107-K135 HydrophobicContact CG2-CB 4.41Å; V107-P136 PolarHBondContact N-O 3.42Å; V107-F137 CarbonylContact O-C 3.57Å; V107-F137 WeakPolarHBondContact O-CA 3.28Å; V107-F137 WeakPolarHBondContact O-CD2 3.16Å; V107-I138 PolarHBondContact O-N 3.47Å
108	A	98.8	Very high	97.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	133.4	175.4	0	0	0	0	0	109.6	V34 L35 G36 I37 I138 V140 V379	V34-A108 HydrophobicContact CG1-CB 3.88Å; L35-A108 PolarHBondContact O-N 3.31Å; G36-A108 CarbonylContact C-O 3.54Å; G36-A108 VanDerWaalsContact CA-O 3.28Å; G36-A108 WeakPolarHBondContact CA-O 3.46Å; I37-A108 PolarHBondContact N-O 3.44Å; A108-I138 VanDerWaalsContact CA-O 3.27Å; A108-I138 WeakPolarHBondContact CA-O 3.25Å; A108-I138 HydrophobicContact CB-CB 4.11Å; A108-V140 HydrophobicContact CB-CG2 3.85Å; A108-V379 HydrophobicContact CB-CG1 4.13Å
109	A	98.8	Very high	97.5	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.008	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	142.9	176.2	0	0	0	0	0	111.6	I37 V111 S126 F137 I138 V140	I37-A109 HydrophobicContact CB-CB 4.13Å; I37-A109 WeakPolarHBondContact O-CA 3.46Å; A109-V111 PolarHBondContact O-N 3.06Å; A109-S126 VanDerWaalsContact CB-OG 3.31Å; A109-S126 WeakPolarHBondContact CB-OG 3.47Å; A109-F137 HydrophobicContact CB-CE2 3.68Å; A109-F137 HydrophobicContact CB-CZ 3.93Å; A109-I138 PolarHBondContact N-O 3.26Å; A109-I138 VanDerWaalsContact N-O 3.08Å; A109-V140 PolarHBondContact O-N 2.87Å
110	T	98.8	Very high	97.6	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.006	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	120.5	175.1	-63.9	0	0	0	0	110.4	I37 E38 L119 V140 H142 V379	I37-T110 PolarHBondContact O-N 3.21Å; E38-T110 WeakPolarHBondContact OE2-CB 3.46Å; E38-T110 PolarHBondContact OE2-OG1 3.5Å; T110-L119 HydrophobicContact CG2-CD2 4.06Å; T110-V140 WeakPolarHBondContact CA-O 3.49Å; T110-H142 HydrophobicContact CG2-CB 3.62Å; T110-V379 WeakPolarHBondContact OG1-CG2 3.38Å
111	V	98.6	Very high	97.7	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.024	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-10.4	177.8	-56.8	0	0	0	0	113.1	A109 L123 F137 P139 V140 V400 Y402 E403	A109-V111 PolarHBondContact O-N 3.06Å; V111-L123 HydrophobicContact CG1-CD1 3.9Å; V111-F137 HydrophobicContact CG1-CE1 4.44Å; V111-F137 HydrophobicContact CG1-CZ 4.18Å; V111-P139 HydrophobicContact CG1-CB 4.06Å; V111-P139 HydrophobicContact CG2-CB 3.63Å; V111-V140 PolarHBondContact N-O 3.48Å; V111-V400 HydrophobicContact CG1-CG1 4.28Å; V111-Y402 CarbonylContact O-C 3.56Å; V111-Y402 VanDerWaalsContact O-CA 3.24Å; V111-Y402 WeakPolarHBondContact O-CA 3.35Å; V111-Y402 VanDerWaalsContact O-CB 3.3Å; V111-Y402 WeakPolarHBondContact O-CB 3.43Å; V111-E403 PolarHBondContact O-N 2.94Å
112	K	97.4	Very high	97.8	Very high	56 Å²	56	24.4 Å²	24.4	24%	0.243	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.8	159.5	-177.8	62.5	-170.6	174.9	179.1	0	113.4	H141 H142 E403 A406	K112-H141 HydrophobicContact CG-CB 4.22Å; K112-H141 CarbonylContact O-C 3.16Å; K112-H141 VanDerWaalsContact O-CA 3.26Å; K112-H141 WeakPolarHBondContact O-CA 3.46Å; K112-H142 WeakPolarHBondContact O-CB 3.05Å; K112-H142 PolarHBondContact O-N 2.9Å; K112-E403 WeakPolarHBondContact CA-O 3.25Å; K112-E403 HydrophobicContact CB-CB 3.8Å; K112-E403 WeakPolarHBondContact CB-O 3.47Å; K112-E403 HydrophobicContact CD-CB 4.13Å; K112-E403 HydrophobicContact CD-CG 4.3Å; K112-E403 VanDerWaalsContact CD-OE1 3.23Å; K112-E403 WeakPolarHBondContact CD-OE1 3.49Å; K112-E403 IonicContact NZ-OE1 3.52Å; K112-E403 PolarHBondContact NZ-OE1 3.36Å; K112-E403 IonicContact NZ-OE2 3.44Å; K112-A406 HydrophobicContact CB-CB 3.75Å; K112-A406 HydrophobicContact CD-CB 3.76Å; K112-A406 HydrophobicContact CG-CB 3.95Å
113	P	97	Very high	97.9	Very high	6 Å²	6	21 Å²	21	4%	0.039	13%	0.125	C	C	.	.	S	Bend	cis	-66.8	174.8	-34.9	32.1	-37.6	0	0	0	111.2	H141 M143 E403 P404 A406	P113-H141 WeakPolarHBondContact CD-CE1 3.29Å; P113-M143 HydrophobicContact CG-CG 4.33Å; P113-E403 WeakPolarHBondContact CA-O 3.41Å; P113-P404 WeakPolarHBondContact CB-O 3.41Å; P113-A406 HydrophobicContact CB-CB 4.38Å
114	G	95.4	Very high	98	Very high	21 Å²	21	18.1 Å²	18.1	22%	0.216	12%	0.117	C	C	.	.	S	Bend	trans	161.3	-179	178.4	0	0	0	0	0	113.4	S40 A116 P404	S40-G114 CarbonylContact O-C 3.58Å; S40-G114 WeakPolarHBondContact O-CA 3.47Å; G114-A116 PolarHBondContact O-N 3.46Å; G114-P404 PolarHBondContact N-O 3.33Å; G114-P404 VanDerWaalsContact O-CA 3.26Å; G114-P404 WeakPolarHBondContact O-CA 3.45Å; G114-P404 WeakPolarHBondContact O-CB 3.46Å
115	L	96.1	Very high	98.1	Very high	52 Å²	52	19.1 Å²	19.1	27%	0.272	12%	0.122	S	C	.	.			trans	-65.2	120.4	171.8	-63.2	-179.9	0	0	0	109.4	S40 I73 A78 L117 S118 L119	S40-L115 PolarHBondContact O-N 2.93Å; I73-L115 HydrophobicContact CG2-CD1 3.76Å; A78-L115 HydrophobicContact CB-CD1 4.48Å; L115-L117 VanDerWaalsContact C-N 3.26Å; L115-L117 PolarHBondContact O-N 3.28Å; L115-S118 PolarHBondContact O-N 3.22Å; L115-L119 PolarHBondContact O-N 3.27Å
116	A	97.6	Very high	98.1	Very high	36 Å²	36	17.5 Å²	17.5	30%	0.298	11%	0.108	S	C	.	.	H	α-helix	trans	-49.4	-46.9	-177.3	0	0	0	0	0	113.1	G114 S118 A120 Y402 P404	G114-A116 PolarHBondContact O-N 3.46Å; A116-S118 VanDerWaalsContact C-N 3.33Å; A116-S118 PolarHBondContact O-N 3.16Å; A116-A120 WeakPolarHBondContact O-CB 3.19Å; A116-A120 PolarHBondContact O-N 2.88Å; A116-Y402 HydrophobicContact CB-CE2 3.82Å; A116-Y402 WeakPolarHBondContact O-CE2 3.27Å; A116-P404 HydrophobicContact CB-CB 4.12Å; A116-P404 HydrophobicContact CB-CG 3.55Å
117	L	97.9	Very high	98.1	Very high	63 Å²	63	18.9 Å²	18.9	33%	0.33	12%	0.115	S	C	.	.	H	α-helix	trans	-67.2	-32.8	-178.6	-61.7	-175.8	0	0	0	112.9	P75 T76 Q79 L115	P75-L117 HydrophobicContact CB-CD1 4.29Å; T76-L117 HydrophobicContact CG2-CD1 4.1Å; Q79-L117 HydrophobicContact CB-CB 3.9Å; Q79-L117 HydrophobicContact CG-CB 4.16Å; Q79-L117 PolarHBondContact NE2-O 2.88Å; L115-L117 VanDerWaalsContact C-N 3.26Å; L115-L117 PolarHBondContact O-N 3.28Å
118	S	98.3	Very high	98.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-77.4	-45.9	177.8	-55.4	0	0	0	0	111.5	T39 C41 H82 L115 A116 A120 V121 G122	T39-S118 CarbonylContact O-C 3.43Å; T39-S118 WeakPolarHBondContact O-CB 2.97Å; T39-S118 PolarHBondContact OG1-O 3.49Å; C41-S118 PolarHBondContact O-OG 2.66Å; H82-S118 VanDerWaalsContact CD2-CB 3.42Å; H82-S118 WeakPolarHBondContact CD2-CB 3.48Å; H82-S118 PolarHBondContact CD2-OG 3.07Å; H82-S118 PolarHBondContact NE2-OG 2.86Å; L115-S118 PolarHBondContact O-N 3.22Å; A116-S118 VanDerWaalsContact C-N 3.33Å; A116-S118 PolarHBondContact O-N 3.16Å; S118-A120 VanDerWaalsContact C-N 3.27Å; S118-A120 PolarHBondContact O-N 2.87Å; S118-V121 WeakPolarHBondContact O-CB 3.4Å; S118-V121 PolarHBondContact O-N 3.36Å; S118-V121 VanDerWaalsContact O-N 3.07Å; S118-G122 PolarHBondContact O-N 3Å
119	L	98.6	Very high	98.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-57.1	-40.6	175.2	-70.9	173.7	0	0	0	112	T39 T110 L115 V121 G122 L123 Y402	T39-L119 PolarHBondContact O-N 2.72Å; T110-L119 HydrophobicContact CG2-CD2 4.06Å; L115-L119 PolarHBondContact O-N 3.27Å; L119-V121 VanDerWaalsContact C-N 3.26Å; L119-V121 PolarHBondContact O-N 2.95Å; L119-G122 PolarHBondContact O-N 3.4Å; L119-L123 WeakPolarHBondContact O-CB 3.47Å; L119-L123 PolarHBondContact O-N 3.42Å; L119-Y402 HydrophobicContact CB-CD2 3.95Å; L119-Y402 HydrophobicContact CB-CG 3.94Å; L119-Y402 HydrophobicContact CD1-CD2 4.15Å
120	A	98.5	Very high	98	Very high	27 Å²	27	27.3 Å²	27.3	22%	0.223	15%	0.147	C	C	.	.	H	α-helix	trans	-58.2	-37.1	177.3	0	0	0	0	0	112.7	A116 S118 S124 Y402	A116-A120 WeakPolarHBondContact O-CB 3.19Å; A116-A120 PolarHBondContact O-N 2.88Å; S118-A120 VanDerWaalsContact C-N 3.27Å; S118-A120 PolarHBondContact O-N 2.87Å; A120-S124 WeakPolarHBondContact O-CB 3.36Å; A120-S124 PolarHBondContact O-N 3.03Å; A120-Y402 HydrophobicContact CB-CD1 4.21Å; A120-Y402 HydrophobicContact CB-CE1 3.61Å
121	V	98.7	Very high	98	Very high	15 Å²	15	32.1 Å²	32.1	9%	0.091	17%	0.165	C	C	.	.	H	α-helix	trans	-67.5	-51.4	178.3	176.5	0	0	0	0	110.6	Q79 H82 R83 I86 S118 L119 L123 S124 F125	Q79-V121 HydrophobicContact CG-CG2 3.79Å; H82-V121 HydrophobicContact CB-CB 4.12Å; H82-V121 HydrophobicContact CB-CG1 3.83Å; H82-V121 HydrophobicContact CB-CG2 4.38Å; R83-V121 HydrophobicContact CB-CG1 4.42Å; I86-V121 HydrophobicContact CD1-CG1 4.25Å; I86-V121 HydrophobicContact CG2-CG1 4.2Å; S118-V121 WeakPolarHBondContact O-CB 3.4Å; S118-V121 PolarHBondContact O-N 3.36Å; S118-V121 VanDerWaalsContact O-N 3.07Å; L119-V121 VanDerWaalsContact C-N 3.26Å; L119-V121 PolarHBondContact O-N 2.95Å; V121-L123 PolarHBondContact O-N 3.08Å; V121-S124 PolarHBondContact O-N 3.04Å; V121-F125 WeakPolarHBondContact O-CB 3.29Å; V121-F125 PolarHBondContact O-N 3.18Å
122	G	98.6	Very high	97.9	Very high	1 Å²	1	39 Å²	39	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-59.6	-46.4	179.3	0	0	0	0	0	112.8	T39 S118 L119 S126	T39-G122 WeakPolarHBondContact OG1-CA 3.3Å; T39-G122 PolarHBondContact OG1-N 3.13Å; S118-G122 PolarHBondContact O-N 3Å; L119-G122 PolarHBondContact O-N 3.4Å; G122-S126 VanDerWaalsContact O-CB 3.29Å; G122-S126 WeakPolarHBondContact O-CB 3.27Å; G122-S126 PolarHBondContact O-N 3.31Å; G122-S126 PolarHBondContact O-OG 3.37Å
123	L	98.6	Very high	97.9	Very high	8 Å²	8	39.1 Å²	39.1	4%	0.042	20%	0.198	C	C	.	.	H	α-helix	trans	-65.7	-45.2	-180	-179	57.1	0	0	0	112.1	V111 L119 V121 F125 S126 Q127 F137 V400 Y402	V111-L123 HydrophobicContact CG1-CD1 3.9Å; L119-L123 WeakPolarHBondContact O-CB 3.47Å; L119-L123 PolarHBondContact O-N 3.42Å; V121-L123 PolarHBondContact O-N 3.08Å; L123-F125 PolarHBondContact O-N 3.23Å; L123-S126 PolarHBondContact O-N 3.14Å; L123-Q127 HydrophobicContact CD1-CG 3.97Å; L123-Q127 WeakPolarHBondContact O-CB 3.48Å; L123-Q127 WeakPolarHBondContact O-CG 3.37Å; L123-Q127 PolarHBondContact O-N 2.99Å; L123-F137 HydrophobicContact CD1-CE1 4.04Å; L123-F137 HydrophobicContact CD1-CZ 3.85Å; L123-V400 HydrophobicContact CD1-CB 4.21Å; L123-V400 HydrophobicContact CD1-CG1 4.24Å; L123-V400 WeakPolarHBondContact CD2-O 3.32Å; L123-Y402 HydrophobicContact CD2-CD1 4.09Å
124	S	98.5	Very high	97.9	Very high	52 Å²	52	44.4 Å²	44.4	36%	0.364	23%	0.226	S	C	.	.	H	α-helix	trans	-61.3	-45.2	178.8	-178.7	0	0	0	0	111.7	A120 V121 R128	A120-S124 WeakPolarHBondContact O-CB 3.36Å; A120-S124 PolarHBondContact O-N 3.03Å; V121-S124 PolarHBondContact O-N 3.04Å; S124-R128 WeakPolarHBondContact O-CG 3.41Å; S124-R128 PolarHBondContact O-N 2.84Å
125	F	98.7	Very high	98	Very high	25 Å²	25	44.8 Å²	44.8	11%	0.11	22%	0.221	C	C	.	.	H	α-helix	trans	-60.7	-50.4	174.8	176.2	-86	0	0	0	111.3	I37 I86 E87 V90 V121 L123 Q127 R128 F129	I37-F125 HydrophobicContact CD1-CD1 4.01Å; I37-F125 HydrophobicContact CD1-CE1 3.95Å; I86-F125 HydrophobicContact CD1-CB 3.45Å; I86-F125 VanDerWaalsContact CD1-CB 3.45Å; I86-F125 HydrophobicContact CD1-CD1 3.89Å; I86-F125 HydrophobicContact CD1-CD2 4.31Å; I86-F125 HydrophobicContact CD1-CG 3.61Å; I86-F125 HydrophobicContact CG1-CB 4.17Å; I86-F125 HydrophobicContact CG1-CD1 3.99Å; I86-F125 HydrophobicContact CG1-CD2 4.1Å; I86-F125 HydrophobicContact CG1-CE1 4.48Å; I86-F125 HydrophobicContact CG1-CG 3.8Å; I86-F125 HydrophobicContact CG2-CB 4.47Å; I86-F125 HydrophobicContact CG2-CD2 3.97Å; I86-F125 HydrophobicContact CG2-CG 4.33Å; E87-F125 HydrophobicContact CB-CE2 4.16Å; E87-F125 HydrophobicContact CG-CE2 4.48Å; V90-F125 HydrophobicContact CB-CE1 3.95Å; V90-F125 HydrophobicContact CB-CZ 3.82Å; V90-F125 HydrophobicContact CG1-CE1 3.89Å; V90-F125 HydrophobicContact CG1-CZ 3.88Å; V90-F125 HydrophobicContact CG2-CD1 4.41Å; V90-F125 HydrophobicContact CG2-CE1 3.63Å; V90-F125 HydrophobicContact CG2-CZ 3.95Å; V121-F125 WeakPolarHBondContact O-CB 3.29Å; V121-F125 PolarHBondContact O-N 3.18Å; L123-F125 PolarHBondContact O-N 3.23Å; F125-Q127 PolarHBondContact O-N 2.91Å; F125-R128 PolarHBondContact O-N 3.15Å; F125-F129 HydrophobicContact CE1-CB 4.31Å; F125-F129 HydrophobicContact CE1-CD2 4.28Å; F125-F129 HydrophobicContact CZ-CD2 4.28Å; F125-F129 PolarHBondContact O-N 3.36Å
126	S	98.6	Very high	98.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-43.4	-175.5	-56.9	0	0	0	0	111.9	I37 A109 G122 L123 R128 F129 V130	I37-S126 WeakPolarHBondContact CD1-OG 3.38Å; A109-S126 VanDerWaalsContact CB-OG 3.31Å; A109-S126 WeakPolarHBondContact CB-OG 3.47Å; G122-S126 VanDerWaalsContact O-CB 3.29Å; G122-S126 WeakPolarHBondContact O-CB 3.27Å; G122-S126 PolarHBondContact O-N 3.31Å; G122-S126 PolarHBondContact O-OG 3.37Å; L123-S126 PolarHBondContact O-N 3.14Å; S126-R128 PolarHBondContact O-N 3.25Å; S126-F129 PolarHBondContact O-N 3.16Å; S126-V130 WeakPolarHBondContact O-CG1 3.15Å; S126-V130 WeakPolarHBondContact O-CG2 3.32Å; S126-V130 PolarHBondContact O-N 3.24Å
127	Q	98.1	Very high	98.2	Very high	28 Å²	28	42.8 Å²	42.8	13%	0.131	21%	0.208	C	C	.	.	H	α-helix	trans	-63	-37.9	176.7	-80.4	-178.4	-15.9	0	0	113	L123 F125 V130 R131 V400	L123-Q127 HydrophobicContact CD1-CG 3.97Å; L123-Q127 WeakPolarHBondContact O-CB 3.48Å; L123-Q127 WeakPolarHBondContact O-CG 3.37Å; L123-Q127 PolarHBondContact O-N 2.99Å; F125-Q127 PolarHBondContact O-N 2.91Å; Q127-V130 WeakPolarHBondContact O-CG2 3.03Å; Q127-R131 WeakPolarHBondContact O-CB 3.47Å; Q127-R131 VanDerWaalsContact O-CG 3.25Å; Q127-R131 WeakPolarHBondContact O-CG 3.41Å; Q127-R131 PolarHBondContact O-N 3.47Å; Q127-V400 PolarHBondContact NE2-O 3.44Å; Q127-V400 VanDerWaalsContact NE2-O 3.1Å
128	R	98.2	Very high	98.2	Very high	154 Å²	154	39.8 Å²	39.8	58%	0.581	19%	0.192	S	C	*	.	H	α-helix	trans	-66.2	-44.9	173	-71.2	-169.9	-57.1	-125.5	2.9	111.2	S124 F125 S126 R131 H132	S124-R128 WeakPolarHBondContact O-CG 3.41Å; S124-R128 PolarHBondContact O-N 2.84Å; F125-R128 PolarHBondContact O-N 3.15Å; S126-R128 PolarHBondContact O-N 3.25Å; R128-R131 PolarHBondContact O-N 3.34Å; R128-H132 VanDerWaalsContact O-CB 3.3Å; R128-H132 WeakPolarHBondContact O-CB 3.43Å; R128-H132 PolarHBondContact O-N 2.63Å
129	F	98.4	Very high	98.2	Very high	23 Å²	23	41.1 Å²	41.1	10%	0.101	20%	0.201	C	C	.	.	H	α-helix	trans	-60.4	-48.3	-179.7	-174.2	-81.1	0	0	0	111.8	L35 V90 L94 P101 L104 V107 F125 S126 R131 H132 H133	L35-F129 HydrophobicContact CD2-CE1 3.96Å; L35-F129 HydrophobicContact CD2-CZ 3.96Å; V90-F129 HydrophobicContact CG1-CE2 4.39Å; L94-F129 HydrophobicContact CD1-CE2 4.04Å; L94-F129 HydrophobicContact CD1-CZ 4.02Å; P101-F129 HydrophobicContact CB-CZ 3.97Å; P101-F129 HydrophobicContact CG-CZ 4.12Å; L104-F129 HydrophobicContact CD1-CE1 4.01Å; L104-F129 HydrophobicContact CD1-CZ 4.23Å; V107-F129 HydrophobicContact CG2-CD1 3.79Å; V107-F129 HydrophobicContact CG2-CE1 3.77Å; F125-F129 HydrophobicContact CE1-CB 4.31Å; F125-F129 HydrophobicContact CE1-CD2 4.28Å; F125-F129 HydrophobicContact CZ-CD2 4.28Å; F125-F129 PolarHBondContact O-N 3.36Å; S126-F129 PolarHBondContact O-N 3.16Å; F129-R131 PolarHBondContact O-N 3.28Å; F129-H132 PolarHBondContact O-N 3.1Å; F129-H133 AromaticContact CD1-CD2 3.8Å; F129-H133 AromaticContact CD2-CD2 3.81Å; F129-H133 AromaticContact CE1-CD2 3.61Å; F129-H133 AromaticContact CE2-CD2 3.61Å; F129-H133 AromaticContact CE2-NE2 3.64Å; F129-H133 AromaticContact CG-CD2 3.9Å; F129-H133 AromaticContact CZ-CD2 3.52Å; F129-H133 AromaticContact CZ-NE2 3.87Å; F129-H133 PolarHBondContact O-CD2 3.14Å; F129-H133 PolarHBondContact O-N 3.24Å
130	V	98.1	Very high	98.2	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-66.4	-37	-179.4	-63.8	0	0	0	0	112.9	V107 S126 Q127 N134 K135 F137 P396	V107-V130 HydrophobicContact CB-CG1 3.56Å; V107-V130 HydrophobicContact CG1-CG1 4.21Å; V107-V130 HydrophobicContact CG2-CG1 3.73Å; S126-V130 WeakPolarHBondContact O-CG1 3.15Å; S126-V130 WeakPolarHBondContact O-CG2 3.32Å; S126-V130 PolarHBondContact O-N 3.24Å; Q127-V130 WeakPolarHBondContact O-CG2 3.03Å; V130-N134 CarbonylContact O-C 3.56Å; V130-N134 VanDerWaalsContact O-CA 3.26Å; V130-N134 WeakPolarHBondContact O-CA 3.22Å; V130-N134 PolarHBondContact O-N 3.03Å; V130-K135 HydrophobicContact CB-CB 4.48Å; V130-K135 WeakPolarHBondContact CB-O 3.28Å; V130-K135 HydrophobicContact CG1-CB 4.45Å; V130-K135 PolarHBondContact O-N 3.09Å; V130-F137 HydrophobicContact CG1-CB 4.18Å; V130-F137 HydrophobicContact CG1-CD2 3.99Å; V130-F137 HydrophobicContact CG2-CB 4.28Å; V130-P396 HydrophobicContact CB-CB 4.34Å; V130-P396 HydrophobicContact CG2-CB 4.23Å
131	R	97.8	Very high	98.2	Very high	103 Å²	103	40.1 Å²	40.1	39%	0.389	19%	0.192	S	C	.	.	H	α-helix	trans	-67.4	-44.3	174.7	-71.9	175.9	-170	133.8	-3.8	111.6	Q127 R128 F129 H133 N134 P396	Q127-R131 WeakPolarHBondContact O-CB 3.47Å; Q127-R131 VanDerWaalsContact O-CG 3.25Å; Q127-R131 WeakPolarHBondContact O-CG 3.41Å; Q127-R131 PolarHBondContact O-N 3.47Å; R128-R131 PolarHBondContact O-N 3.34Å; F129-R131 PolarHBondContact O-N 3.28Å; R131-H133 VanDerWaalsContact C-N 3.35Å; R131-H133 PolarHBondContact O-N 3.11Å; R131-N134 PolarHBondContact O-N 3.4Å; R131-P396 HydrophobicContact CG-CB 4.37Å; R131-P396 WeakPolarHBondContact CG-O 3.47Å; R131-P396 PolarHBondContact NE-O 3.11Å
132	H	97.9	Very high	98.2	Very high	147 Å²	147	39.7 Å²	39.7	68%	0.681	19%	0.189	S	C	*	.	H	α-helix	trans	-63	-40.6	179.9	-178.5	64	0	0	0	112.4	R128 F129	R128-H132 VanDerWaalsContact O-CB 3.3Å; R128-H132 WeakPolarHBondContact O-CB 3.43Å; R128-H132 PolarHBondContact O-N 2.63Å; F129-H132 PolarHBondContact O-N 3.1Å
133	H	97.4	Very high	98.1	Very high	60 Å²	60	39.9 Å²	39.9	28%	0.278	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	5.7	-178.6	-64.4	-62.4	0	0	0	114.5	P101 F129 R131 K135	P101-H133 HydrophobicContact CB-CB 4.27Å; F129-H133 AromaticContact CD1-CD2 3.8Å; F129-H133 AromaticContact CD2-CD2 3.81Å; F129-H133 AromaticContact CE1-CD2 3.61Å; F129-H133 AromaticContact CE2-CD2 3.61Å; F129-H133 AromaticContact CE2-NE2 3.64Å; F129-H133 AromaticContact CG-CD2 3.9Å; F129-H133 AromaticContact CZ-CD2 3.52Å; F129-H133 AromaticContact CZ-NE2 3.87Å; F129-H133 PolarHBondContact O-CD2 3.14Å; F129-H133 PolarHBondContact O-N 3.24Å; R131-H133 VanDerWaalsContact C-N 3.35Å; R131-H133 PolarHBondContact O-N 3.11Å; H133-K135 HydrophobicContact CB-CG 3.96Å; H133-K135 PolarHBondContact O-N 3.09Å
134	N	97.1	Very high	98.1	Very high	116 Å²	116	40.3 Å²	40.3	62%	0.62	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.3	56.2	-175.7	-170	21.8	0	0	0	112.8	V130 R131	V130-N134 CarbonylContact O-C 3.56Å; V130-N134 VanDerWaalsContact O-CA 3.26Å; V130-N134 WeakPolarHBondContact O-CA 3.22Å; V130-N134 PolarHBondContact O-N 3.03Å; R131-N134 PolarHBondContact O-N 3.4Å
135	K	97.1	Very high	98	Very high	29 Å²	29	37.8 Å²	37.8	13%	0.126	17%	0.174	C	C	.	.			trans	-111.7	145.4	-178	-64.2	-51.9	-174.7	176.6	0	112.6	P101 A102 L104 V107 V130 H133 P396	P101-K135 WeakPolarHBondContact O-CE 3.33Å; A102-K135 VanDerWaalsContact C-NZ 3.34Å; A102-K135 PolarHBondContact O-NZ 2.87Å; L104-K135 WeakPolarHBondContact O-CD 3.44Å; L104-K135 WeakPolarHBondContact O-CE 3.41Å; L104-K135 PolarHBondContact O-NZ 3.15Å; V107-K135 HydrophobicContact CG2-CB 4.41Å; V130-K135 HydrophobicContact CB-CB 4.48Å; V130-K135 WeakPolarHBondContact CB-O 3.28Å; V130-K135 HydrophobicContact CG1-CB 4.45Å; V130-K135 PolarHBondContact O-N 3.09Å; H133-K135 HydrophobicContact CB-CG 3.96Å; H133-K135 PolarHBondContact O-N 3.09Å; K135-P396 WeakPolarHBondContact O-CB 3.34Å
136	P	97.9	Very high	97.9	Very high	42 Å²	42	36.7 Å²	36.7	27%	0.273	17%	0.169	S	C	.	.			trans	-60.3	146.6	167.8	-20.8	32	0	0	0	111.8	A105 A106 V107 I393 L394	A105-P136 WeakPolarHBondContact O-CD 3.44Å; A105-P136 WeakPolarHBondContact O-CG 3.4Å; A106-P136 WeakPolarHBondContact CA-O 3.41Å; A106-P136 HydrophobicContact CB-CB 4.26Å; V107-P136 PolarHBondContact N-O 3.42Å; P136-I393 HydrophobicContact CB-CG2 3.56Å; P136-I393 HydrophobicContact CG-CG2 4.43Å; P136-L394 CarbonylContact C-O 3.56Å; P136-L394 VanDerWaalsContact CA-O 3.29Å; P136-L394 WeakPolarHBondContact CA-O 3.41Å
137	F	98.7	Very high	97.9	Very high	4 Å²	4	36.7 Å²	36.7	2%	0.018	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	138.1	177.8	-176.4	-115.1	0	0	0	111.1	V107 A109 V111 L123 V130 P139 L394 V400	V107-F137 CarbonylContact O-C 3.57Å; V107-F137 WeakPolarHBondContact O-CA 3.28Å; V107-F137 WeakPolarHBondContact O-CD2 3.16Å; A109-F137 HydrophobicContact CB-CE2 3.68Å; A109-F137 HydrophobicContact CB-CZ 3.93Å; V111-F137 HydrophobicContact CG1-CE1 4.44Å; V111-F137 HydrophobicContact CG1-CZ 4.18Å; L123-F137 HydrophobicContact CD1-CE1 4.04Å; L123-F137 HydrophobicContact CD1-CZ 3.85Å; V130-F137 HydrophobicContact CG1-CB 4.18Å; V130-F137 HydrophobicContact CG1-CD2 3.99Å; V130-F137 HydrophobicContact CG2-CB 4.28Å; F137-P139 HydrophobicContact CE1-CB 4.15Å; F137-L394 PolarHBondContact N-O 3.1Å; F137-L394 WeakPolarHBondContact O-CB 3.48Å; F137-L394 PolarHBondContact O-N 3.06Å; F137-V400 HydrophobicContact CD1-CG2 3.92Å; F137-V400 HydrophobicContact CE1-CB 4.18Å; F137-V400 HydrophobicContact CE1-CG1 4.21Å; F137-V400 HydrophobicContact CE1-CG2 3.91Å
138	I	98.7	Very high	97.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	104.8	178	-59	174.8	0	0	0	108.5	A106 V107 A108 A109 V140 R386 L387 I393	A106-I138 HydrophobicContact CB-CD1 3.64Å; A106-I138 HydrophobicContact CB-CG1 4.06Å; V107-I138 PolarHBondContact O-N 3.47Å; A108-I138 VanDerWaalsContact CA-O 3.27Å; A108-I138 WeakPolarHBondContact CA-O 3.25Å; A108-I138 HydrophobicContact CB-CB 4.11Å; A109-I138 PolarHBondContact N-O 3.26Å; A109-I138 VanDerWaalsContact N-O 3.08Å; I138-V140 HydrophobicContact CG2-CG2 4.26Å; I138-V140 PolarHBondContact O-N 2.89Å; I138-R386 HydrophobicContact CG2-CB 4.12Å; I138-R386 HydrophobicContact CG2-CG 4.37Å; I138-L387 HydrophobicContact CD1-CD2 3.83Å; I138-L387 HydrophobicContact CD1-CG 3.73Å; I138-I393 HydrophobicContact CD1-CG1 4.4Å; I138-I393 HydrophobicContact CG1-CG1 4.4Å
139	P	98.6	Very high	97.7	Very high	29 Å²	29	28 Å²	28	19%	0.188	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	124.7	172.2	27.5	-31.4	0	0	0	110.1	V111 F137 G392 L394 V400	V111-P139 HydrophobicContact CG1-CB 4.06Å; V111-P139 HydrophobicContact CG2-CB 3.63Å; F137-P139 HydrophobicContact CE1-CB 4.15Å; P139-G392 WeakPolarHBondContact CD-O 3.26Å; P139-L394 HydrophobicContact CG-CD1 3.89Å; P139-V400 HydrophobicContact CB-CG1 4.24Å
140	V	98.7	Very high	97.6	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	137.8	-176.8	174.3	0	0	0	0	111	A108 A109 T110 V111 I138 A145 V379 N382	A108-V140 HydrophobicContact CB-CG2 3.85Å; A109-V140 PolarHBondContact O-N 2.87Å; T110-V140 WeakPolarHBondContact CA-O 3.49Å; V111-V140 PolarHBondContact N-O 3.48Å; I138-V140 HydrophobicContact CG2-CG2 4.26Å; I138-V140 PolarHBondContact O-N 2.89Å; V140-A145 HydrophobicContact CG1-CB 3.91Å; V140-V379 HydrophobicContact CB-CG1 4.04Å; V140-V379 HydrophobicContact CG1-CG1 4.2Å; V140-V379 HydrophobicContact CG2-CG1 3.91Å; V140-N382 HydrophobicContact CG1-CB 3.94Å; V140-N382 HydrophobicContact CG2-CB 4.37Å
141	H	98.5	Very high	97.5	Very high	6 Å²	6	29.1 Å²	29.1	3%	0.028	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	119.6	166.1	-170.4	-67.3	0	0	0	109.6	K112 P113 M143 E144 A145	K112-H141 HydrophobicContact CG-CB 4.22Å; K112-H141 CarbonylContact O-C 3.16Å; K112-H141 VanDerWaalsContact O-CA 3.26Å; K112-H141 WeakPolarHBondContact O-CA 3.46Å; P113-H141 WeakPolarHBondContact CD-CE1 3.29Å; H141-M143 VanDerWaalsContact C-N 3.33Å; H141-M143 PolarHBondContact ND1-N 3.31Å; H141-M143 VanDerWaalsContact ND1-N 3.2Å; H141-M143 PolarHBondContact O-N 3.01Å; H141-E144 HydrophobicContact CB-CB 4.09Å; H141-E144 HydrophobicContact CB-CG 3.64Å; H141-E144 IonicContact CG-OE1 3.42Å; H141-E144 WeakPolarHBondContact O-CA 3.38Å; H141-E144 WeakPolarHBondContact O-CB 3.47Å; H141-E144 PolarHBondContact O-N 3.15Å; H141-A145 PolarHBondContact O-N 2.81Å
142	H	97.9	Very high	97.4	Very high	6 Å²	6	25 Å²	25	3%	0.028	12%	0.124	C	C	.	.	H	α-helix	trans	-52.4	-44.5	-176.6	-176.9	66.2	0	0	0	113.2	E38 S40 T110 K112 E144 A145 H146 D374 M378	E38-H142 IonicContact OE1-CE1 2.75Å; E38-H142 IonicContact OE1-ND1 3.97Å; E38-H142 IonicContact OE2-CE1 3.88Å; E38-H142 IonicContact OE2-ND1 3.9Å; E38-H142 PolarHBondContact OE2-ND1 3.11Å; S40-H142 PolarHBondContact OG-CE1 3.18Å; S40-H142 VanDerWaalsContact OG-CE1 3.25Å; S40-H142 PolarHBondContact OG-ND1 2.91Å; T110-H142 HydrophobicContact CG2-CB 3.62Å; K112-H142 WeakPolarHBondContact O-CB 3.05Å; K112-H142 PolarHBondContact O-N 2.9Å; H142-E144 PolarHBondContact O-N 3.26Å; H142-A145 WeakPolarHBondContact O-CB 3.35Å; H142-A145 PolarHBondContact O-N 2.76Å; H142-H146 AromaticContact CE1-CD2 3.65Å; H142-H146 AromaticContact CE1-NE2 3.41Å; H142-H146 PolarHBondContact CE1-NE2 3.05Å; H142-H146 AromaticContact NE2-CD2 3.51Å; H142-H146 AromaticContact NE2-NE2 3.44Å; H142-H146 PolarHBondContact NE2-NE2 2.96Å; H142-H146 PolarHBondContact O-CD2 3.25Å; H142-H146 PolarHBondContact O-N 3Å; H142-H146 VanDerWaalsContact O-N 3.09Å; H142-D374 VanDerWaalsContact CE1-CG 3.42Å; H142-D374 IonicContact CE1-OD1 2.73Å; H142-D374 PolarHBondContact CE1-OD1 3.14Å; H142-D374 IonicContact CE1-OD2 3.73Å; H142-D374 IonicContact NE2-OD1 3.42Å; H142-D374 PolarHBondContact NE2-OD1 3.47Å; H142-D374 IonicContact NE2-OD2 3.17Å; H142-M378 VanDerWaalsContact CE1-CE 3.47Å; H142-M378 WeakPolarHBondContact CE1-CE 3.4Å; H142-M378 WeakPolarHBondContact ND1-CE 3.45Å
143	M	96.9	Very high	97.1	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.02	11%	0.11	C	C	.	.	H	α-helix	trans	-71.2	-27.5	177	-61.7	-70.3	101.3	0	0	113.5	P113 H141 A147 L164 H169 L171 L408	P113-M143 HydrophobicContact CG-CG 4.33Å; H141-M143 VanDerWaalsContact C-N 3.33Å; H141-M143 PolarHBondContact ND1-N 3.31Å; H141-M143 VanDerWaalsContact ND1-N 3.2Å; H141-M143 PolarHBondContact O-N 3.01Å; M143-A147 WeakPolarHBondContact O-CB 3.42Å; M143-A147 PolarHBondContact O-N 3.34Å; M143-A147 VanDerWaalsContact O-N 3.08Å; M143-L164 HydrophobicContact CB-CD1 3.99Å; M143-L164 HydrophobicContact SD-CD1 4.05Å; M143-H169 HydrophobicContact SD-CB 3.97Å; M143-L171 HydrophobicContact CB-CD1 4.49Å; M143-L171 HydrophobicContact CG-CD1 3.89Å; M143-L171 HydrophobicContact SD-CD1 3.74Å; M143-L408 HydrophobicContact CB-CD1 4.17Å; M143-L408 HydrophobicContact CB-CD2 4.26Å
144	E	97.9	Very high	96.8	Very high	17 Å²	17	22.3 Å²	22.3	8%	0.079	11%	0.114	C	C	.	.	H	α-helix	trans	-70.2	-42.6	173.6	-63.3	171.2	-173.4	0	0	109.1	H141 H142 H146 A147 L148 F181 R386 L408	H141-E144 HydrophobicContact CB-CB 4.09Å; H141-E144 HydrophobicContact CB-CG 3.64Å; H141-E144 IonicContact CG-OE1 3.42Å; H141-E144 WeakPolarHBondContact O-CA 3.38Å; H141-E144 WeakPolarHBondContact O-CB 3.47Å; H141-E144 PolarHBondContact O-N 3.15Å; H142-E144 PolarHBondContact O-N 3.26Å; E144-H146 PolarHBondContact O-N 3.18Å; E144-A147 PolarHBondContact O-N 2.86Å; E144-A147 VanDerWaalsContact O-N 3.16Å; E144-L148 VanDerWaalsContact O-CG 3.29Å; E144-L148 WeakPolarHBondContact O-CG 3.47Å; E144-L148 PolarHBondContact O-N 3.4Å; E144-F181 HydrophobicContact CB-CE2 4.13Å; E144-F181 HydrophobicContact CB-CZ 4.27Å; E144-F181 HydrophobicContact CG-CD2 4.14Å; E144-F181 HydrophobicContact CG-CE2 3.63Å; E144-F181 HydrophobicContact CG-CZ 4.18Å; E144-R386 IonicContact OE1-NH2 2.69Å; E144-R386 IonicContact OE2-CZ 2.71Å; E144-R386 IonicContact OE2-NH2 3.51Å; E144-R386 PolarHBondContact OE2-NH2 3.33Å; E144-L408 HydrophobicContact CG-CD1 3.69Å
145	A	97.5	Very high	96.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-54.7	-52.3	174.8	0	0	0	0	0	111.3	V140 H141 H142 A147 L148 T149 M378 N382	V140-A145 HydrophobicContact CG1-CB 3.91Å; H141-A145 PolarHBondContact O-N 2.81Å; H142-A145 WeakPolarHBondContact O-CB 3.35Å; H142-A145 PolarHBondContact O-N 2.76Å; A145-A147 VanDerWaalsContact C-N 3.31Å; A145-A147 PolarHBondContact O-N 3.16Å; A145-L148 PolarHBondContact O-N 3.41Å; A145-T149 PolarHBondContact O-N 3.08Å; A145-T149 VanDerWaalsContact O-N 3.1Å; A145-T149 PolarHBondContact O-OG1 3.08Å; A145-M378 HydrophobicContact CB-CB 4.15Å; A145-M378 HydrophobicContact CB-CG 3.96Å; A145-M378 HydrophobicContact CB-SD 4.34Å; A145-N382 HydrophobicContact CB-CB 4.19Å
146	H	97	Very high	96.4	Very high	2 Å²	2	22 Å²	22	1%	0.009	12%	0.12	C	C	.	.	H	α-helix	trans	-58.4	-38.1	175.9	-88.3	-67.8	0	0	0	114.1	H142 E144 T149 L164 S340 C372 D374 M378	H142-H146 AromaticContact CE1-CD2 3.65Å; H142-H146 AromaticContact CE1-NE2 3.41Å; H142-H146 PolarHBondContact CE1-NE2 3.05Å; H142-H146 AromaticContact NE2-CD2 3.51Å; H142-H146 AromaticContact NE2-NE2 3.44Å; H142-H146 PolarHBondContact NE2-NE2 2.96Å; H142-H146 PolarHBondContact O-CD2 3.25Å; H142-H146 PolarHBondContact O-N 3Å; H142-H146 VanDerWaalsContact O-N 3.09Å; E144-H146 PolarHBondContact O-N 3.18Å; H146-T149 PolarHBondContact O-OG1 2.99Å; H146-L164 HydrophobicContact CB-CD2 3.76Å; H146-S340 WeakPolarHBondContact O-CB 3.33Å; H146-S340 PolarHBondContact O-OG 2.99Å; H146-C372 PolarHBondContact CE1-O 2.87Å; H146-D374 IonicContact CE1-OD1 3.52Å; H146-D374 PolarHBondContact CE1-OD1 3.35Å; H146-D374 IonicContact NE2-OD1 3.25Å; H146-D374 PolarHBondContact NE2-OD1 2.97Å; H146-M378 PolarHBondContact CE1-SD 3.45Å
147	A	96.9	Very high	96.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-70.9	-35.4	-179.1	0	0	0	0	0	112.6	M143 E144 A145 V162 L164 F181	M143-A147 WeakPolarHBondContact O-CB 3.42Å; M143-A147 PolarHBondContact O-N 3.34Å; M143-A147 VanDerWaalsContact O-N 3.08Å; E144-A147 PolarHBondContact O-N 2.86Å; E144-A147 VanDerWaalsContact O-N 3.16Å; A145-A147 VanDerWaalsContact C-N 3.31Å; A145-A147 PolarHBondContact O-N 3.16Å; A147-V162 HydrophobicContact CB-CG1 4.24Å; A147-V162 HydrophobicContact CB-CG2 4.07Å; A147-L164 HydrophobicContact CB-CD1 4.38Å; A147-F181 HydrophobicContact CB-CE1 3.75Å; A147-F181 HydrophobicContact CB-CZ 4.13Å
148	L	97.2	Very high	96.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-88.6	-12.6	-176.5	-59.2	-178.7	0	0	0	113.3	E144 A145 V150 R151 F158 F160 V178 F181 W381 N382	E144-L148 VanDerWaalsContact O-CG 3.29Å; E144-L148 WeakPolarHBondContact O-CG 3.47Å; E144-L148 PolarHBondContact O-N 3.4Å; A145-L148 PolarHBondContact O-N 3.41Å; L148-V150 PolarHBondContact O-N 3.01Å; L148-R151 VanDerWaalsContact O-CB 3.28Å; L148-R151 WeakPolarHBondContact O-CB 3.5Å; L148-R151 PolarHBondContact O-N 3.07Å; L148-F158 HydrophobicContact CD2-CE1 3.69Å; L148-F158 HydrophobicContact CD2-CZ 3.71Å; L148-F160 HydrophobicContact CD2-CZ 4.09Å; L148-V178 HydrophobicContact CD1-CB 4.33Å; L148-V178 HydrophobicContact CD1-CG1 3.9Å; L148-F181 HydrophobicContact CD2-CZ 4.22Å; L148-F181 HydrophobicContact CG-CZ 4.45Å; L148-W381 PolarHBondContact O-NE1 3.22Å; L148-W381 VanDerWaalsContact O-NE1 3.1Å; L148-N382 WeakPolarHBondContact CD1-ND2 3.21Å
149	T	96	Very high	96.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-47.9	-37.2	179.4	-60.1	0	0	0	0	113.8	A145 H146 R151 M152 P367 F371 M378	A145-T149 PolarHBondContact O-N 3.08Å; A145-T149 VanDerWaalsContact O-N 3.1Å; A145-T149 PolarHBondContact O-OG1 3.08Å; H146-T149 PolarHBondContact O-OG1 2.99Å; T149-R151 PolarHBondContact O-N 3.46Å; T149-M152 HydrophobicContact CG2-CE 4.42Å; T149-M152 WeakPolarHBondContact O-CB 3.46Å; T149-M152 PolarHBondContact O-N 3.43Å; T149-P367 HydrophobicContact CG2-CB 4.17Å; T149-P367 HydrophobicContact CG2-CG 4.15Å; T149-F371 HydrophobicContact CG2-CB 3.75Å; T149-M378 WeakPolarHBondContact OG1-CB 3.33Å
150	V	95.8	Very high	96.2	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.012	15%	0.153	C	C	.	.	H	α-helix	trans	-63.7	-30.5	179.8	73.5	0	0	0	0	112.8	L148 M152 L153 Q154 L156 V338 L365 P367	L148-V150 PolarHBondContact O-N 3.01Å; V150-M152 PolarHBondContact O-N 3.27Å; V150-L153 PolarHBondContact O-N 3.15Å; V150-L153 VanDerWaalsContact O-N 3.08Å; V150-Q154 HydrophobicContact CG2-CG 4.43Å; V150-Q154 PolarHBondContact O-N 3.44Å; V150-Q154 VanDerWaalsContact O-N 3.16Å; V150-L156 HydrophobicContact CG1-CD2 3.63Å; V150-V338 HydrophobicContact CB-CG1 4.02Å; V150-V338 HydrophobicContact CG1-CB 4.43Å; V150-V338 HydrophobicContact CG1-CG1 3.75Å; V150-V338 HydrophobicContact CG1-CG2 3.75Å; V150-L365 HydrophobicContact CG2-CB 3.79Å; V150-L365 HydrophobicContact CG2-CD1 4.02Å; V150-P367 HydrophobicContact CB-CG 4.32Å
151	R	96.3	Very high	96.2	Very high	44 Å²	44	29.9 Å²	29.9	17%	0.166	15%	0.153	C	C	.	.	H	α-helix	trans	-70.4	-21.4	180	-61.8	166.6	57.2	71.8	16.8	112.2	L148 T149 L153 Q154 L156 F160 W381 E385	L148-R151 VanDerWaalsContact O-CB 3.28Å; L148-R151 WeakPolarHBondContact O-CB 3.5Å; L148-R151 PolarHBondContact O-N 3.07Å; T149-R151 PolarHBondContact O-N 3.46Å; R151-L153 VanDerWaalsContact C-N 3.27Å; R151-Q154 WeakPolarHBondContact CA-O 3.41Å; R151-L156 HydrophobicContact CG-CB 4.12Å; R151-L156 HydrophobicContact CG-CD2 4.49Å; R151-L156 PolarHBondContact NH1-O 3.1Å; R151-F160 HydrophobicContact CG-CE1 4.4Å; R151-F160 HydrophobicContact CG-CZ 4.48Å; R151-W381 HydrophobicContact CB-CZ2 3.91Å; R151-W381 WeakPolarHBondContact O-CZ2 3.35Å; R151-E385 WeakPolarHBondContact CD-OE2 3.34Å; R151-E385 IonicContact CZ-OE1 3.73Å; R151-E385 VanDerWaalsContact CZ-OE1 3.3Å; R151-E385 IonicContact CZ-OE2 2.67Å; R151-E385 VanDerWaalsContact NE-CD 3.28Å; R151-E385 IonicContact NE-OE1 3.75Å; R151-E385 PolarHBondContact NE-OE1 2.8Å; R151-E385 IonicContact NE-OE2 3.57Å; R151-E385 PolarHBondContact NE-OE2 2.7Å; R151-E385 IonicContact NH2-OE1 3.7Å; R151-E385 PolarHBondContact NH2-OE1 2.95Å; R151-E385 IonicContact NH2-OE2 3.78Å
152	M	94.6	Very high	96.2	Very high	17 Å²	17	29.7 Å²	29.7	8%	0.084	15%	0.152	C	C	.	.	H	α-helix	trans	-66.2	-33.1	171	-174.7	-174.9	70.3	0	0	111.4	M49 T149 V150 F371 W381	M49-M152 HydrophobicContact CE-CG 4.11Å; M49-M152 HydrophobicContact CE-SD 3.25Å; M49-M152 WeakPolarHBondContact CE-SD 3.23Å; M49-M152 HydrophobicContact SD-CG 4.22Å; M49-M152 HydrophobicContact SD-SD 4.06Å; T149-M152 HydrophobicContact CG2-CE 4.42Å; T149-M152 WeakPolarHBondContact O-CB 3.46Å; T149-M152 PolarHBondContact O-N 3.43Å; V150-M152 PolarHBondContact O-N 3.27Å; M152-F371 HydrophobicContact CE-CD1 3.92Å; M152-F371 HydrophobicContact CE-CD2 3.99Å; M152-F371 HydrophobicContact CE-CE1 3.73Å; M152-F371 HydrophobicContact CE-CE2 3.78Å; M152-F371 HydrophobicContact CE-CG 4.04Å; M152-F371 HydrophobicContact CE-CZ 3.61Å; M152-W381 VanDerWaalsContact CA-CE2 3.49Å; M152-W381 HydrophobicContact CB-CB 4.4Å; M152-W381 HydrophobicContact CB-CD2 3.61Å; M152-W381 HydrophobicContact CB-CE3 4.07Å; M152-W381 HydrophobicContact CB-CG 3.74Å; M152-W381 HydrophobicContact CB-CZ2 4.36Å; M152-W381 HydrophobicContact CG-CB 4.42Å; M152-W381 HydrophobicContact CG-CD2 3.98Å; M152-W381 HydrophobicContact CG-CE3 4Å; M152-W381 HydrophobicContact CG-CG 4.16Å; M152-W381 VanDerWaalsContact N-CE2 3.33Å; M152-W381 HydrophobicContact SD-CB 4.24Å
153	L	92.2	Very high	96.3	Very high	74 Å²	74	29.4 Å²	29.4	39%	0.387	15%	0.151	S	C	.	.	H	α-helix	trans	-93.4	-30.5	-170.9	-57.9	175	0	0	0	112.6	V150 R151 P367 P368 F371	V150-L153 PolarHBondContact O-N 3.15Å; V150-L153 VanDerWaalsContact O-N 3.08Å; R151-L153 VanDerWaalsContact C-N 3.27Å; L153-P367 HydrophobicContact CD1-CB 4.08Å; L153-P368 HydrophobicContact CD1-CG 4.18Å; L153-F371 HydrophobicContact CD1-CD2 4.27Å; L153-F371 HydrophobicContact CD2-CD2 4.03Å; L153-F371 HydrophobicContact CD2-CE2 3.75Å
154	Q	90.8	Very high	96.3	Very high	76 Å²	76	29.3 Å²	29.3	36%	0.355	15%	0.151	S	C	.	.	S	Bend	trans	-154	150.6	179.3	55.3	177.7	76.9	0	0	111.3	V150 R151 L156 L365	V150-Q154 HydrophobicContact CG2-CG 4.43Å; V150-Q154 PolarHBondContact O-N 3.44Å; V150-Q154 VanDerWaalsContact O-N 3.16Å; R151-Q154 WeakPolarHBondContact CA-O 3.41Å; Q154-L156 PolarHBondContact O-N 3.47Å; Q154-L156 VanDerWaalsContact O-N 3.1Å; Q154-L365 VanDerWaalsContact NE2-CD2 3.3Å
155	P	90.4	Very high	96.2	Very high	120 Å²	120	28.5 Å²	28.5	78%	0.779	15%	0.147	S	C	*	.			trans	-60	117.1	172.5	-21.4	33.1	0	0	0	110.6
156	L	95.8	Very high	96	Very high	18 Å²	18	29.2 Å²	29.2	9%	0.094	15%	0.152	C	C	.	.			trans	-127	140.5	169.2	174.8	62.4	0	0	0	106.4	V150 R151 Q154 F160 T336 V338 L365	V150-L156 HydrophobicContact CG1-CD2 3.63Å; R151-L156 HydrophobicContact CG-CB 4.12Å; R151-L156 HydrophobicContact CG-CD2 4.49Å; R151-L156 PolarHBondContact NH1-O 3.1Å; Q154-L156 PolarHBondContact O-N 3.47Å; Q154-L156 VanDerWaalsContact O-N 3.1Å; L156-F160 HydrophobicContact CD1-CD1 4.5Å; L156-F160 HydrophobicContact CD2-CB 4.23Å; L156-F160 HydrophobicContact CD2-CD1 3.56Å; L156-F160 HydrophobicContact CD2-CD2 4.03Å; L156-F160 HydrophobicContact CD2-CE1 3.81Å; L156-F160 HydrophobicContact CD2-CE2 4.24Å; L156-F160 HydrophobicContact CD2-CG 3.67Å; L156-F160 HydrophobicContact CD2-CZ 4.13Å; L156-F160 HydrophobicContact CG-CD1 3.78Å; L156-F160 HydrophobicContact CG-CE1 4.17Å; L156-F160 HydrophobicContact CG-CG 4.24Å; L156-T336 HydrophobicContact CD1-CG2 3.9Å; L156-T336 HydrophobicContact CD2-CG2 4.33Å; L156-V338 HydrophobicContact CD2-CG2 3.64Å; L156-L365 HydrophobicContact CD1-CD1 4.36Å; L156-L365 HydrophobicContact CD2-CD1 4.23Å
157	H	96	Very high	95.5	Very high	152 Å²	152	30.9 Å²	30.9	70%	0.704	17%	0.17	S	C	*	.			trans	-104.8	149.2	177.8	-63.6	93.1	0	0	0	109.9
158	F	97.9	Very high	95.1	Very high	51 Å²	51	33.3 Å²	33.3	22%	0.224	19%	0.194	C	C	.	.	S	Bend	trans	-72.3	151	169.1	-60.4	-72	0	0	0	110.6	L148 F160 A175 R176 G177 V178	L148-F158 HydrophobicContact CD2-CE1 3.69Å; L148-F158 HydrophobicContact CD2-CZ 3.71Å; F158-F160 AromaticContact CD1-CD1 3.95Å; F158-F160 HydrophobicContact CD1-CD1 3.95Å; F158-F160 AromaticContact CD1-CE1 3.46Å; F158-F160 HydrophobicContact CD1-CE1 3.46Å; F158-F160 VanDerWaalsContact CD1-CE1 3.46Å; F158-F160 HydrophobicContact CD1-CZ 4.31Å; F158-F160 HydrophobicContact CE1-CD1 4.4Å; F158-F160 AromaticContact CE1-CE1 3.47Å; F158-F160 HydrophobicContact CE1-CE1 3.47Å; F158-F160 VanDerWaalsContact CE1-CE1 3.47Å; F158-F160 AromaticContact CE1-CZ 3.97Å; F158-F160 HydrophobicContact CE1-CZ 3.97Å; F158-F160 HydrophobicContact CG-CE1 4.44Å; F158-F160 HydrophobicContact CZ-CE1 4.46Å; F158-A175 HydrophobicContact CD1-CB 4.1Å; F158-A175 HydrophobicContact CE1-CB 4.05Å; F158-R176 VanDerWaalsContact CB-O 3.3Å; F158-R176 WeakPolarHBondContact CB-O 3.28Å; F158-G177 VanDerWaalsContact CE1-O 3.29Å; F158-G177 WeakPolarHBondContact CE1-O 3.47Å; F158-G177 WeakPolarHBondContact CZ-O 3.34Å; F158-V178 HydrophobicContact CE2-CG2 4.17Å; F158-V178 HydrophobicContact CZ-CG2 4.16Å
159	P	98.3	Very high	94.8	Very high	39 Å²	39	35.8 Å²	35.8	25%	0.253	21%	0.206	S	C	.	.			cis	-86.9	154.5	-5.7	33.4	-32.4	0	0	0	113.4	V174 A175 R176 L329 P331	P159-V174 HydrophobicContact CB-CG1 3.99Å; P159-A175 CarbonylContact C-O 3.58Å; P159-A175 WeakPolarHBondContact CA-O 3.48Å; P159-A175 WeakPolarHBondContact CB-O 3.31Å; P159-R176 HydrophobicContact CB-CG 4.4Å; P159-L329 WeakPolarHBondContact CG-O 3.42Å; P159-P331 WeakPolarHBondContact O-CD 3.27Å
160	F	98.6	Very high	94.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	156.3	171.2	57.6	-93.2	0	0	0	111.6	L148 R151 L156 F158 V174 A175 V338	L148-F160 HydrophobicContact CD2-CZ 4.09Å; R151-F160 HydrophobicContact CG-CE1 4.4Å; R151-F160 HydrophobicContact CG-CZ 4.48Å; L156-F160 HydrophobicContact CD1-CD1 4.5Å; L156-F160 HydrophobicContact CD2-CB 4.23Å; L156-F160 HydrophobicContact CD2-CD1 3.56Å; L156-F160 HydrophobicContact CD2-CD2 4.03Å; L156-F160 HydrophobicContact CD2-CE1 3.81Å; L156-F160 HydrophobicContact CD2-CE2 4.24Å; L156-F160 HydrophobicContact CD2-CG 3.67Å; L156-F160 HydrophobicContact CD2-CZ 4.13Å; L156-F160 HydrophobicContact CG-CD1 3.78Å; L156-F160 HydrophobicContact CG-CE1 4.17Å; L156-F160 HydrophobicContact CG-CG 4.24Å; F158-F160 AromaticContact CD1-CD1 3.95Å; F158-F160 HydrophobicContact CD1-CD1 3.95Å; F158-F160 AromaticContact CD1-CE1 3.46Å; F158-F160 HydrophobicContact CD1-CE1 3.46Å; F158-F160 VanDerWaalsContact CD1-CE1 3.46Å; F158-F160 HydrophobicContact CD1-CZ 4.31Å; F158-F160 HydrophobicContact CE1-CD1 4.4Å; F158-F160 AromaticContact CE1-CE1 3.47Å; F158-F160 HydrophobicContact CE1-CE1 3.47Å; F158-F160 VanDerWaalsContact CE1-CE1 3.47Å; F158-F160 AromaticContact CE1-CZ 3.97Å; F158-F160 HydrophobicContact CE1-CZ 3.97Å; F158-F160 HydrophobicContact CG-CE1 4.44Å; F158-F160 HydrophobicContact CZ-CE1 4.46Å; F160-V174 WeakPolarHBondContact O-CA 3.45Å; F160-A175 HydrophobicContact CD1-CB 4.36Å; F160-A175 HydrophobicContact CD2-CB 4.04Å; F160-A175 HydrophobicContact CE1-CB 3.98Å; F160-A175 HydrophobicContact CE2-CB 3.64Å; F160-A175 HydrophobicContact CG-CB 4.39Å; F160-A175 HydrophobicContact CZ-CB 3.61Å; F160-A175 PolarHBondContact N-O 3.5Å; F160-A175 PolarHBondContact O-N 3.25Å; F160-V338 HydrophobicContact CD2-CB 4.14Å; F160-V338 HydrophobicContact CD2-CG2 3.45Å; F160-V338 VanDerWaalsContact CD2-CG2 3.45Å; F160-V338 HydrophobicContact CE2-CB 4.29Å; F160-V338 HydrophobicContact CE2-CG2 3.78Å; F160-V338 HydrophobicContact CG-CG2 4.2Å
161	L	98.7	Very high	94.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	135.8	176.6	-178.9	65.5	0	0	0	108.8	L172 A173 V174 L184 A320 V321 L330 T336 L337 V338	L161-L172 HydrophobicContact CD1-CD2 4.46Å; L161-A173 WeakPolarHBondContact CD1-O 3.28Å; L161-V174 HydrophobicContact CD1-CG2 4.39Å; L161-L184 HydrophobicContact CD1-CD1 3.69Å; L161-A320 HydrophobicContact CD1-CB 4.34Å; L161-A320 HydrophobicContact CD2-CB 4.36Å; L161-V321 HydrophobicContact CD2-CG2 3.55Å; L161-L330 HydrophobicContact CB-CD1 4.23Å; L161-L330 HydrophobicContact CB-CD2 4.1Å; L161-T336 PolarHBondContact N-O 2.89Å; L161-L337 HydrophobicContact CB-CD1 4.38Å; L161-L337 HydrophobicContact CD2-CD1 3.97Å; L161-L337 HydrophobicContact CG-CD1 3.94Å; L161-L337 CarbonylContact O-C 3.6Å; L161-L337 WeakPolarHBondContact O-CA 3.45Å; L161-V338 PolarHBondContact O-N 3.45Å
162	V	98.4	Very high	95	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.5	174.4	76.3	0	0	0	0	110.8	A147 L164 L172 A173 V338	A147-V162 HydrophobicContact CB-CG1 4.24Å; A147-V162 HydrophobicContact CB-CG2 4.07Å; V162-L164 HydrophobicContact CG1-CG 4.33Å; V162-L164 HydrophobicContact CG2-CD2 3.99Å; V162-L164 HydrophobicContact CG2-CG 3.96Å; V162-L172 WeakPolarHBondContact O-CA 3.15Å; V162-A173 HydrophobicContact CG1-CB 3.99Å; V162-A173 WeakPolarHBondContact CG1-O 3.05Å; V162-A173 PolarHBondContact N-O 2.96Å; V162-A173 PolarHBondContact O-N 2.72Å; V162-V338 CarbonylContact C-O 3.6Å; V162-V338 WeakPolarHBondContact CA-O 3.24Å; V162-V338 HydrophobicContact CB-CB 4.43Å; V162-V338 HydrophobicContact CG2-CB 4.02Å; V162-V338 HydrophobicContact CG2-CG1 4.05Å
163	L	98.6	Very high	95.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	111.9	162.3	177	64.7	0	0	0	108.1	V165 L171 L172 F246 T317 L337 V338 L339 S340 L353	L163-V165 HydrophobicContact CD1-CG1 3.88Å; L163-V165 HydrophobicContact CD2-CG1 4.36Å; L163-V165 HydrophobicContact CG-CG1 3.96Å; L163-L171 WeakPolarHBondContact CA-O 3.15Å; L163-L172 HydrophobicContact CB-CD2 3.92Å; L163-L172 HydrophobicContact CD1-CD2 3.78Å; L163-L172 HydrophobicContact CD1-CG 3.76Å; L163-L172 HydrophobicContact CG-CD2 4.4Å; L163-F246 HydrophobicContact CD1-CE1 4.5Å; L163-F246 HydrophobicContact CD1-CE2 4.32Å; L163-F246 HydrophobicContact CD1-CZ 3.69Å; L163-T317 WeakPolarHBondContact CD2-OG1 3.47Å; L163-L337 HydrophobicContact CB-CD1 4.23Å; L163-V338 PolarHBondContact N-O 3.38Å; L163-L339 HydrophobicContact CB-CD1 4.16Å; L163-L339 HydrophobicContact CD2-CD1 3.82Å; L163-L339 HydrophobicContact CG-CD1 3.97Å; L163-L339 WeakPolarHBondContact O-CA 3.38Å; L163-S340 PolarHBondContact O-N 3.06Å; L163-L353 HydrophobicContact CD2-CD1 3.62Å; L163-L353 HydrophobicContact CD2-CD2 3.81Å; L163-L353 HydrophobicContact CD2-CG 4.4Å
164	L	97	Very high	95.5	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.016	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	115.5	175.1	-67.5	171.9	0	0	0	109	M143 H146 A147 V162 A170 L171 S340 L408	M143-L164 HydrophobicContact CB-CD1 3.99Å; M143-L164 HydrophobicContact SD-CD1 4.05Å; H146-L164 HydrophobicContact CB-CD2 3.76Å; A147-L164 HydrophobicContact CB-CD1 4.38Å; V162-L164 HydrophobicContact CG1-CG 4.33Å; V162-L164 HydrophobicContact CG2-CD2 3.99Å; V162-L164 HydrophobicContact CG2-CG 3.96Å; L164-A170 CarbonylContact O-C 3.58Å; L164-A170 WeakPolarHBondContact O-CA 3.18Å; L164-L171 HydrophobicContact CB-CB 4.3Å; L164-L171 HydrophobicContact CD1-CD1 4.4Å; L164-L171 PolarHBondContact N-O 3.27Å; L164-L171 PolarHBondContact O-N 3.26Å; L164-S340 WeakPolarHBondContact CA-O 3.48Å; L164-L408 HydrophobicContact CD1-CD2 4.06Å
165	V	96.3	Very high	95.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	114.9	179.5	-73.2	0	0	0	0	110.7	L163 H169 A170 P192 L313 L339 S340 G341 G342 V343 A344	L163-V165 HydrophobicContact CD1-CG1 3.88Å; L163-V165 HydrophobicContact CD2-CG1 4.36Å; L163-V165 HydrophobicContact CG-CG1 3.96Å; V165-H169 WeakPolarHBondContact CA-O 3.24Å; V165-A170 HydrophobicContact CG1-CB 4.22Å; V165-P192 HydrophobicContact CB-CG 4.18Å; V165-P192 HydrophobicContact CG1-CG 4.2Å; V165-L313 HydrophobicContact CG1-CD1 4.22Å; V165-L313 HydrophobicContact CG1-CD2 3.7Å; V165-L339 HydrophobicContact CG2-CD1 3.75Å; V165-S340 PolarHBondContact N-O 3.41Å; V165-G341 CarbonylContact O-C 3.55Å; V165-G341 VanDerWaalsContact O-CA 3.27Å; V165-G341 WeakPolarHBondContact O-CA 3.29Å; V165-G342 PolarHBondContact O-N 3.31Å; V165-V343 HydrophobicContact CB-CB 3.98Å; V165-V343 HydrophobicContact CB-CG1 4.29Å; V165-V343 HydrophobicContact CG2-CB 3.99Å; V165-V343 HydrophobicContact CG2-CG1 4.21Å; V165-V343 WeakPolarHBondContact O-CB 3.46Å; V165-V343 PolarHBondContact O-N 2.92Å; V165-A344 HydrophobicContact CG2-CB 4.36Å
166	S	92.5	Very high	96.3	Very high	15 Å²	15	26.2 Å²	26.2	11%	0.105	15%	0.146	C	C	.	.			trans	-135.7	-171.2	-177.7	73.6	0	0	0	0	111.7	G168 H169 G193	S166-G168 VanDerWaalsContact C-N 3.3Å; S166-G168 PolarHBondContact OG-N 3.24Å; S166-H169 PolarHBondContact N-O 2.86Å; S166-H169 PolarHBondContact OG-N 3.39Å; S166-H169 VanDerWaalsContact OG-N 3.1Å; S166-G193 PolarHBondContact O-N 3.09Å
167	G	88.1	Confident	96.4	Very high	37 Å²	37	25.9 Å²	25.9	38%	0.381	15%	0.147	S	C	.	.	S	Bend	trans	-60.8	-37.6	170.7	0	0	0	0	0	112.8	A191 D194	G167-A191 VanDerWaalsContact O-CB 3.28Å; G167-A191 WeakPolarHBondContact O-CB 3.37Å; G167-D194 VanDerWaalsContact O-CB 3.3Å; G167-D194 WeakPolarHBondContact O-CB 3.19Å; G167-D194 PolarHBondContact O-N 3.02Å
168	G	87.8	Confident	96.5	Very high	50 Å²	50	18.7 Å²	18.7	52%	0.515	11%	0.114	S	C	.	.	S	Bend	trans	-108	-11.3	-175.2	0	0	0	0	0	115.6	S166	S166-G168 VanDerWaalsContact C-N 3.3Å; S166-G168 PolarHBondContact OG-N 3.24Å
169	H	91.8	Very high	96.4	Very high	52 Å²	52	20 Å²	20	24%	0.241	12%	0.123	C	C	.	.			trans	-136.5	144.2	-171.1	-56.6	89.2	0	0	0	112.6	M143 V165 S166 L171 A191	M143-H169 HydrophobicContact SD-CB 3.97Å; V165-H169 WeakPolarHBondContact CA-O 3.24Å; S166-H169 PolarHBondContact N-O 2.86Å; S166-H169 PolarHBondContact OG-N 3.39Å; S166-H169 VanDerWaalsContact OG-N 3.1Å; H169-L171 HydrophobicContact CB-CD1 4.42Å; H169-L171 HydrophobicContact CB-CG 4.48Å; H169-A191 VanDerWaalsContact N-CB 3.34Å
170	A	96.1	Very high	96.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	115.7	156.3	0	0	0	0	0	108.1	L164 V165 R186 T187 P192 F246 F248	L164-A170 CarbonylContact O-C 3.58Å; L164-A170 WeakPolarHBondContact O-CA 3.18Å; V165-A170 HydrophobicContact CG1-CB 4.22Å; A170-R186 CarbonylContact O-C 3.53Å; A170-R186 VanDerWaalsContact O-CA 3.29Å; A170-R186 WeakPolarHBondContact O-CA 3.29Å; A170-T187 PolarHBondContact O-N 2.86Å; A170-P192 HydrophobicContact CB-CG 4.18Å; A170-F246 HydrophobicContact CB-CB 4.22Å; A170-F246 HydrophobicContact CB-CD2 3.75Å; A170-F246 HydrophobicContact CB-CE2 4.25Å; A170-F246 HydrophobicContact CB-CG 3.99Å; A170-F248 HydrophobicContact CB-CE2 4.3Å
171	L	97.2	Very high	96.4	Very high	20 Å²	20	20.9 Å²	20.9	11%	0.105	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	140.3	-174.4	-54.8	165.5	0	0	0	110.1	M143 L163 L164 H169 L183 G185 R186	M143-L171 HydrophobicContact CB-CD1 4.49Å; M143-L171 HydrophobicContact CG-CD1 3.89Å; M143-L171 HydrophobicContact SD-CD1 3.74Å; L163-L171 WeakPolarHBondContact CA-O 3.15Å; L164-L171 HydrophobicContact CB-CB 4.3Å; L164-L171 HydrophobicContact CD1-CD1 4.4Å; L164-L171 PolarHBondContact N-O 3.27Å; L164-L171 PolarHBondContact O-N 3.26Å; H169-L171 HydrophobicContact CB-CD1 4.42Å; H169-L171 HydrophobicContact CB-CG 4.48Å; L171-L183 HydrophobicContact CB-CD1 4.28Å; L171-L183 HydrophobicContact CD2-CD1 4Å; L171-G185 CarbonylContact C-O 3.56Å; L171-G185 WeakPolarHBondContact CA-O 3.31Å; L171-R186 HydrophobicContact CD2-CB 3.46Å; L171-R186 VanDerWaalsContact CD2-CB 3.46Å
172	L	98.4	Very high	96.4	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	123.3	166.8	-84.2	162.5	0	0	0	108.1	L161 V162 L163 L184 G185 C244 F246 R316 T317 A320	L161-L172 HydrophobicContact CD1-CD2 4.46Å; V162-L172 WeakPolarHBondContact O-CA 3.15Å; L163-L172 HydrophobicContact CB-CD2 3.92Å; L163-L172 HydrophobicContact CD1-CD2 3.78Å; L163-L172 HydrophobicContact CD1-CG 3.76Å; L163-L172 HydrophobicContact CG-CD2 4.4Å; L172-L184 HydrophobicContact CB-CB 4.25Å; L172-L184 WeakPolarHBondContact O-CA 3.49Å; L172-L184 WeakPolarHBondContact O-CB 3.1Å; L172-L184 PolarHBondContact O-N 2.77Å; L172-G185 PolarHBondContact N-O 2.97Å; L172-G185 PolarHBondContact O-N 2.82Å; L172-G185 VanDerWaalsContact O-N 3.17Å; L172-C244 HydrophobicContact CD1-CB 4.01Å; L172-F246 HydrophobicContact CD1-CE1 4.42Å; L172-F246 HydrophobicContact CD1-CE2 3.94Å; L172-F246 HydrophobicContact CD1-CZ 3.44Å; L172-F246 VanDerWaalsContact CD1-CZ 3.44Å; L172-F246 HydrophobicContact CG-CE2 4.04Å; L172-F246 HydrophobicContact CG-CZ 3.78Å; L172-R316 HydrophobicContact CD1-CB 4.07Å; L172-T317 HydrophobicContact CD2-CG2 4.26Å; L172-A320 HydrophobicContact CD1-CB 3.95Å; L172-A320 HydrophobicContact CD2-CB 4.16Å; L172-A320 HydrophobicContact CG-CB 4.46Å
173	A	98.7	Very high	96.4	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	154.7	179.8	0	0	0	0	0	112.1	L161 V162 L182 L408	L161-A173 WeakPolarHBondContact CD1-O 3.28Å; V162-A173 HydrophobicContact CG1-CB 3.99Å; V162-A173 WeakPolarHBondContact CG1-O 3.05Å; V162-A173 PolarHBondContact N-O 2.96Å; V162-A173 PolarHBondContact O-N 2.72Å; A173-L182 CarbonylContact C-O 3.6Å; A173-L182 WeakPolarHBondContact CA-O 3.31Å; A173-L182 WeakPolarHBondContact CB-O 3.42Å; A173-L408 HydrophobicContact CB-CD2 3.97Å
174	V	98.8	Very high	96.4	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120.4	166.2	-175.7	0	0	0	0	107.9	P159 F160 L161 R176 F181 L182 L184 C324 L329	P159-V174 HydrophobicContact CB-CG1 3.99Å; F160-V174 WeakPolarHBondContact O-CA 3.45Å; L161-V174 HydrophobicContact CD1-CG2 4.39Å; V174-R176 HydrophobicContact CG1-CG 4.11Å; V174-F181 CarbonylContact O-C 3.59Å; V174-F181 VanDerWaalsContact O-CA 3.31Å; V174-F181 WeakPolarHBondContact O-CA 3.4Å; V174-L182 HydrophobicContact CB-CB 4.27Å; V174-L182 PolarHBondContact N-O 2.73Å; V174-L182 PolarHBondContact O-N 3.03Å; V174-L184 HydrophobicContact CG2-CD1 3.94Å; V174-L184 HydrophobicContact CG2-CD2 4.31Å; V174-L184 HydrophobicContact CG2-CG 4.31Å; V174-C324 VanDerWaalsContact CG2-SG 3.57Å; V174-L329 HydrophobicContact CG2-CB 4.34Å; V174-L329 HydrophobicContact CG2-CD1 4.38Å
175	A	98.7	Very high	96.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	116.7	169.5	0	0	0	0	0	108.4	F158 P159 F160 F181	F158-A175 HydrophobicContact CD1-CB 4.1Å; F158-A175 HydrophobicContact CE1-CB 4.05Å; P159-A175 CarbonylContact C-O 3.58Å; P159-A175 WeakPolarHBondContact CA-O 3.48Å; P159-A175 WeakPolarHBondContact CB-O 3.31Å; F160-A175 HydrophobicContact CD1-CB 4.36Å; F160-A175 HydrophobicContact CD2-CB 4.04Å; F160-A175 HydrophobicContact CE1-CB 3.98Å; F160-A175 HydrophobicContact CE2-CB 3.64Å; F160-A175 HydrophobicContact CG-CB 4.39Å; F160-A175 HydrophobicContact CZ-CB 3.61Å; F160-A175 PolarHBondContact N-O 3.5Å; F160-A175 PolarHBondContact O-N 3.25Å; A175-F181 HydrophobicContact CB-CD1 3.86Å; A175-F181 HydrophobicContact CB-CE1 3.47Å; A175-F181 VanDerWaalsContact CB-CE1 3.47Å; A175-F181 HydrophobicContact CB-CZ 4.13Å
176	R	98.5	Very high	96.5	Very high	112 Å²	112	26.6 Å²	26.6	42%	0.423	15%	0.148	S	C	.	.			trans	-105.4	-18.4	177.6	-61.4	-168.3	-56.8	-166.4	-4.4	112.9	F158 P159 V174 D180	F158-R176 VanDerWaalsContact CB-O 3.3Å; F158-R176 WeakPolarHBondContact CB-O 3.28Å; P159-R176 HydrophobicContact CB-CG 4.4Å; V174-R176 HydrophobicContact CG1-CG 4.11Å; R176-D180 HydrophobicContact CB-CB 4.33Å; R176-D180 WeakPolarHBondContact CB-OD2 3.38Å; R176-D180 IonicContact CZ-OD1 3.82Å; R176-D180 IonicContact CZ-OD2 3.87Å; R176-D180 PolarHBondContact N-O 2.86Å; R176-D180 IonicContact NE-OD1 3.93Å; R176-D180 PolarHBondContact NE-OD1 2.99Å; R176-D180 IonicContact NE-OD2 2.69Å; R176-D180 PolarHBondContact NE-OD2 3.39Å; R176-D180 IonicContact NH2-OD1 3.74Å; R176-D180 PolarHBondContact NH2-OD1 3Å; R176-D180 IonicContact NH2-OD2 3.62Å; R176-D180 PolarHBondContact NH2-OD2 3.13Å
177	G	98.1	Very high	96.6	Very high	10 Å²	10	27.3 Å²	27.3	10%	0.103	15%	0.152	C	C	.	.	S	Bend	trans	-162.2	-171.8	175.6	0	0	0	0	0	110.7	F158 D179 D180	F158-G177 VanDerWaalsContact CE1-O 3.29Å; F158-G177 WeakPolarHBondContact CE1-O 3.47Å; F158-G177 WeakPolarHBondContact CZ-O 3.34Å; G177-D179 VanDerWaalsContact C-N 3.33Å; G177-D179 PolarHBondContact O-N 3.03Å; G177-D180 PolarHBondContact N-O 3.46Å; G177-D180 VanDerWaalsContact N-O 3.16Å
178	V	97.8	Very high	96.9	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	16%	0.158	C	C	.	.	S	Bend	trans	-66.5	-34.7	-178.3	174.8	0	0	0	0	112.3	L148 F158 F181 E385 R386 E389 I391	L148-V178 HydrophobicContact CD1-CB 4.33Å; L148-V178 HydrophobicContact CD1-CG1 3.9Å; F158-V178 HydrophobicContact CE2-CG2 4.17Å; F158-V178 HydrophobicContact CZ-CG2 4.16Å; V178-F181 WeakPolarHBondContact O-CE2 3.42Å; V178-E385 HydrophobicContact CG1-CB 3.88Å; V178-E385 HydrophobicContact CG2-CB 3.72Å; V178-R386 HydrophobicContact CG1-CG 3.67Å; V178-E389 VanDerWaalsContact CG2-CD 3.42Å; V178-E389 HydrophobicContact CG2-CG 4.3Å; V178-E389 VanDerWaalsContact CG2-OE1 3.32Å; V178-E389 WeakPolarHBondContact CG2-OE1 3.24Å; V178-I391 HydrophobicContact CB-CD1 4.16Å; V178-I391 HydrophobicContact CG1-CD1 4.27Å
179	D	96.8	Very high	97.2	Very high	80 Å²	80	31.1 Å²	31.1	43%	0.428	15%	0.151	S	C	.	.	S	Bend	trans	-127.5	15.3	176.2	68.7	-13.3	0	0	0	113.2	G177 R386 I391	G177-D179 VanDerWaalsContact C-N 3.33Å; G177-D179 PolarHBondContact O-N 3.03Å; D179-R386 IonicContact OD2-NH1 2.89Å; D179-I391 HydrophobicContact CB-CD1 4.39Å
180	D	98.2	Very high	97.2	Very high	55 Å²	55	29.3 Å²	29.3	29%	0.294	14%	0.142	S	C	.	.			trans	-112.9	106.8	178.1	-179.1	18.3	0	0	0	111.1	R176 G177	R176-D180 HydrophobicContact CB-CB 4.33Å; R176-D180 WeakPolarHBondContact CB-OD2 3.38Å; R176-D180 IonicContact CZ-OD1 3.82Å; R176-D180 IonicContact CZ-OD2 3.87Å; R176-D180 PolarHBondContact N-O 2.86Å; R176-D180 IonicContact NE-OD1 3.93Å; R176-D180 PolarHBondContact NE-OD1 2.99Å; R176-D180 IonicContact NE-OD2 2.69Å; R176-D180 PolarHBondContact NE-OD2 3.39Å; R176-D180 IonicContact NH2-OD1 3.74Å; R176-D180 PolarHBondContact NH2-OD1 3Å; R176-D180 IonicContact NH2-OD2 3.62Å; R176-D180 PolarHBondContact NH2-OD2 3.13Å; G177-D180 PolarHBondContact N-O 3.46Å; G177-D180 VanDerWaalsContact N-O 3.16Å
181	F	98.7	Very high	97.1	Very high	1 Å²	1	29.5 Å²	29.5	0%	0.004	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.7	-178.2	-67.9	-101.8	0	0	0	111.5	E144 A147 L148 V174 A175 V178 L408 G409 V410	E144-F181 HydrophobicContact CB-CE2 4.13Å; E144-F181 HydrophobicContact CB-CZ 4.27Å; E144-F181 HydrophobicContact CG-CD2 4.14Å; E144-F181 HydrophobicContact CG-CE2 3.63Å; E144-F181 HydrophobicContact CG-CZ 4.18Å; A147-F181 HydrophobicContact CB-CE1 3.75Å; A147-F181 HydrophobicContact CB-CZ 4.13Å; L148-F181 HydrophobicContact CD2-CZ 4.22Å; L148-F181 HydrophobicContact CG-CZ 4.45Å; V174-F181 CarbonylContact O-C 3.59Å; V174-F181 VanDerWaalsContact O-CA 3.31Å; V174-F181 WeakPolarHBondContact O-CA 3.4Å; A175-F181 HydrophobicContact CB-CD1 3.86Å; A175-F181 HydrophobicContact CB-CE1 3.47Å; A175-F181 VanDerWaalsContact CB-CE1 3.47Å; A175-F181 HydrophobicContact CB-CZ 4.13Å; V178-F181 WeakPolarHBondContact O-CE2 3.42Å; F181-L408 HydrophobicContact CB-CD1 4.23Å; F181-L408 HydrophobicContact CB-CG 4.08Å; F181-L408 HydrophobicContact CD1-CD1 4.11Å; F181-L408 HydrophobicContact CD1-CD2 4.14Å; F181-L408 HydrophobicContact CD1-CG 4.24Å; F181-L408 HydrophobicContact CD2-CD1 4.02Å; F181-L408 HydrophobicContact CE1-CD1 4.49Å; F181-L408 HydrophobicContact CE2-CD1 4.44Å; F181-L408 HydrophobicContact CG-CD1 3.86Å; F181-L408 HydrophobicContact CG-CG 4.12Å; F181-G409 CarbonylContact O-C 3.55Å; F181-G409 VanDerWaalsContact O-CA 3.25Å; F181-G409 WeakPolarHBondContact O-CA 3.27Å; F181-V410 PolarHBondContact O-N 3.19Å
182	L	98.7	Very high	97.1	Very high	14 Å²	14	28.5 Å²	28.5	7%	0.073	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	114.6	168.5	-61.7	178	0	0	0	109.6	A173 V174 L184 L329 V410 I412	A173-L182 CarbonylContact C-O 3.6Å; A173-L182 WeakPolarHBondContact CA-O 3.31Å; A173-L182 WeakPolarHBondContact CB-O 3.42Å; V174-L182 HydrophobicContact CB-CB 4.27Å; V174-L182 PolarHBondContact N-O 2.73Å; V174-L182 PolarHBondContact O-N 3.03Å; L182-L184 PolarHBondContact O-N 3Å; L182-L329 HydrophobicContact CD1-CD2 4.31Å; L182-V410 HydrophobicContact CD2-CB 4.13Å; L182-I412 HydrophobicContact CB-CD1 3.9Å; L182-I412 HydrophobicContact CB-CG1 4.28Å; L182-I412 HydrophobicContact CD1-CD1 4.13Å; L182-I412 HydrophobicContact CG-CD1 4.45Å
183	L	98.6	Very high	96.9	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.016	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	117.2	178.7	-178.7	70.8	0	0	0	110.5	L171 G185 R186 L408 V410 D411 I412 T413	L171-L183 HydrophobicContact CB-CD1 4.28Å; L171-L183 HydrophobicContact CD2-CD1 4Å; L183-G185 WeakPolarHBondContact CD1-O 3.49Å; L183-R186 HydrophobicContact CD2-CB 4.45Å; L183-L408 WeakPolarHBondContact CB-O 3.48Å; L183-V410 PolarHBondContact N-O 3.41Å; L183-D411 HydrophobicContact CD2-CB 4.47Å; L183-I412 VanDerWaalsContact O-CG1 3.27Å; L183-I412 WeakPolarHBondContact O-CG1 3.44Å; L183-I412 PolarHBondContact O-N 3.03Å; L183-T413 PolarHBondContact O-N 3.17Å
184	L	98.5	Very high	96.6	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-29.2	-179.6	-53.4	-177.5	0	0	0	112.5	L161 L172 V174 L182 C244 A320 F323 I412 T413 V416	L161-L184 HydrophobicContact CD1-CD1 3.69Å; L172-L184 HydrophobicContact CB-CB 4.25Å; L172-L184 WeakPolarHBondContact O-CA 3.49Å; L172-L184 WeakPolarHBondContact O-CB 3.1Å; L172-L184 PolarHBondContact O-N 2.77Å; V174-L184 HydrophobicContact CG2-CD1 3.94Å; V174-L184 HydrophobicContact CG2-CD2 4.31Å; V174-L184 HydrophobicContact CG2-CG 4.31Å; L182-L184 PolarHBondContact O-N 3Å; L184-C244 WeakPolarHBondContact O-CB 3.37Å; L184-A320 HydrophobicContact CD1-CB 3.84Å; L184-F323 HydrophobicContact CD2-CD1 4.03Å; L184-F323 HydrophobicContact CD2-CE1 3.95Å; L184-I412 HydrophobicContact CD2-CD1 3.55Å; L184-I412 HydrophobicContact CD2-CG1 3.83Å; L184-T413 WeakPolarHBondContact O-CG2 3.4Å; L184-V416 HydrophobicContact CB-CG2 4.14Å; L184-V416 HydrophobicContact CD2-CG2 4.05Å
185	G	97.8	Very high	96.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.4	145.9	-173.4	0	0	0	0	0	111.9	L171 L172 L183 C244	L171-G185 CarbonylContact C-O 3.56Å; L171-G185 WeakPolarHBondContact CA-O 3.31Å; L172-G185 PolarHBondContact N-O 2.97Å; L172-G185 PolarHBondContact O-N 2.82Å; L172-G185 VanDerWaalsContact O-N 3.17Å; L183-G185 WeakPolarHBondContact CD1-O 3.49Å; G185-C244 WeakPolarHBondContact CA-O 3.27Å
186	R	96.9	Very high	96.3	Very high	107 Å²	107	31.4 Å²	31.4	40%	0.404	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	162.9	175.9	62.5	176.7	177.3	-162.8	-4.8	111.6	A170 L171 L183 C245 F246 D411	A170-R186 CarbonylContact O-C 3.53Å; A170-R186 VanDerWaalsContact O-CA 3.29Å; A170-R186 WeakPolarHBondContact O-CA 3.29Å; L171-R186 HydrophobicContact CD2-CB 3.46Å; L171-R186 VanDerWaalsContact CD2-CB 3.46Å; L183-R186 HydrophobicContact CD2-CB 4.45Å; R186-C245 CarbonylContact O-C 3.55Å; R186-C245 VanDerWaalsContact O-CA 3.3Å; R186-C245 WeakPolarHBondContact O-CA 3.47Å; R186-C245 WeakPolarHBondContact O-CB 3.36Å; R186-F246 PolarHBondContact O-N 3.27Å; R186-D411 IonicContact CZ-OD2 3.99Å; R186-D411 IonicContact NH1-OD2 3.66Å; R186-D411 IonicContact NH2-OD2 3.81Å
187	T	95.2	Very high	96	Very high	29 Å²	29	28.5 Å²	28.5	18%	0.178	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-64.8	138.7	167.9	-157.4	0	0	0	0	110.5	A170 E190	A170-T187 PolarHBondContact O-N 2.86Å; T187-E190 PolarHBondContact OG1-O 3.36Å
188	L	94.6	Very high	95.8	Very high	97 Å²	97	30.9 Å²	30.9	51%	0.508	16%	0.156	S	C	.	.	S	Bend	trans	-100.6	-19.5	179.1	-58.1	179.8	0	0	0	112.4	M238 C245 F246	L188-M238 HydrophobicContact CD1-CE 3.68Å; L188-M238 HydrophobicContact CD1-SD 4.2Å; L188-C245 HydrophobicContact CD1-CB 3.91Å; L188-C245 HydrophobicContact CD2-CB 4.13Å; L188-C245 HydrophobicContact CG-CB 3.93Å; L188-F246 PolarHBondContact N-O 2.78Å
189	D	93.2	Very high	95.7	Very high	70 Å²	70	31 Å²	31	37%	0.374	16%	0.157	S	C	.	.	S	Bend	trans	-127.8	-104.2	179.9	54.4	35.4	0	0	0	111.9	S247 F248 A249	D189-S247 VanDerWaalsContact OD1-CA 3.25Å; D189-S247 WeakPolarHBondContact OD1-CA 3.48Å; D189-S247 VanDerWaalsContact OD2-CB 3.3Å; D189-S247 WeakPolarHBondContact OD2-CB 3.49Å; D189-S247 PolarHBondContact OD2-OG 3.18Å; D189-F248 PolarHBondContact OD1-N 2.54Å; D189-F248 PolarHBondContact OD2-N 3.48Å; D189-A249 HydrophobicContact CB-CB 4.04Å; D189-A249 PolarHBondContact OD1-N 2.89Å; D189-A249 WeakPolarHBondContact OD2-CB 3.45Å; D189-A249 PolarHBondContact OD2-N 2.87Å
190	E	92.1	Very high	95.5	Very high	14 Å²	14	27.4 Å²	27.4	7%	0.065	14%	0.138	C	C	.	.			trans	-100.1	159.4	175.1	56.9	-179.8	-157.3	0	0	110.9	T187 T195 K198 F248 A249 R252	T187-E190 PolarHBondContact OG1-O 3.36Å; E190-T195 VanDerWaalsContact CD-OG1 3.22Å; E190-T195 WeakPolarHBondContact CG-OG1 3.32Å; E190-T195 PolarHBondContact OE1-OG1 2.93Å; E190-K198 IonicContact OE2-NZ 2.78Å; E190-K198 PolarHBondContact OE2-NZ 3.27Å; E190-F248 HydrophobicContact CG-CB 4.23Å; E190-F248 WeakPolarHBondContact O-CD2 3.3Å; E190-A249 HydrophobicContact CG-CB 4.11Å; E190-A249 WeakPolarHBondContact OE1-CA 3.21Å; E190-R252 WeakPolarHBondContact OE1-CB 3.45Å; E190-R252 WeakPolarHBondContact OE1-CD 3.06Å; E190-R252 IonicContact OE1-NH1 3.19Å; E190-R252 IonicContact OE2-CZ 2.72Å; E190-R252 IonicContact OE2-NH1 3.97Å; E190-R252 PolarHBondContact OE2-NH1 3.36Å
191	A	94.2	Very high	95.2	Very high	4 Å²	4	30.5 Å²	30.5	3%	0.033	15%	0.146	C	C	.	.			trans	-87.5	158.5	178.7	0	0	0	0	0	111.2	G167 H169 G193 D194 T195	G167-A191 VanDerWaalsContact O-CB 3.28Å; G167-A191 WeakPolarHBondContact O-CB 3.37Å; H169-A191 VanDerWaalsContact N-CB 3.34Å; A191-G193 VanDerWaalsContact C-N 3.29Å; A191-G193 PolarHBondContact O-N 3.15Å; A191-D194 PolarHBondContact O-N 3.4Å; A191-T195 PolarHBondContact O-N 3.15Å; A191-T195 PolarHBondContact O-OG1 3.03Å
192	P	96	Very high	94.8	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-62.1	-36.3	-175	22.3	-31.7	0	0	0	112.4	V165 A170 T195 L196 F248 V309 V343	V165-P192 HydrophobicContact CB-CG 4.18Å; V165-P192 HydrophobicContact CG1-CG 4.2Å; A170-P192 HydrophobicContact CB-CG 4.18Å; P192-T195 PolarHBondContact O-N 3.1Å; P192-L196 WeakPolarHBondContact O-CG 3.43Å; P192-L196 PolarHBondContact O-N 3.37Å; P192-F248 HydrophobicContact CB-CD1 4.36Å; P192-F248 HydrophobicContact CB-CD2 4.41Å; P192-F248 HydrophobicContact CB-CE1 3.92Å; P192-F248 HydrophobicContact CB-CE2 3.96Å; P192-F248 HydrophobicContact CB-CZ 3.71Å; P192-F248 HydrophobicContact CG-CE2 4.08Å; P192-F248 HydrophobicContact CG-CZ 4.08Å; P192-V309 HydrophobicContact CB-CG1 4Å; P192-V343 HydrophobicContact CB-CG1 4.45Å; P192-V343 HydrophobicContact CG-CG1 4.46Å; P192-V343 HydrophobicContact CG-CG2 4.34Å
193	G	94.4	Very high	94.5	Very high	6 Å²	6	31.8 Å²	31.8	6%	0.062	15%	0.15	C	C	.	.	H	α-helix	trans	-66	-44.5	177.7	0	0	0	0	0	112	S166 A191 T195 L196 D197 V343	S166-G193 PolarHBondContact O-N 3.09Å; A191-G193 VanDerWaalsContact C-N 3.29Å; A191-G193 PolarHBondContact O-N 3.15Å; G193-T195 PolarHBondContact O-N 3.11Å; G193-L196 PolarHBondContact O-N 3.18Å; G193-D197 WeakPolarHBondContact O-CB 3.3Å; G193-D197 PolarHBondContact O-N 3.29Å; G193-V343 VanDerWaalsContact CA-CG2 3.45Å
194	D	92.8	Very high	94.1	Very high	51 Å²	51	32.7 Å²	32.7	27%	0.273	16%	0.157	S	C	.	.	H	α-helix	trans	-62.1	-40.7	174.8	-179.2	37.8	0	0	0	112.1	G167 A191 D197 K198	G167-D194 VanDerWaalsContact O-CB 3.3Å; G167-D194 WeakPolarHBondContact O-CB 3.19Å; G167-D194 PolarHBondContact O-N 3.02Å; A191-D194 PolarHBondContact O-N 3.4Å; D194-D197 PolarHBondContact O-N 3.43Å; D194-K198 WeakPolarHBondContact O-CB 3.36Å; D194-K198 VanDerWaalsContact O-CG 3.31Å; D194-K198 WeakPolarHBondContact O-CG 3.47Å; D194-K198 PolarHBondContact O-N 3.41Å; D194-K198 WeakPolarHBondContact OD1-CE 3.46Å; D194-K198 IonicContact OD1-NZ 3.73Å; D194-K198 PolarHBondContact OD1-NZ 3.1Å; D194-K198 WeakPolarHBondContact OD2-CE 3.1Å; D194-K198 IonicContact OD2-NZ 3Å; D194-K198 PolarHBondContact OD2-NZ 2.98Å
195	T	95.3	Very high	93.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60.3	-46.8	172.4	-62	0	0	0	0	112.1	E190 A191 P192 G193 D197 K198 V199 F248 R252	E190-T195 VanDerWaalsContact CD-OG1 3.22Å; E190-T195 WeakPolarHBondContact CG-OG1 3.32Å; E190-T195 PolarHBondContact OE1-OG1 2.93Å; A191-T195 PolarHBondContact O-N 3.15Å; A191-T195 PolarHBondContact O-OG1 3.03Å; P192-T195 PolarHBondContact O-N 3.1Å; G193-T195 PolarHBondContact O-N 3.11Å; T195-D197 VanDerWaalsContact C-N 3.33Å; T195-D197 PolarHBondContact O-N 3.1Å; T195-K198 PolarHBondContact O-N 3.02Å; T195-V199 HydrophobicContact CG2-CG2 4.42Å; T195-V199 WeakPolarHBondContact O-CB 3.33Å; T195-V199 VanDerWaalsContact O-CG2 3.31Å; T195-V199 WeakPolarHBondContact O-CG2 3.5Å; T195-V199 PolarHBondContact O-N 2.73Å; T195-F248 HydrophobicContact CG2-CB 4.19Å; T195-F248 WeakPolarHBondContact OG1-CB 3.28Å; T195-R252 HydrophobicContact CG2-CB 4.1Å
196	L	96.1	Very high	93.3	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-62.6	-41.3	178.2	-69.5	168.5	0	0	0	111.4	P192 G193 V199 A200 I220 T305 V309	P192-L196 WeakPolarHBondContact O-CG 3.43Å; P192-L196 PolarHBondContact O-N 3.37Å; G193-L196 PolarHBondContact O-N 3.18Å; L196-V199 PolarHBondContact O-N 3.08Å; L196-A200 VanDerWaalsContact O-CB 3.31Å; L196-A200 WeakPolarHBondContact O-CB 3.31Å; L196-A200 PolarHBondContact O-N 2.85Å; L196-I220 HydrophobicContact CD2-CB 4.41Å; L196-I220 HydrophobicContact CD2-CG2 3.93Å; L196-T305 HydrophobicContact CD2-CG2 4.29Å; L196-V309 HydrophobicContact CD2-CG2 4.26Å
197	D	93.2	Very high	92.9	Very high	52 Å²	52	39.2 Å²	39.2	28%	0.278	19%	0.185	S	C	.	.	H	α-helix	trans	-65.6	-41.1	177.7	-74.1	-20.9	0	0	0	112.5	G193 D194 T195 R201 G216 G217	G193-D197 WeakPolarHBondContact O-CB 3.3Å; G193-D197 PolarHBondContact O-N 3.29Å; D194-D197 PolarHBondContact O-N 3.43Å; T195-D197 VanDerWaalsContact C-N 3.33Å; T195-D197 PolarHBondContact O-N 3.1Å; D197-R201 WeakPolarHBondContact O-CB 3.37Å; D197-R201 PolarHBondContact O-N 2.99Å; D197-G216 WeakPolarHBondContact OD1-CA 3.25Å; D197-G216 PolarHBondContact OD1-N 3.48Å; D197-G217 PolarHBondContact OD1-N 2.87Å
198	K	92.7	Very high	92.6	Very high	60 Å²	60	39.9 Å²	39.9	26%	0.261	19%	0.188	S	C	.	.	H	α-helix	trans	-66.4	-41.3	174.7	-75.9	166.8	173.4	162	0	112.3	E190 D194 T195 R201 R202	E190-K198 IonicContact OE2-NZ 2.78Å; E190-K198 PolarHBondContact OE2-NZ 3.27Å; D194-K198 WeakPolarHBondContact O-CB 3.36Å; D194-K198 VanDerWaalsContact O-CG 3.31Å; D194-K198 WeakPolarHBondContact O-CG 3.47Å; D194-K198 PolarHBondContact O-N 3.41Å; D194-K198 WeakPolarHBondContact OD1-CE 3.46Å; D194-K198 IonicContact OD1-NZ 3.73Å; D194-K198 PolarHBondContact OD1-NZ 3.1Å; D194-K198 WeakPolarHBondContact OD2-CE 3.1Å; D194-K198 IonicContact OD2-NZ 3Å; D194-K198 PolarHBondContact OD2-NZ 2.98Å; T195-K198 PolarHBondContact O-N 3.02Å; K198-R201 PolarHBondContact O-N 3.36Å; K198-R202 PolarHBondContact O-N 3.46Å
199	V	95.1	Very high	92.5	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.012	20%	0.201	C	C	.	.	H	α-helix	trans	-64.9	-46.4	175.9	169.7	0	0	0	0	110.7	T195 L196 R201 R202 L203 I220 V255 T305	T195-V199 HydrophobicContact CG2-CG2 4.42Å; T195-V199 WeakPolarHBondContact O-CB 3.33Å; T195-V199 VanDerWaalsContact O-CG2 3.31Å; T195-V199 WeakPolarHBondContact O-CG2 3.5Å; T195-V199 PolarHBondContact O-N 2.73Å; L196-V199 PolarHBondContact O-N 3.08Å; V199-R201 PolarHBondContact O-N 3.29Å; V199-R202 PolarHBondContact O-N 3.37Å; V199-R202 VanDerWaalsContact O-N 3.11Å; V199-L203 HydrophobicContact CG1-CD1 3.86Å; V199-L203 HydrophobicContact CG1-CG 4.4Å; V199-L203 WeakPolarHBondContact O-CG 3.49Å; V199-L203 PolarHBondContact O-N 3.04Å; V199-I220 HydrophobicContact CG1-CD1 3.9Å; V199-V255 HydrophobicContact CB-CG1 4.47Å; V199-V255 HydrophobicContact CG1-CG1 3.71Å; V199-V255 HydrophobicContact CG2-CB 4.19Å; V199-V255 HydrophobicContact CG2-CG1 3.93Å; V199-V255 HydrophobicContact CG2-CG2 4.47Å; V199-T305 HydrophobicContact CG1-CG2 4.17Å; V199-T305 HydrophobicContact CG2-CG2 4.27Å
200	A	94.3	Very high	92.4	Very high	5 Å²	5	45.1 Å²	45.1	4%	0.041	21%	0.211	C	C	.	.	H	α-helix	trans	-57.9	-38.7	175.9	0	0	0	0	0	112.2	L196 S204 L205 I220	L196-A200 VanDerWaalsContact O-CB 3.31Å; L196-A200 WeakPolarHBondContact O-CB 3.31Å; L196-A200 PolarHBondContact O-N 2.85Å; A200-S204 PolarHBondContact O-N 3.3Å; A200-L205 HydrophobicContact CB-CD1 3.81Å; A200-L205 HydrophobicContact CB-CG 4.26Å; A200-L205 WeakPolarHBondContact O-CG 3.38Å; A200-L205 PolarHBondContact O-N 2.72Å; A200-L205 VanDerWaalsContact O-N 3.1Å; A200-I220 HydrophobicContact CB-CD1 4.41Å; A200-I220 HydrophobicContact CB-CG1 4.04Å
201	R	90.6	Very high	92.4	Very high	120 Å²	120	44.6 Å²	44.6	45%	0.453	21%	0.209	S	C	.	.	H	α-helix	trans	-65.7	-45.6	174.4	-169.6	178.5	-53.4	133.5	15.7	111.9	G71 D197 K198 V199 L203 S204	G71-R201 PolarHBondContact O-NE 2.88Å; G71-R201 PolarHBondContact O-NH1 2.94Å; G71-R201 VanDerWaalsContact O-NH1 3.09Å; G71-R201 PolarHBondContact O-NH2 3.11Å; D197-R201 WeakPolarHBondContact O-CB 3.37Å; D197-R201 PolarHBondContact O-N 2.99Å; K198-R201 PolarHBondContact O-N 3.36Å; V199-R201 PolarHBondContact O-N 3.29Å; R201-L203 VanDerWaalsContact C-N 3.28Å; R201-L203 PolarHBondContact O-N 2.95Å; R201-S204 WeakPolarHBondContact O-CA 3.35Å; R201-S204 PolarHBondContact O-N 3.39Å
202	R	91.8	Very high	92.1	Very high	38 Å²	38	46.9 Å²	46.9	14%	0.143	23%	0.228	C	C	.	.	H	α-helix	trans	-65.5	-31.6	-179.9	-175.3	57.8	-175.8	82.6	-4.3	112.9	K198 V199 S204 I259 E263 E291	K198-R202 PolarHBondContact O-N 3.46Å; V199-R202 PolarHBondContact O-N 3.37Å; V199-R202 VanDerWaalsContact O-N 3.11Å; R202-S204 PolarHBondContact O-N 2.94Å; R202-I259 HydrophobicContact CB-CD1 4.12Å; R202-I259 HydrophobicContact CG-CD1 3.67Å; R202-I259 HydrophobicContact CG-CG2 4.31Å; R202-E263 IonicContact CZ-OE1 3.4Å; R202-E263 IonicContact CZ-OE2 2.77Å; R202-E263 IonicContact NH1-OE1 3.81Å; R202-E263 PolarHBondContact NH1-OE1 2.77Å; R202-E263 IonicContact NH1-OE2 3.35Å; R202-E263 PolarHBondContact NH1-OE2 3.35Å; R202-E263 IonicContact NH2-OE1 2.67Å; R202-E263 IonicContact NH2-OE2 2.79Å; R202-E263 PolarHBondContact NH2-OE2 3.42Å; R202-E291 IonicContact NE-OE1 3.58Å
203	L	91.9	Very high	91.7	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.021	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-1.4	172	-70.9	172.2	0	0	0	113.4	V199 R201 L205 I220 I259 V298 I301	V199-L203 HydrophobicContact CG1-CD1 3.86Å; V199-L203 HydrophobicContact CG1-CG 4.4Å; V199-L203 WeakPolarHBondContact O-CG 3.49Å; V199-L203 PolarHBondContact O-N 3.04Å; R201-L203 VanDerWaalsContact C-N 3.28Å; R201-L203 PolarHBondContact O-N 2.95Å; L203-L205 HydrophobicContact CB-CD2 3.52Å; L203-L205 HydrophobicContact CB-CG 3.83Å; L203-L205 HydrophobicContact CD1-CD2 4.26Å; L203-L205 PolarHBondContact O-N 3.3Å; L203-L205 VanDerWaalsContact O-N 3.15Å; L203-I220 HydrophobicContact CD1-CD1 4Å; L203-I259 HydrophobicContact CD2-CD1 3.48Å; L203-I259 VanDerWaalsContact CD2-CD1 3.48Å; L203-I259 HydrophobicContact CD2-CG1 3.66Å; L203-I259 HydrophobicContact CG-CD1 3.71Å; L203-I259 HydrophobicContact CG-CG1 4.44Å; L203-V298 HydrophobicContact CB-CG2 4.26Å; L203-V298 HydrophobicContact CD1-CG2 4.26Å; L203-V298 HydrophobicContact CD2-CG2 4.28Å; L203-I301 HydrophobicContact CD1-CB 4.49Å; L203-I301 HydrophobicContact CD1-CG2 4.07Å; L203-I301 HydrophobicContact CD2-CB 4.35Å; L203-I301 HydrophobicContact CD2-CD1 4.06Å; L203-I301 HydrophobicContact CD2-CG2 4.09Å
204	S	90.8	Very high	91.5	Very high	23 Å²	23	52.8 Å²	52.8	16%	0.161	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	35.8	-178	-65.5	0	0	0	0	113.9	A200 R201 R202 R206 K207 G292	A200-S204 PolarHBondContact O-N 3.3Å; R201-S204 WeakPolarHBondContact O-CA 3.35Å; R201-S204 PolarHBondContact O-N 3.39Å; R202-S204 PolarHBondContact O-N 2.94Å; S204-R206 PolarHBondContact O-N 3.3Å; S204-K207 WeakPolarHBondContact O-CB 3.44Å; S204-K207 PolarHBondContact O-N 2.98Å; S204-G292 WeakPolarHBondContact CB-O 3.1Å; S204-G292 WeakPolarHBondContact OG-CA 3.36Å; S204-G292 PolarHBondContact OG-O 3.13Å; S204-G292 VanDerWaalsContact OG-O 3.11Å
205	L	91.1	Very high	91.3	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.01	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-58.4	-24.3	-174.1	-61	-167.7	0	0	0	113.2	A200 L203 K207 L208 C211 A219 I220 L223 V298	A200-L205 HydrophobicContact CB-CD1 3.81Å; A200-L205 HydrophobicContact CB-CG 4.26Å; A200-L205 WeakPolarHBondContact O-CG 3.38Å; A200-L205 PolarHBondContact O-N 2.72Å; A200-L205 VanDerWaalsContact O-N 3.1Å; L203-L205 HydrophobicContact CB-CD2 3.52Å; L203-L205 HydrophobicContact CB-CG 3.83Å; L203-L205 HydrophobicContact CD1-CD2 4.26Å; L203-L205 PolarHBondContact O-N 3.3Å; L203-L205 VanDerWaalsContact O-N 3.15Å; L205-K207 PolarHBondContact O-N 2.87Å; L205-L208 HydrophobicContact CD2-CD1 4.36Å; L205-L208 VanDerWaalsContact O-CB 3.27Å; L205-L208 WeakPolarHBondContact O-CB 3.48Å; L205-L208 PolarHBondContact O-N 3.04Å; L205-C211 HydrophobicContact CB-CB 4.32Å; L205-C211 WeakPolarHBondContact O-CB 3.39Å; L205-A219 HydrophobicContact CB-CB 4.27Å; L205-A219 HydrophobicContact CD1-CB 3.78Å; L205-I220 HydrophobicContact CD1-CD1 3.84Å; L205-I220 HydrophobicContact CD1-CG1 4.18Å; L205-L223 HydrophobicContact CD1-CD1 3.87Å; L205-L223 HydrophobicContact CD2-CD1 3.43Å; L205-L223 VanDerWaalsContact CD2-CD1 3.43Å; L205-L223 HydrophobicContact CG-CD1 4.17Å; L205-V298 HydrophobicContact CD2-CG2 3.27Å
206	R	86.9	Confident	91.2	Very high	103 Å²	103	52.1 Å²	52.1	39%	0.389	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-64.8	-22.7	176.9	-72.2	-172.6	175	-164.4	19.7	115.1	L68 S204 L208	L68-R206 VanDerWaalsContact CB-NH2 3.31Å; L68-R206 PolarHBondContact O-NH1 2.78Å; L68-R206 PolarHBondContact O-NH2 2.78Å; S204-R206 PolarHBondContact O-N 3.3Å; R206-L208 PolarHBondContact O-N 3.1Å
207	K	88.7	Confident	91.1	Very high	139 Å²	139	52.7 Å²	52.7	60%	0.604	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-68.3	-18.5	173.1	-65.4	-173.6	177.5	-179.4	0	111.4	S204 L205 G292 V294	S204-K207 WeakPolarHBondContact O-CB 3.44Å; S204-K207 PolarHBondContact O-N 2.98Å; L205-K207 PolarHBondContact O-N 2.87Å; K207-G292 WeakPolarHBondContact CD-O 3.26Å; K207-G292 VanDerWaalsContact CE-O 3.24Å; K207-G292 WeakPolarHBondContact CE-O 3.2Å; K207-G292 PolarHBondContact NZ-O 2.92Å; K207-V294 HydrophobicContact CB-CG2 4.06Å
208	L	90.1	Very high	91.2	Very high	44 Å²	44	54 Å²	54	23%	0.23	28%	0.281	C	S	.	.	S	Bend	trans	-81.3	124.5	174.5	-62.1	173.9	0	0	0	110.5	L205 R206 R210 C211 A212 L223 V294	L205-L208 HydrophobicContact CD2-CD1 4.36Å; L205-L208 VanDerWaalsContact O-CB 3.27Å; L205-L208 WeakPolarHBondContact O-CB 3.48Å; L205-L208 PolarHBondContact O-N 3.04Å; R206-L208 PolarHBondContact O-N 3.1Å; L208-R210 PolarHBondContact O-N 2.88Å; L208-R210 VanDerWaalsContact O-N 3.15Å; L208-C211 HydrophobicContact CB-CB 4.23Å; L208-C211 PolarHBondContact O-N 3.02Å; L208-A212 PolarHBondContact O-N 2.87Å; L208-A212 VanDerWaalsContact O-N 3.14Å; L208-L223 HydrophobicContact CD1-CD1 3.78Å; L208-L223 HydrophobicContact CD1-CD2 4.22Å; L208-V294 HydrophobicContact CD1-CG1 4.19Å; L208-V294 HydrophobicContact CD2-CG1 4.03Å; L208-V294 HydrophobicContact CD2-CG2 4.14Å; L208-V294 HydrophobicContact CG-CG1 4.24Å; L208-V294 HydrophobicContact CG-CG2 4.18Å
209	P	90.8	Very high	91.3	Very high	122 Å²	122	51.3 Å²	51.3	79%	0.792	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-53.8	-39.3	-178.9	-28.9	35.2	0	0	0	113.8	C211	P209-C211 PolarHBondContact O-N 3.17Å
210	R	92.3	Very high	91.5	Very high	155 Å²	155	51.2 Å²	51.2	59%	0.585	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-67.3	-16.2	178.8	-66.9	175.2	66.3	-163.5	-1.2	113.9	L208 L214 L222 D226	L208-R210 PolarHBondContact O-N 2.88Å; L208-R210 VanDerWaalsContact O-N 3.15Å; R210-L214 WeakPolarHBondContact O-CD1 3.37Å; R210-L222 HydrophobicContact CB-CD2 4.07Å; R210-L222 WeakPolarHBondContact O-CD2 3.44Å; R210-D226 IonicContact NH1-OD2 3.66Å
211	C	92.3	Very high	91.6	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.014	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-114.5	-9.8	-175.6	-67.3	0	0	0	0	114	L205 L208 P209 A213 L214 A219	L205-C211 HydrophobicContact CB-CB 4.32Å; L205-C211 WeakPolarHBondContact O-CB 3.39Å; L208-C211 HydrophobicContact CB-CB 4.23Å; L208-C211 PolarHBondContact O-N 3.02Å; P209-C211 PolarHBondContact O-N 3.17Å; C211-A213 VanDerWaalsContact C-N 3.28Å; C211-A213 PolarHBondContact O-N 2.97Å; C211-L214 PolarHBondContact O-N 3.28Å; C211-A219 HydrophobicContact CB-CB 3.93Å
212	A	86.9	Confident	91.9	Very high	52 Å²	52	48.5 Å²	48.5	43%	0.43	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-36.4	-170.2	0	0	0	0	0	114.2	L208	L208-A212 PolarHBondContact O-N 2.87Å; L208-A212 VanDerWaalsContact O-N 3.14Å
213	A	87.4	Confident	92.2	Very high	84 Å²	84	47 Å²	47	69%	0.694	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	0	-179.9	0	0	0	0	0	114.1	C211	C211-A213 VanDerWaalsContact C-N 3.28Å; C211-A213 PolarHBondContact O-N 2.97Å
214	L	90.5	Very high	92.5	Very high	46 Å²	46	47.4 Å²	47.4	24%	0.241	26%	0.26	C	S	.	.	S	Bend	trans	-88.8	150.5	-176.7	-60.9	-174.7	0	0	0	111	R210 C211 Q218 A219 L222	R210-L214 WeakPolarHBondContact O-CD1 3.37Å; C211-L214 PolarHBondContact O-N 3.28Å; L214-Q218 HydrophobicContact CB-CB 3.88Å; L214-Q218 HydrophobicContact CD1-CB 4.41Å; L214-Q218 HydrophobicContact CD2-CB 4.35Å; L214-Q218 HydrophobicContact CG-CB 4.44Å; L214-A219 HydrophobicContact CB-CB 4.19Å; L214-L222 HydrophobicContact CD1-CB 4.3Å; L214-L222 HydrophobicContact CD1-CD2 3.74Å
215	S	89.7	Confident	92.7	Very high	29 Å²	29	52.6 Å²	52.6	20%	0.203	28%	0.282	C	S	.	.			trans	-65.2	161.6	161.1	66.5	0	0	0	0	109.8	G217 Q218 A219	S215-G217 VanDerWaalsContact C-N 3.32Å; S215-G217 PolarHBondContact O-N 2.85Å; S215-Q218 WeakPolarHBondContact O-CB 3.3Å; S215-Q218 PolarHBondContact O-N 3.22Å; S215-Q218 VanDerWaalsContact O-N 3.1Å; S215-Q218 VanDerWaalsContact OG-CG 3.28Å; S215-Q218 WeakPolarHBondContact OG-CG 3.43Å; S215-Q218 PolarHBondContact OG-N 3.29Å; S215-Q218 PolarHBondContact OG-OE1 3.22Å; S215-A219 WeakPolarHBondContact O-CB 3.32Å; S215-A219 PolarHBondContact O-N 2.97Å
216	G	92	Very high	92.9	Very high	9 Å²	9	57 Å²	57	9%	0.093	31%	0.306	C	S	.	.	H	α-helix	trans	-64.1	-39.8	-178.2	0	0	0	0	0	112.2	D197 Q218 A219 I220	D197-G216 WeakPolarHBondContact OD1-CA 3.25Å; D197-G216 PolarHBondContact OD1-N 3.48Å; G216-Q218 VanDerWaalsContact C-N 3.33Å; G216-Q218 PolarHBondContact O-N 3.35Å; G216-A219 PolarHBondContact O-N 3.38Å; G216-I220 WeakPolarHBondContact O-CB 3.5Å; G216-I220 VanDerWaalsContact O-CG1 3.27Å; G216-I220 WeakPolarHBondContact O-CG1 3.39Å; G216-I220 PolarHBondContact O-N 3.47Å
217	G	94.2	Very high	93.3	Very high	15 Å²	15	53.1 Å²	53.1	16%	0.155	30%	0.298	C	S	.	.	H	α-helix	trans	-54.9	-44.1	169.5	0	0	0	0	0	114	D197 S215 E221	D197-G217 PolarHBondContact OD1-N 2.87Å; S215-G217 VanDerWaalsContact C-N 3.32Å; S215-G217 PolarHBondContact O-N 2.85Å; G217-E221 PolarHBondContact O-N 3.44Å; G217-E221 VanDerWaalsContact O-N 3.09Å
218	Q	95	Very high	93.6	Very high	81 Å²	81	50.3 Å²	50.3	38%	0.379	29%	0.29	S	S	.	.	H	α-helix	trans	-68.3	-40.3	176.9	-72.4	175.2	-52.7	0	0	112.2	L214 S215 G216 E221 L222	L214-Q218 HydrophobicContact CB-CB 3.88Å; L214-Q218 HydrophobicContact CD1-CB 4.41Å; L214-Q218 HydrophobicContact CD2-CB 4.35Å; L214-Q218 HydrophobicContact CG-CB 4.44Å; S215-Q218 WeakPolarHBondContact O-CB 3.3Å; S215-Q218 PolarHBondContact O-N 3.22Å; S215-Q218 VanDerWaalsContact O-N 3.1Å; S215-Q218 VanDerWaalsContact OG-CG 3.28Å; S215-Q218 WeakPolarHBondContact OG-CG 3.43Å; S215-Q218 PolarHBondContact OG-N 3.29Å; S215-Q218 PolarHBondContact OG-OE1 3.22Å; G216-Q218 VanDerWaalsContact C-N 3.33Å; G216-Q218 PolarHBondContact O-N 3.35Å; Q218-E221 PolarHBondContact O-N 3.4Å; Q218-L222 WeakPolarHBondContact O-CB 3.38Å; Q218-L222 PolarHBondContact O-N 2.98Å
219	A	95.9	Very high	93.8	Very high	2 Å²	2	50.9 Å²	50.9	2%	0.017	29%	0.288	C	S	.	.	H	α-helix	trans	-65.6	-43.3	177.9	0	0	0	0	0	111.8	L205 C211 L214 S215 G216 E221 L222 L223	L205-A219 HydrophobicContact CB-CB 4.27Å; L205-A219 HydrophobicContact CD1-CB 3.78Å; C211-A219 HydrophobicContact CB-CB 3.93Å; L214-A219 HydrophobicContact CB-CB 4.19Å; S215-A219 WeakPolarHBondContact O-CB 3.32Å; S215-A219 PolarHBondContact O-N 2.97Å; G216-A219 PolarHBondContact O-N 3.38Å; A219-E221 VanDerWaalsContact C-N 3.29Å; A219-E221 PolarHBondContact O-N 2.91Å; A219-L222 PolarHBondContact O-N 2.69Å; A219-L223 WeakPolarHBondContact O-CG 3.46Å; A219-L223 PolarHBondContact O-N 3.27Å
220	I	97.7	Very high	94	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.2	-43.2	174.2	-69.5	-72.5	0	0	0	110.4	L196 V199 A200 L203 L205 G216 A224 A302 Q306	L196-I220 HydrophobicContact CD2-CB 4.41Å; L196-I220 HydrophobicContact CD2-CG2 3.93Å; V199-I220 HydrophobicContact CG1-CD1 3.9Å; A200-I220 HydrophobicContact CB-CD1 4.41Å; A200-I220 HydrophobicContact CB-CG1 4.04Å; L203-I220 HydrophobicContact CD1-CD1 4Å; L205-I220 HydrophobicContact CD1-CD1 3.84Å; L205-I220 HydrophobicContact CD1-CG1 4.18Å; G216-I220 WeakPolarHBondContact O-CB 3.5Å; G216-I220 VanDerWaalsContact O-CG1 3.27Å; G216-I220 WeakPolarHBondContact O-CG1 3.39Å; G216-I220 PolarHBondContact O-N 3.47Å; I220-A224 WeakPolarHBondContact O-CB 3.31Å; I220-A224 PolarHBondContact O-N 2.89Å; I220-A302 HydrophobicContact CD1-CB 3.96Å; I220-A302 HydrophobicContact CG2-CB 4.24Å; I220-Q306 HydrophobicContact CG2-CB 4.1Å
221	E	97.6	Very high	94.1	Very high	34 Å²	34	49.9 Å²	49.9	16%	0.159	27%	0.272	C	S	.	.	H	α-helix	trans	-63.4	-42.8	177.3	-175.3	170	-162	0	0	113.8	G217 Q218 A219 Q306 N346 Q347	G217-E221 PolarHBondContact O-N 3.44Å; G217-E221 VanDerWaalsContact O-N 3.09Å; Q218-E221 PolarHBondContact O-N 3.4Å; A219-E221 VanDerWaalsContact C-N 3.29Å; A219-E221 PolarHBondContact O-N 2.91Å; E221-Q306 VanDerWaalsContact CA-NE2 3.26Å; E221-N346 WeakPolarHBondContact CB-ND2 3.48Å; E221-N346 WeakPolarHBondContact CG-ND2 3.3Å; E221-N346 WeakPolarHBondContact OE1-CA 3.43Å; E221-N346 WeakPolarHBondContact OE2-CA 3.42Å; E221-N346 PolarHBondContact OE2-ND2 3.33Å; E221-Q347 WeakPolarHBondContact OE1-CB 3.4Å; E221-Q347 PolarHBondContact OE1-N 2.86Å
222	L	97.5	Very high	94.3	Very high	34 Å²	34	51.2 Å²	51.2	18%	0.178	28%	0.278	C	S	.	.	H	α-helix	trans	-61.3	-48.5	178.2	-179.4	64.5	0	0	0	111.3	R210 L214 Q218 A219 Q225	R210-L222 HydrophobicContact CB-CD2 4.07Å; R210-L222 WeakPolarHBondContact O-CD2 3.44Å; L214-L222 HydrophobicContact CD1-CB 4.3Å; L214-L222 HydrophobicContact CD1-CD2 3.74Å; Q218-L222 WeakPolarHBondContact O-CB 3.38Å; Q218-L222 PolarHBondContact O-N 2.98Å; A219-L222 PolarHBondContact O-N 2.69Å; L222-Q225 WeakPolarHBondContact O-CB 3.41Å; L222-Q225 PolarHBondContact O-N 3.42Å
223	L	97.3	Very high	94.6	Very high	8 Å²	8	59.4 Å²	59.4	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-74	-28.6	-177.5	-63.1	-175.9	0	0	0	113.2	L205 L208 A219 Q225 D226 V298 N299 A302	L205-L223 HydrophobicContact CD1-CD1 3.87Å; L205-L223 HydrophobicContact CD2-CD1 3.43Å; L205-L223 VanDerWaalsContact CD2-CD1 3.43Å; L205-L223 HydrophobicContact CG-CD1 4.17Å; L208-L223 HydrophobicContact CD1-CD1 3.78Å; L208-L223 HydrophobicContact CD1-CD2 4.22Å; A219-L223 WeakPolarHBondContact O-CG 3.46Å; A219-L223 PolarHBondContact O-N 3.27Å; L223-Q225 PolarHBondContact O-N 2.6Å; L223-D226 PolarHBondContact O-N 3.32Å; L223-V298 HydrophobicContact CD1-CG2 3.98Å; L223-N299 WeakPolarHBondContact O-CB 3.41Å; L223-A302 HydrophobicContact CB-CB 3.98Å
224	A	97.3	Very high	94.9	Very high	11 Å²	11	56.8 Å²	56.8	9%	0.091	27%	0.271	C	S	.	.	H	α-helix	trans	-62.5	-23.3	176.9	0	0	0	0	0	113.3	I220 D226 G227 A303 Q306	I220-A224 WeakPolarHBondContact O-CB 3.31Å; I220-A224 PolarHBondContact O-N 2.89Å; A224-D226 PolarHBondContact O-N 2.69Å; A224-G227 PolarHBondContact O-N 2.87Å; A224-A303 HydrophobicContact CB-CB 4.09Å; A224-Q306 HydrophobicContact CB-CB 4.46Å
225	Q	95.9	Very high	94.9	Very high	133 Å²	133	64.1 Å²	64.1	62%	0.621	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-33.7	177	-66.3	172.7	4.8	0	0	112.2	L222 L223	L222-Q225 WeakPolarHBondContact O-CB 3.41Å; L222-Q225 PolarHBondContact O-N 3.42Å; L223-Q225 PolarHBondContact O-N 2.6Å
226	D	95.2	Very high	94.7	Very high	94 Å²	94	64.5 Å²	64.5	50%	0.503	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	18.8	-176.2	-62	-36.7	0	0	0	111.6	R210 L223 A224 N299	R210-D226 IonicContact NH1-OD2 3.66Å; L223-D226 PolarHBondContact O-N 3.32Å; A224-D226 PolarHBondContact O-N 2.69Å; D226-N299 WeakPolarHBondContact CB-ND2 3.36Å; D226-N299 PolarHBondContact O-ND2 2.56Å
227	G	95.3	Very high	94.4	Very high	22 Å²	22	64.6 Å²	64.6	23%	0.227	30%	0.295	C	S	.	.	S	Bend	trans	-126	148.9	-173.5	0	0	0	0	0	114.6	A224 R229 D300	A224-G227 PolarHBondContact O-N 2.87Å; G227-R229 PolarHBondContact O-N 2.99Å; G227-D300 WeakPolarHBondContact CA-OD1 3.37Å
228	D	95.3	Very high	94.1	Very high	80 Å²	80	66 Å²	66	43%	0.428	30%	0.298	S	S	.	.			trans	-87.5	102.4	172.3	-179.9	12.8	0	0	0	111.5	K230 R231 D300	D228-K230 PolarHBondContact O-N 2.81Å; D228-K230 VanDerWaalsContact OD1-CB 3.32Å; D228-K230 WeakPolarHBondContact OD1-CB 3.38Å; D228-K230 PolarHBondContact OD1-N 2.95Å; D228-R231 HydrophobicContact CB-CB 4.29Å; D228-R231 WeakPolarHBondContact O-CB 3.36Å; D228-R231 PolarHBondContact O-N 2.91Å; D228-R231 VanDerWaalsContact O-N 3.12Å; D228-R231 PolarHBondContact OD2-N 3.09Å; D228-D300 PolarHBondContact N-OD1 3.4Å
229	R	94.6	Very high	93.4	Very high	55 Å²	55	64.2 Å²	64.2	21%	0.208	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-13.3	174.4	68.2	-177.1	175.9	84.6	-1.6	115.2	G227 A303 H307 Y348 D432	G227-R229 PolarHBondContact O-N 2.99Å; R229-A303 HydrophobicContact CB-CB 4.03Å; R229-H307 HydrophobicContact CB-CB 4Å; R229-H307 PolarHBondContact NH1-CE1 3.48Å; R229-Y348 WeakPolarHBondContact CD-OH 3.05Å; R229-D432 IonicContact NE-OD1 2.77Å; R229-D432 PolarHBondContact NE-OD1 3.28Å; R229-D432 IonicContact NH2-OD1 3.19Å
230	K	94.2	Very high	92.8	Very high	126 Å²	126	73 Å²	73	55%	0.548	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-16.4	179.6	-61.8	175.1	-174.2	161.2	0	113.1	D228 F232	D228-K230 PolarHBondContact O-N 2.81Å; D228-K230 VanDerWaalsContact OD1-CB 3.32Å; D228-K230 WeakPolarHBondContact OD1-CB 3.38Å; D228-K230 PolarHBondContact OD1-N 2.95Å; K230-F232 VanDerWaalsContact C-N 3.27Å; K230-F232 PolarHBondContact O-N 2.88Å
231	R	95.4	Very high	92.4	Very high	131 Å²	131	75.1 Å²	75.1	49%	0.494	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-43.1	179.5	-176	179.3	177	162.2	-1.2	111.3	D228 D300	D228-R231 HydrophobicContact CB-CB 4.29Å; D228-R231 WeakPolarHBondContact O-CB 3.36Å; D228-R231 PolarHBondContact O-N 2.91Å; D228-R231 VanDerWaalsContact O-N 3.12Å; D228-R231 PolarHBondContact OD2-N 3.09Å; R231-D300 HydrophobicContact CB-CB 4.18Å; R231-D300 VanDerWaalsContact CD-CG 3.43Å; R231-D300 WeakPolarHBondContact CD-OD2 3.36Å; R231-D300 HydrophobicContact CG-CB 4.45Å; R231-D300 IonicContact CZ-OD2 3.64Å; R231-D300 IonicContact NE-OD2 3.35Å; R231-D300 IonicContact NH1-OD2 3.77Å; R231-D300 PolarHBondContact NH1-OD2 3.37Å
232	F	95.6	Very high	92.1	Very high	30 Å²	30	75.7 Å²	75.7	13%	0.132	36%	0.362	C	S	.	.	S	Bend	trans	-117.1	134.8	176.2	-57	-66.9	0	0	0	110.9	K230 F234 L258 C297 D300 I301 A304	K230-F232 VanDerWaalsContact C-N 3.27Å; K230-F232 PolarHBondContact O-N 2.88Å; F232-F234 HydrophobicContact CB-CZ 4.39Å; F232-L258 HydrophobicContact CB-CD2 3.87Å; F232-L258 HydrophobicContact CD1-CD1 3.78Å; F232-L258 HydrophobicContact CD1-CD2 3.69Å; F232-L258 HydrophobicContact CD1-CG 4.34Å; F232-L258 HydrophobicContact CD2-CD2 4Å; F232-L258 HydrophobicContact CE1-CD1 3.82Å; F232-L258 HydrophobicContact CE1-CD2 4.17Å; F232-L258 HydrophobicContact CE1-CG 4.49Å; F232-L258 HydrophobicContact CE2-CD2 4.44Å; F232-L258 HydrophobicContact CG-CD2 3.57Å; F232-C297 HydrophobicContact CE2-CB 4.09Å; F232-C297 HydrophobicContact CZ-CB 4.21Å; F232-D300 HydrophobicContact CD2-CB 3.98Å; F232-D300 HydrophobicContact CE2-CB 3.82Å; F232-I301 HydrophobicContact CD2-CG1 3.94Å; F232-I301 HydrophobicContact CE2-CG1 3.74Å; F232-A304 HydrophobicContact CB-CB 4.02Å; F232-A304 WeakPolarHBondContact O-CB 3.15Å
233	R	92.3	Very high	91.9	Very high	224 Å²	224	74.1 Å²	74.1	85%	0.845	35%	0.354	S	S	*	.			trans	-114.8	112.5	-179.6	-66.3	-174.2	-177.4	-180	2.3	110.6
234	F	94.3	Very high	91.9	Very high	28 Å²	28	73.8 Å²	73.8	12%	0.123	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-94.9	146.4	171.5	-55.6	-60.2	0	0	0	111.1	F232 T236 L251 Q254 V255 L258 A304 T308	F232-F234 HydrophobicContact CB-CZ 4.39Å; F234-T236 PolarHBondContact O-N 2.84Å; F234-L251 HydrophobicContact CB-CD1 3.64Å; F234-L251 HydrophobicContact CD2-CD1 4.01Å; F234-L251 HydrophobicContact CG-CD1 3.82Å; F234-Q254 HydrophobicContact CD1-CB 3.93Å; F234-Q254 HydrophobicContact CE1-CB 4.47Å; F234-V255 HydrophobicContact CD1-CG2 4.41Å; F234-V255 HydrophobicContact CD2-CG2 4.3Å; F234-V255 HydrophobicContact CE1-CG2 3.95Å; F234-V255 HydrophobicContact CE2-CG2 3.83Å; F234-V255 HydrophobicContact CZ-CB 4.38Å; F234-V255 HydrophobicContact CZ-CG2 3.64Å; F234-L258 HydrophobicContact CE1-CB 4.28Å; F234-L258 HydrophobicContact CE1-CD2 3.76Å; F234-L258 HydrophobicContact CZ-CD2 3.55Å; F234-A304 HydrophobicContact CD2-CB 4.05Å; F234-A304 HydrophobicContact CE2-CB 3.6Å; F234-T308 HydrophobicContact CB-CG2 4.07Å
235	R	90.9	Very high	91.9	Very high	201 Å²	201	73.4 Å²	73.4	76%	0.758	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-72.9	128.1	172.2	-69.4	-177.1	-83	-168.3	-5.9	108.9	Q254	R235-Q254 PolarHBondContact O-NE2 2.84Å
236	T	85.9	Confident	92	Very high	37 Å²	37	67.1 Å²	67.1	23%	0.227	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-60.5	126.9	173.4	-50.2	0	0	0	0	109.3	F234 H312 K315	F234-T236 PolarHBondContact O-N 2.84Å; T236-H312 HydrophobicContact CG2-CB 3.99Å; T236-K315 HydrophobicContact CG2-CD 4.21Å; T236-K315 PolarHBondContact OG1-NZ 3Å; T236-K315 VanDerWaalsContact OG1-NZ 3.11Å
237	P	86.2	Confident	92	Very high	11 Å²	11	63.5 Å²	63.5	7%	0.071	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	139.9	177.4	-26.6	35.6	0	0	0	112.2	G239 S247 L251 H312	P237-G239 PolarHBondContact O-N 3.17Å; P237-S247 WeakPolarHBondContact CB-O 3.35Å; P237-S247 VanDerWaalsContact CG-O 3.29Å; P237-S247 WeakPolarHBondContact CG-O 3.29Å; P237-L251 HydrophobicContact CG-CB 3.97Å; P237-H312 PolarHBondContact O-CE1 3.47Å; P237-H312 PolarHBondContact O-ND1 3.15Å
238	M	87.9	Confident	92.1	Very high	43 Å²	43	62.5 Å²	62.5	21%	0.212	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	30.5	173.4	-56.4	172.2	72.4	0	0	114.6	L188 Q240 T241 C245 S247 R316	L188-M238 HydrophobicContact CD1-CE 3.68Å; L188-M238 HydrophobicContact CD1-SD 4.2Å; M238-Q240 PolarHBondContact O-N 2.79Å; M238-T241 HydrophobicContact CE-CG2 4.07Å; M238-T241 PolarHBondContact O-N 3.39Å; M238-C245 HydrophobicContact CE-CB 4.22Å; M238-S247 WeakPolarHBondContact SD-CB 3.25Å; M238-R316 PolarHBondContact O-NH2 3.3Å
239	G	78.4	Confident	92	Very high	44 Å²	44	59.8 Å²	59.8	45%	0.454	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-23	-171.1	0	0	0	0	0	115.6	P237	P237-G239 PolarHBondContact O-N 3.17Å
240	Q	83.9	Confident	92	Very high	187 Å²	187	59 Å²	59	87%	0.874	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-8	179	-59.1	-59.3	-24.6	0	0	113.8	M238 P242	M238-Q240 PolarHBondContact O-N 2.79Å; Q240-P242 WeakPolarHBondContact O-CD 3.38Å
241	T	89.1	Confident	92.1	Very high	44 Å²	44	53 Å²	53	27%	0.27	26%	0.263	S	S	.	.			trans	-82.5	120.6	-177.9	-47	0	0	0	0	109.4	M238 D243 R316	M238-T241 HydrophobicContact CE-CG2 4.07Å; M238-T241 PolarHBondContact O-N 3.39Å; T241-D243 HydrophobicContact CG2-CB 4.44Å; T241-D243 VanDerWaalsContact CG2-OD2 3.31Å; T241-D243 WeakPolarHBondContact CG2-OD2 3.13Å; T241-D243 PolarHBondContact O-N 3.34Å; T241-R316 PolarHBondContact O-NH1 3.45Å
242	P	91.3	Very high	92.1	Very high	47 Å²	47	50.7 Å²	50.7	31%	0.305	25%	0.254	S	S	.	.			trans	-86.1	45.1	-175.4	37.2	-37.7	0	0	0	112.9	Q240	Q240-P242 WeakPolarHBondContact O-CD 3.38Å
243	D	94.4	Very high	92.1	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	27%	0.269	C	S	.	.	S	Bend	trans	-117.3	-178.9	175.3	66.2	20.2	0	0	0	112.4	T241 C245 R316 R319 R417	T241-D243 HydrophobicContact CG2-CB 4.44Å; T241-D243 VanDerWaalsContact CG2-OD2 3.31Å; T241-D243 WeakPolarHBondContact CG2-OD2 3.13Å; T241-D243 PolarHBondContact O-N 3.34Å; D243-C245 PolarHBondContact OD1-N 3.48Å; D243-R316 WeakPolarHBondContact O-CD 3.43Å; D243-R316 PolarHBondContact O-NH1 3.23Å; D243-R316 IonicContact OD1-CZ 3.37Å; D243-R316 IonicContact OD1-NH1 3.42Å; D243-R316 IonicContact OD1-NH2 3.53Å; D243-R319 WeakPolarHBondContact O-CD 3.23Å; D243-R319 PolarHBondContact O-NH1 3.49Å; D243-R417 HydrophobicContact CB-CB 4.19Å; D243-R417 IonicContact OD2-CZ 3Å; D243-R417 IonicContact OD2-NE 2.89Å; D243-R417 IonicContact OD2-NH2 3.57Å; D243-R417 PolarHBondContact OD2-NH2 3.24Å
244	C	96.6	Very high	92.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.239	C	C	.	.	S	Bend	trans	-102.9	12.2	175.7	-65.4	0	0	0	0	112.8	L172 L184 G185 A320 V416	L172-C244 HydrophobicContact CD1-CB 4.01Å; L184-C244 WeakPolarHBondContact O-CB 3.37Å; G185-C244 WeakPolarHBondContact CA-O 3.27Å; C244-A320 PolarHBondContact SG-N 2.68Å; C244-A320 VanDerWaalsContact SG-N 3.39Å; C244-V416 HydrophobicContact CB-CG1 4.05Å; C244-V416 WeakPolarHBondContact SG-CG1 3.39Å
245	C	97.3	Very high	92.4	Very high	4 Å²	4	43.4 Å²	43.4	3%	0.027	23%	0.233	C	C	.	.			trans	-79.9	153.6	-178.1	-68.2	0	0	0	0	112.1	R186 L188 M238 D243 R316	R186-C245 CarbonylContact O-C 3.55Å; R186-C245 VanDerWaalsContact O-CA 3.3Å; R186-C245 WeakPolarHBondContact O-CA 3.47Å; R186-C245 WeakPolarHBondContact O-CB 3.36Å; L188-C245 HydrophobicContact CD1-CB 3.91Å; L188-C245 HydrophobicContact CD2-CB 4.13Å; L188-C245 HydrophobicContact CG-CB 3.93Å; M238-C245 HydrophobicContact CE-CB 4.22Å; D243-C245 PolarHBondContact OD1-N 3.48Å; C245-R316 WeakPolarHBondContact O-CD 3.46Å; C245-R316 PolarHBondContact O-NE 3.4Å
246	F	97.3	Very high	92.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-110.3	156.5	-177.5	-53.2	-86.3	0	0	0	111.6	L163 A170 L172 R186 L188 F248 L313 R316	L163-F246 HydrophobicContact CD1-CE1 4.5Å; L163-F246 HydrophobicContact CD1-CE2 4.32Å; L163-F246 HydrophobicContact CD1-CZ 3.69Å; A170-F246 HydrophobicContact CB-CB 4.22Å; A170-F246 HydrophobicContact CB-CD2 3.75Å; A170-F246 HydrophobicContact CB-CE2 4.25Å; A170-F246 HydrophobicContact CB-CG 3.99Å; L172-F246 HydrophobicContact CD1-CE1 4.42Å; L172-F246 HydrophobicContact CD1-CE2 3.94Å; L172-F246 HydrophobicContact CD1-CZ 3.44Å; L172-F246 VanDerWaalsContact CD1-CZ 3.44Å; L172-F246 HydrophobicContact CG-CE2 4.04Å; L172-F246 HydrophobicContact CG-CZ 3.78Å; R186-F246 PolarHBondContact O-N 3.27Å; L188-F246 PolarHBondContact N-O 2.78Å; F246-F248 HydrophobicContact CB-CD2 4.38Å; F246-F248 HydrophobicContact CB-CE2 3.61Å; F246-F248 HydrophobicContact CB-CZ 4.21Å; F246-F248 HydrophobicContact CD1-CE2 4.46Å; F246-F248 HydrophobicContact CD1-CZ 4.27Å; F246-F248 HydrophobicContact CG-CE2 4.32Å; F246-L313 HydrophobicContact CD1-CD2 3.88Å; F246-L313 HydrophobicContact CE1-CD2 3.59Å; F246-L313 HydrophobicContact CZ-CD2 4.33Å; F246-R316 HydrophobicContact CD1-CB 4.04Å; F246-R316 HydrophobicContact CD1-CG 3.77Å; F246-R316 HydrophobicContact CE1-CB 3.37Å; F246-R316 HydrophobicContact CE1-CG 3.65Å; F246-R316 HydrophobicContact CZ-CB 3.84Å; F246-R316 HydrophobicContact CZ-CG 4.43Å
247	S	96.1	Very high	92.9	Very high	19 Å²	19	38 Å²	38	13%	0.133	22%	0.219	C	C	.	.			trans	-159.2	133.4	176.1	163.1	0	0	0	0	107	D189 P237 M238 H312	D189-S247 VanDerWaalsContact OD1-CA 3.25Å; D189-S247 WeakPolarHBondContact OD1-CA 3.48Å; D189-S247 VanDerWaalsContact OD2-CB 3.3Å; D189-S247 WeakPolarHBondContact OD2-CB 3.49Å; D189-S247 PolarHBondContact OD2-OG 3.18Å; P237-S247 WeakPolarHBondContact CB-O 3.35Å; P237-S247 VanDerWaalsContact CG-O 3.29Å; P237-S247 WeakPolarHBondContact CG-O 3.29Å; M238-S247 WeakPolarHBondContact SD-CB 3.25Å; S247-H312 PolarHBondContact N-NE2 2.99Å; S247-H312 PolarHBondContact O-CD2 3.08Å; S247-H312 PolarHBondContact O-NE2 3.39Å
248	F	96.5	Very high	93.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.222	C	C	.	.			trans	-133.1	-14.5	-176.8	-60.5	-86.7	0	0	0	113	A170 D189 E190 P192 T195 F246 G250 L251 R252 V309 H312 L313	A170-F248 HydrophobicContact CB-CE2 4.3Å; D189-F248 PolarHBondContact OD1-N 2.54Å; D189-F248 PolarHBondContact OD2-N 3.48Å; E190-F248 HydrophobicContact CG-CB 4.23Å; E190-F248 WeakPolarHBondContact O-CD2 3.3Å; P192-F248 HydrophobicContact CB-CD1 4.36Å; P192-F248 HydrophobicContact CB-CD2 4.41Å; P192-F248 HydrophobicContact CB-CE1 3.92Å; P192-F248 HydrophobicContact CB-CE2 3.96Å; P192-F248 HydrophobicContact CB-CZ 3.71Å; P192-F248 HydrophobicContact CG-CE2 4.08Å; P192-F248 HydrophobicContact CG-CZ 4.08Å; T195-F248 HydrophobicContact CG2-CB 4.19Å; T195-F248 WeakPolarHBondContact OG1-CB 3.28Å; F246-F248 HydrophobicContact CB-CD2 4.38Å; F246-F248 HydrophobicContact CB-CE2 3.61Å; F246-F248 HydrophobicContact CB-CZ 4.21Å; F246-F248 HydrophobicContact CD1-CE2 4.46Å; F246-F248 HydrophobicContact CD1-CZ 4.27Å; F246-F248 HydrophobicContact CG-CE2 4.32Å; F248-G250 VanDerWaalsContact C-N 3.26Å; F248-G250 PolarHBondContact O-N 3.19Å; F248-L251 WeakPolarHBondContact O-CA 3.31Å; F248-L251 WeakPolarHBondContact O-CB 3.38Å; F248-L251 PolarHBondContact O-N 3.15Å; F248-R252 PolarHBondContact O-N 3.23Å; F248-V309 HydrophobicContact CD1-CG2 4.34Å; F248-V309 HydrophobicContact CE1-CG1 4.06Å; F248-V309 HydrophobicContact CE1-CG2 4.44Å; F248-H312 HydrophobicContact CE1-CB 4.48Å; F248-H312 AromaticContact CE1-CD2 3.62Å; F248-H312 AromaticContact CZ-CD2 3.76Å; F248-L313 HydrophobicContact CZ-CD2 3.9Å; F248-L313 HydrophobicContact CZ-CG 4.41Å
249	A	93.8	Very high	93.6	Very high	24 Å²	24	36.8 Å²	36.8	20%	0.198	21%	0.212	C	C	.	.	H	α-helix	trans	-58.7	-37.4	178.2	0	0	0	0	0	112.7	D189 E190 L251 R252 N253	D189-A249 HydrophobicContact CB-CB 4.04Å; D189-A249 PolarHBondContact OD1-N 2.89Å; D189-A249 WeakPolarHBondContact OD2-CB 3.45Å; D189-A249 PolarHBondContact OD2-N 2.87Å; E190-A249 HydrophobicContact CG-CB 4.11Å; E190-A249 WeakPolarHBondContact OE1-CA 3.21Å; A249-L251 VanDerWaalsContact C-N 3.34Å; A249-L251 PolarHBondContact O-N 3.03Å; A249-R252 WeakPolarHBondContact O-CB 3.32Å; A249-R252 PolarHBondContact O-N 2.93Å; A249-N253 PolarHBondContact O-N 2.85Å
250	G	94.4	Very high	94.2	Very high	38 Å²	38	39.2 Å²	39.2	39%	0.392	21%	0.212	S	C	.	.	H	α-helix	trans	-68	-30.2	175.3	0	0	0	0	0	113.7	F248 Q254	F248-G250 VanDerWaalsContact C-N 3.26Å; F248-G250 PolarHBondContact O-N 3.19Å; G250-Q254 WeakPolarHBondContact O-CG 3.17Å; G250-Q254 PolarHBondContact O-N 3.5Å; G250-Q254 PolarHBondContact O-NE2 3.46Å; G250-Q254 VanDerWaalsContact O-NE2 3.1Å
251	L	95.8	Very high	94.5	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-71.2	-48.8	171.7	173.5	59.5	0	0	0	110.1	F234 P237 F248 A249 N253 Q254 V255 T308 V309	F234-L251 HydrophobicContact CB-CD1 3.64Å; F234-L251 HydrophobicContact CD2-CD1 4.01Å; F234-L251 HydrophobicContact CG-CD1 3.82Å; P237-L251 HydrophobicContact CG-CB 3.97Å; F248-L251 WeakPolarHBondContact O-CA 3.31Å; F248-L251 WeakPolarHBondContact O-CB 3.38Å; F248-L251 PolarHBondContact O-N 3.15Å; A249-L251 VanDerWaalsContact C-N 3.34Å; A249-L251 PolarHBondContact O-N 3.03Å; L251-N253 PolarHBondContact O-N 3.2Å; L251-Q254 WeakPolarHBondContact O-CB 3.43Å; L251-Q254 PolarHBondContact O-N 3.06Å; L251-V255 HydrophobicContact CD1-CG2 4.05Å; L251-V255 HydrophobicContact CG-CG2 4.39Å; L251-V255 WeakPolarHBondContact O-CG2 3.29Å; L251-V255 PolarHBondContact O-N 2.89Å; L251-T308 HydrophobicContact CD1-CG2 3.72Å; L251-T308 HydrophobicContact CD2-CG2 3.92Å; L251-T308 HydrophobicContact CG-CG2 4.42Å; L251-V309 HydrophobicContact CD2-CG2 3.65Å
252	R	95.6	Very high	94.6	Very high	82 Å²	82	34.8 Å²	34.8	31%	0.309	19%	0.186	S	C	.	.	H	α-helix	trans	-50.7	-47.4	175.7	-173.5	-159.3	69.1	-153.1	4.1	111.3	E190 T195 F248 A249 Q254 V255 T256	E190-R252 WeakPolarHBondContact OE1-CB 3.45Å; E190-R252 WeakPolarHBondContact OE1-CD 3.06Å; E190-R252 IonicContact OE1-NH1 3.19Å; E190-R252 IonicContact OE2-CZ 2.72Å; E190-R252 IonicContact OE2-NH1 3.97Å; E190-R252 PolarHBondContact OE2-NH1 3.36Å; T195-R252 HydrophobicContact CG2-CB 4.1Å; F248-R252 PolarHBondContact O-N 3.23Å; A249-R252 WeakPolarHBondContact O-CB 3.32Å; A249-R252 PolarHBondContact O-N 2.93Å; R252-Q254 PolarHBondContact O-N 3.41Å; R252-V255 PolarHBondContact O-N 3.26Å; R252-T256 PolarHBondContact O-N 3.2Å; R252-T256 PolarHBondContact O-OG1 3.11Å; R252-T256 VanDerWaalsContact O-OG1 3.09Å
253	N	95.4	Very high	94.4	Very high	84 Å²	84	33.2 Å²	33.2	45%	0.449	18%	0.175	S	C	.	.	H	α-helix	trans	-61.8	-43.5	178.5	-168.7	50.4	0	0	0	112.8	A249 L251 V255 T256 L257	A249-N253 PolarHBondContact O-N 2.85Å; L251-N253 PolarHBondContact O-N 3.2Å; N253-V255 VanDerWaalsContact C-N 3.29Å; N253-V255 PolarHBondContact O-N 2.66Å; N253-T256 PolarHBondContact O-N 2.94Å; N253-L257 VanDerWaalsContact O-CG 3.32Å; N253-L257 WeakPolarHBondContact O-CG 3.47Å; N253-L257 PolarHBondContact O-N 3.2Å
254	Q	96.9	Very high	93.9	Very high	45 Å²	45	35 Å²	35	21%	0.21	19%	0.19	C	C	.	.	H	α-helix	trans	-59.6	-41.3	175.2	-74.3	172.8	88	0	0	111.9	F234 R235 G250 L251 R252 L258	F234-Q254 HydrophobicContact CD1-CB 3.93Å; F234-Q254 HydrophobicContact CE1-CB 4.47Å; R235-Q254 PolarHBondContact O-NE2 2.84Å; G250-Q254 WeakPolarHBondContact O-CG 3.17Å; G250-Q254 PolarHBondContact O-N 3.5Å; G250-Q254 PolarHBondContact O-NE2 3.46Å; G250-Q254 VanDerWaalsContact O-NE2 3.1Å; L251-Q254 WeakPolarHBondContact O-CB 3.43Å; L251-Q254 PolarHBondContact O-N 3.06Å; R252-Q254 PolarHBondContact O-N 3.41Å; Q254-L258 PolarHBondContact O-N 3.37Å; Q254-L258 VanDerWaalsContact O-N 3.08Å
255	V	96.4	Very high	93.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-67.2	-46.1	177.6	177.4	0	0	0	0	110.7	V199 F234 L251 R252 N253 L257 L258 I259 I301 T305	V199-V255 HydrophobicContact CB-CG1 4.47Å; V199-V255 HydrophobicContact CG1-CG1 3.71Å; V199-V255 HydrophobicContact CG2-CB 4.19Å; V199-V255 HydrophobicContact CG2-CG1 3.93Å; V199-V255 HydrophobicContact CG2-CG2 4.47Å; F234-V255 HydrophobicContact CD1-CG2 4.41Å; F234-V255 HydrophobicContact CD2-CG2 4.3Å; F234-V255 HydrophobicContact CE1-CG2 3.95Å; F234-V255 HydrophobicContact CE2-CG2 3.83Å; F234-V255 HydrophobicContact CZ-CB 4.38Å; F234-V255 HydrophobicContact CZ-CG2 3.64Å; L251-V255 HydrophobicContact CD1-CG2 4.05Å; L251-V255 HydrophobicContact CG-CG2 4.39Å; L251-V255 WeakPolarHBondContact O-CG2 3.29Å; L251-V255 PolarHBondContact O-N 2.89Å; R252-V255 PolarHBondContact O-N 3.26Å; N253-V255 VanDerWaalsContact C-N 3.29Å; N253-V255 PolarHBondContact O-N 2.66Å; V255-L257 VanDerWaalsContact C-N 3.34Å; V255-L257 PolarHBondContact O-N 3.39Å; V255-L258 WeakPolarHBondContact O-CB 3.49Å; V255-L258 PolarHBondContact O-N 2.8Å; V255-L258 VanDerWaalsContact O-N 3.16Å; V255-I259 HydrophobicContact CG1-CD1 3.77Å; V255-I259 HydrophobicContact CG1-CG1 4.31Å; V255-I259 VanDerWaalsContact O-CG1 3.28Å; V255-I259 WeakPolarHBondContact O-CG1 3.29Å; V255-I259 PolarHBondContact O-N 2.68Å; V255-I301 HydrophobicContact CG1-CG2 3.89Å; V255-T305 HydrophobicContact CG2-CG2 4.34Å
256	T	94.2	Very high	92.7	Very high	32 Å²	32	40.6 Å²	40.6	20%	0.196	22%	0.215	C	C	.	.	H	α-helix	trans	-57.3	-45.8	176.9	-61.5	0	0	0	0	112	R252 N253 L258 I259 Q260	R252-T256 PolarHBondContact O-N 3.2Å; R252-T256 PolarHBondContact O-OG1 3.11Å; R252-T256 VanDerWaalsContact O-OG1 3.09Å; N253-T256 PolarHBondContact O-N 2.94Å; T256-L258 VanDerWaalsContact C-N 3.33Å; T256-L258 PolarHBondContact O-N 3.01Å; T256-I259 PolarHBondContact O-N 2.65Å; T256-Q260 WeakPolarHBondContact O-CG 3.25Å; T256-Q260 PolarHBondContact O-N 3.32Å
257	L	94	Very high	91.6	Very high	94 Å²	94	41 Å²	41	49%	0.492	22%	0.22	S	C	.	.	H	α-helix	trans	-64	-37.7	177.5	-69.8	172.1	0	0	0	112.2	N253 V255 K261	N253-L257 VanDerWaalsContact O-CG 3.32Å; N253-L257 WeakPolarHBondContact O-CG 3.47Å; N253-L257 PolarHBondContact O-N 3.2Å; V255-L257 VanDerWaalsContact C-N 3.34Å; V255-L257 PolarHBondContact O-N 3.39Å; L257-K261 WeakPolarHBondContact O-CB 3.37Å; L257-K261 PolarHBondContact O-N 3.09Å; L257-K261 VanDerWaalsContact O-N 3.08Å
258	L	95.4	Very high	90	Very high	27 Å²	27	47.2 Å²	47.2	14%	0.141	24%	0.24	C	C	.	.	H	α-helix	trans	-63.6	-45.9	174.1	177.2	66.8	0	0	0	111.1	F232 F234 Q254 V255 T256 Q260 K261 Q262 I301	F232-L258 HydrophobicContact CB-CD2 3.87Å; F232-L258 HydrophobicContact CD1-CD1 3.78Å; F232-L258 HydrophobicContact CD1-CD2 3.69Å; F232-L258 HydrophobicContact CD1-CG 4.34Å; F232-L258 HydrophobicContact CD2-CD2 4Å; F232-L258 HydrophobicContact CE1-CD1 3.82Å; F232-L258 HydrophobicContact CE1-CD2 4.17Å; F232-L258 HydrophobicContact CE1-CG 4.49Å; F232-L258 HydrophobicContact CE2-CD2 4.44Å; F232-L258 HydrophobicContact CG-CD2 3.57Å; F234-L258 HydrophobicContact CE1-CB 4.28Å; F234-L258 HydrophobicContact CE1-CD2 3.76Å; F234-L258 HydrophobicContact CZ-CD2 3.55Å; Q254-L258 PolarHBondContact O-N 3.37Å; Q254-L258 VanDerWaalsContact O-N 3.08Å; V255-L258 WeakPolarHBondContact O-CB 3.49Å; V255-L258 PolarHBondContact O-N 2.8Å; V255-L258 VanDerWaalsContact O-N 3.16Å; T256-L258 VanDerWaalsContact C-N 3.33Å; T256-L258 PolarHBondContact O-N 3.01Å; L258-Q260 PolarHBondContact O-N 3.37Å; L258-K261 WeakPolarHBondContact O-CB 3.44Å; L258-K261 PolarHBondContact O-N 2.88Å; L258-Q262 HydrophobicContact CD1-CG 4.26Å; L258-Q262 HydrophobicContact CG-CG 4.42Å; L258-Q262 WeakPolarHBondContact O-CG 3.27Å; L258-Q262 PolarHBondContact O-N 2.74Å; L258-I301 HydrophobicContact CD2-CD1 4.39Å; L258-I301 HydrophobicContact CD2-CG1 4.05Å
259	I	92.5	Very high	88.4	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-59	-48.6	179.4	-66.9	166.6	0	0	0	110.2	R202 L203 V255 T256 K261 Q262 E263 L295 I301	R202-I259 HydrophobicContact CB-CD1 4.12Å; R202-I259 HydrophobicContact CG-CD1 3.67Å; R202-I259 HydrophobicContact CG-CG2 4.31Å; L203-I259 HydrophobicContact CD2-CD1 3.48Å; L203-I259 VanDerWaalsContact CD2-CD1 3.48Å; L203-I259 HydrophobicContact CD2-CG1 3.66Å; L203-I259 HydrophobicContact CG-CD1 3.71Å; L203-I259 HydrophobicContact CG-CG1 4.44Å; V255-I259 HydrophobicContact CG1-CD1 3.77Å; V255-I259 HydrophobicContact CG1-CG1 4.31Å; V255-I259 VanDerWaalsContact O-CG1 3.28Å; V255-I259 WeakPolarHBondContact O-CG1 3.29Å; V255-I259 PolarHBondContact O-N 2.68Å; T256-I259 PolarHBondContact O-N 2.65Å; I259-K261 VanDerWaalsContact C-N 3.28Å; I259-K261 PolarHBondContact O-N 2.61Å; I259-Q262 PolarHBondContact O-N 2.93Å; I259-Q262 VanDerWaalsContact O-N 3.11Å; I259-E263 HydrophobicContact CG2-CG 4.35Å; I259-E263 WeakPolarHBondContact O-CG 3.09Å; I259-E263 PolarHBondContact O-N 2.85Å; I259-L295 HydrophobicContact CB-CD1 4.47Å; I259-L295 HydrophobicContact CG2-CD1 3.91Å; I259-I301 HydrophobicContact CG1-CD1 4.09Å; I259-I301 HydrophobicContact CG1-CG2 4.44Å
260	Q	90.5	Very high	86.9	Confident	94 Å²	94	54.6 Å²	54.6	44%	0.439	28%	0.283	S	S	.	.	H	α-helix	trans	-57	-41.3	176.3	-73.3	173.6	-25.1	0	0	112.5	T256 L258 A264	T256-Q260 WeakPolarHBondContact O-CG 3.25Å; T256-Q260 PolarHBondContact O-N 3.32Å; L258-Q260 PolarHBondContact O-N 3.37Å; Q260-A264 PolarHBondContact O-N 2.86Å; Q260-A264 VanDerWaalsContact O-N 3.15Å
261	K	90.5	Very high	85.2	Confident	120 Å²	120	56 Å²	56	52%	0.522	28%	0.281	S	S	.	.	H	α-helix	trans	-62.9	-45.3	176	179.8	-179.2	169.6	-178.8	0	111.6	L257 L258 I259 A264 E265	L257-K261 WeakPolarHBondContact O-CB 3.37Å; L257-K261 PolarHBondContact O-N 3.09Å; L257-K261 VanDerWaalsContact O-N 3.08Å; L258-K261 WeakPolarHBondContact O-CB 3.44Å; L258-K261 PolarHBondContact O-N 2.88Å; I259-K261 VanDerWaalsContact C-N 3.28Å; I259-K261 PolarHBondContact O-N 2.61Å; K261-A264 PolarHBondContact O-N 3.49Å; K261-E265 WeakPolarHBondContact CE-OE1 3.32Å; K261-E265 IonicContact NZ-OE1 3.3Å; K261-E265 WeakPolarHBondContact O-CG 3.2Å; K261-E265 PolarHBondContact O-N 3.09Å
262	Q	91	Very high	83.5	Confident	18 Å²	18	61.4 Å²	61.4	8%	0.084	31%	0.31	C	S	.	.	H	α-helix	trans	-67.9	-38.3	179.9	-65.2	-55.5	-81.6	0	0	112.3	L258 I259 A264 E265 E266 L295	L258-Q262 HydrophobicContact CD1-CG 4.26Å; L258-Q262 HydrophobicContact CG-CG 4.42Å; L258-Q262 WeakPolarHBondContact O-CG 3.27Å; L258-Q262 PolarHBondContact O-N 2.74Å; I259-Q262 PolarHBondContact O-N 2.93Å; I259-Q262 VanDerWaalsContact O-N 3.11Å; Q262-A264 VanDerWaalsContact C-N 3.29Å; Q262-A264 PolarHBondContact O-N 3.49Å; Q262-E265 PolarHBondContact NE2-OE2 3.44Å; Q262-E265 PolarHBondContact O-N 3.45Å; Q262-E266 PolarHBondContact O-N 3.1Å; Q262-L295 HydrophobicContact CB-CD1 3.77Å; Q262-L295 HydrophobicContact CB-CD2 4.27Å
263	E	87.4	Confident	82	Confident	15 Å²	15	63.9 Å²	63.9	7%	0.07	32%	0.323	C	S	.	.	H	α-helix	trans	-60.5	-38.5	173.7	-71.8	170.9	158.2	0	0	111.9	R202 I259 G267 V289 L295	R202-E263 IonicContact CZ-OE1 3.4Å; R202-E263 IonicContact CZ-OE2 2.77Å; R202-E263 IonicContact NH1-OE1 3.81Å; R202-E263 PolarHBondContact NH1-OE1 2.77Å; R202-E263 IonicContact NH1-OE2 3.35Å; R202-E263 PolarHBondContact NH1-OE2 3.35Å; R202-E263 IonicContact NH2-OE1 2.67Å; R202-E263 IonicContact NH2-OE2 2.79Å; R202-E263 PolarHBondContact NH2-OE2 3.42Å; I259-E263 HydrophobicContact CG2-CG 4.35Å; I259-E263 WeakPolarHBondContact O-CG 3.09Å; I259-E263 PolarHBondContact O-N 2.85Å; E263-G267 PolarHBondContact O-N 2.97Å; E263-G267 VanDerWaalsContact O-N 3.08Å; E263-V289 WeakPolarHBondContact O-CG2 3.44Å; E263-V289 PolarHBondContact O-N 3.19Å; E263-V289 VanDerWaalsContact O-N 3.15Å; E263-L295 HydrophobicContact CB-CD2 4.42Å; E263-L295 HydrophobicContact CG-CD1 4.41Å; E263-L295 HydrophobicContact CG-CD2 3.68Å; E263-L295 HydrophobicContact CG-CG 4.31Å
264	A	84.9	Confident	80.4	Confident	38 Å²	38	64.9 Å²	64.9	31%	0.314	33%	0.328	S	S	.	.	H	α-helix	trans	-69.6	-37.4	175.5	0	0	0	0	0	112.7	Q260 K261 Q262 R268	Q260-A264 PolarHBondContact O-N 2.86Å; Q260-A264 VanDerWaalsContact O-N 3.15Å; K261-A264 PolarHBondContact O-N 3.49Å; Q262-A264 VanDerWaalsContact C-N 3.29Å; Q262-A264 PolarHBondContact O-N 3.49Å; A264-R268 VanDerWaalsContact O-CG 3.31Å; A264-R268 WeakPolarHBondContact O-CG 3.18Å; A264-R268 PolarHBondContact O-N 3.33Å
265	E	84.9	Confident	78.6	Confident	79 Å²	79	64.6 Å²	64.6	37%	0.369	33%	0.331	S	S	.	.	H	α-helix	trans	-72.2	-46.2	179.2	-74.1	173.3	176.1	0	0	112.3	K261 Q262 G267 R268 T269	K261-E265 WeakPolarHBondContact CE-OE1 3.32Å; K261-E265 IonicContact NZ-OE1 3.3Å; K261-E265 WeakPolarHBondContact O-CG 3.2Å; K261-E265 PolarHBondContact O-N 3.09Å; Q262-E265 PolarHBondContact NE2-OE2 3.44Å; Q262-E265 PolarHBondContact O-N 3.45Å; E265-G267 VanDerWaalsContact C-N 3.33Å; E265-G267 PolarHBondContact O-N 3.27Å; E265-R268 PolarHBondContact O-N 3.16Å; E265-T269 PolarHBondContact O-N 3.09Å; E265-T269 VanDerWaalsContact O-N 3.1Å; E265-T269 PolarHBondContact O-OG1 3.44Å
266	E	83.1	Confident	76.9	Confident	42 Å²	42	68.7 Å²	68.7	20%	0.196	36%	0.359	C	S	.	.	H	α-helix	trans	-65.7	-37.2	176.6	-70.3	-173.4	-164	0	0	111.2	Q262 R268 T269 V270 V289 S296	Q262-E266 PolarHBondContact O-N 3.1Å; E266-R268 PolarHBondContact O-N 3.08Å; E266-T269 PolarHBondContact O-N 3.45Å; E266-V270 WeakPolarHBondContact O-CG2 3.3Å; E266-V270 PolarHBondContact O-N 3.41Å; E266-V289 HydrophobicContact CB-CG2 3.8Å; E266-S296 WeakPolarHBondContact OE1-CB 3.06Å; E266-S296 PolarHBondContact OE1-N 2.76Å; E266-S296 PolarHBondContact OE1-OG 3.44Å; E266-S296 PolarHBondContact OE2-N 2.67Å
267	G	73.7	Confident	75.2	Confident	9 Å²	9	74.3 Å²	74.3	9%	0.093	38%	0.381	C	S	.	.	H	α-helix	trans	-64.4	-41.4	178.7	0	0	0	0	0	112.4	E263 E265 L271 V289	E263-G267 PolarHBondContact O-N 2.97Å; E263-G267 VanDerWaalsContact O-N 3.08Å; E265-G267 VanDerWaalsContact C-N 3.33Å; E265-G267 PolarHBondContact O-N 3.27Å; G267-L271 PolarHBondContact O-N 3.1Å; G267-V289 VanDerWaalsContact N-CG2 3.33Å
268	R	63.6	Low	73.4	Confident	150 Å²	150	74.1 Å²	74.1	57%	0.566	39%	0.388	S	S	*	.	H	α-helix	trans	-62.8	-42.6	172.1	-72.5	176.3	-160.2	-154	2.4	111.9	A264 E265 E266 V270 L271 D272	A264-R268 VanDerWaalsContact O-CG 3.31Å; A264-R268 WeakPolarHBondContact O-CG 3.18Å; A264-R268 PolarHBondContact O-N 3.33Å; E265-R268 PolarHBondContact O-N 3.16Å; E266-R268 PolarHBondContact O-N 3.08Å; R268-V270 PolarHBondContact O-N 3.47Å; R268-L271 PolarHBondContact O-N 3.33Å; R268-D272 VanDerWaalsContact O-CG 3.31Å; R268-D272 PolarHBondContact O-N 2.89Å
269	T	62.3	Low	70.9	Confident	92 Å²	92	81.4 Å²	81.4	56%	0.564	43%	0.426	S	S	*	.	H	α-helix	trans	-63.7	-42.3	-177.8	-53.2	0	0	0	0	112.2	E265 E266 L271 F273	E265-T269 PolarHBondContact O-N 3.09Å; E265-T269 VanDerWaalsContact O-N 3.1Å; E265-T269 PolarHBondContact O-OG1 3.44Å; E266-T269 PolarHBondContact O-N 3.45Å; T269-L271 VanDerWaalsContact C-N 3.33Å; T269-F273 PolarHBondContact O-N 2.67Å; T269-F273 VanDerWaalsContact O-N 3.1Å
270	V	62.8	Low	69	Low	87 Å²	87	84.3 Å²	84.3	53%	0.527	45%	0.445	S	S	.	.	H	α-helix	trans	-63.7	-41.5	175.9	173.5	0	0	0	0	110.8	E266 R268 F273 L274	E266-V270 WeakPolarHBondContact O-CG2 3.3Å; E266-V270 PolarHBondContact O-N 3.41Å; R268-V270 PolarHBondContact O-N 3.47Å; V270-F273 PolarHBondContact O-N 2.77Å; V270-L274 HydrophobicContact CG1-CD1 4.07Å; V270-L274 WeakPolarHBondContact O-CG 3.38Å; V270-L274 PolarHBondContact O-N 2.82Å
271	L	58.4	Low	66.9	Low	68 Å²	68	87 Å²	87	36%	0.356	46%	0.462	S	S	.	.	H	α-helix	trans	-68.5	-44.1	178.8	-170.7	67	0	0	0	112.1	G267 R268 T269 F273 L274 C275 F286	G267-L271 PolarHBondContact O-N 3.1Å; R268-L271 PolarHBondContact O-N 3.33Å; T269-L271 VanDerWaalsContact C-N 3.33Å; L271-F273 PolarHBondContact O-N 2.79Å; L271-L274 CarbonylContact O-C 3.45Å; L271-L274 PolarHBondContact O-N 2.75Å; L271-C275 WeakPolarHBondContact O-CB 3.31Å; L271-C275 PolarHBondContact O-N 3.3Å; L271-C275 PolarHBondContact O-SG 3.4Å; L271-F286 HydrophobicContact CD2-CD1 4.25Å
272	D	60.8	Low	64.9	Low	113 Å²	113	88.9 Å²	88.9	60%	0.604	47%	0.472	S	S	*	.	H	α-helix	trans	-57.9	-39	175.9	-72.3	-16.4	0	0	0	111.2	R268 S276	R268-D272 VanDerWaalsContact O-CG 3.31Å; R268-D272 PolarHBondContact O-N 2.89Å; D272-S276 PolarHBondContact O-N 3.23Å
273	F	63.5	Low	62.6	Low	134 Å²	134	92.8 Å²	92.8	59%	0.588	50%	0.502	S	S	*	.	H	α-helix	trans	-64.6	-45.4	173	-178	-98.9	0	0	0	112.2	T269 V270 L271 S276 F277	T269-F273 PolarHBondContact O-N 2.67Å; T269-F273 VanDerWaalsContact O-N 3.1Å; V270-F273 PolarHBondContact O-N 2.77Å; L271-F273 PolarHBondContact O-N 2.79Å; F273-S276 WeakPolarHBondContact O-CB 3.49Å; F273-S276 PolarHBondContact O-N 3.16Å; F273-S276 PolarHBondContact O-OG 3.48Å; F273-F277 HydrophobicContact CE1-CE2 4.04Å; F273-F277 HydrophobicContact CE2-CE2 4.07Å; F273-F277 AromaticContact CZ-CE2 3.79Å; F273-F277 HydrophobicContact CZ-CE2 3.79Å; F273-F277 HydrophobicContact CZ-CZ 4.46Å; F273-F277 VanDerWaalsContact O-CD2 3.31Å; F273-F277 WeakPolarHBondContact O-CD2 3.35Å
274	L	62.4	Low	60.4	Low	104 Å²	104	98.9 Å²	98.9	55%	0.545	54%	0.535	S	S	.	.	H	α-helix	trans	-67.2	-40	177.9	-68.3	172.1	0	0	0	112.5	V270 L271 S276 F277	V270-L274 HydrophobicContact CG1-CD1 4.07Å; V270-L274 WeakPolarHBondContact O-CG 3.38Å; V270-L274 PolarHBondContact O-N 2.82Å; L271-L274 CarbonylContact O-C 3.45Å; L271-L274 PolarHBondContact O-N 2.75Å; L274-S276 PolarHBondContact O-N 2.89Å; L274-F277 PolarHBondContact O-N 2.73Å; L274-F277 VanDerWaalsContact O-N 3.08Å
275	C	58.4	Low	58.6	Low	40 Å²	40	102.4 Å²	102.4	27%	0.27	56%	0.555	S	S	.	*	H	α-helix	trans	-67.3	-22.2	175.1	-69.8	0	0	0	0	112.7	L271 F277 S278 P280	L271-C275 WeakPolarHBondContact O-CB 3.31Å; L271-C275 PolarHBondContact O-N 3.3Å; L271-C275 PolarHBondContact O-SG 3.4Å; C275-F277 PolarHBondContact O-N 3.25Å; C275-S278 CarbonylContact C-O 3.58Å; C275-S278 WeakPolarHBondContact CA-O 3.25Å; C275-S278 CarbonylContact O-C 3.44Å; C275-S278 PolarHBondContact O-N 3.19Å; C275-P280 HydrophobicContact CB-CG 4.22Å
276	S	59.8	Low	56.9	Low	85 Å²	85	105.6 Å²	105.6	59%	0.594	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-12	171	78.7	0	0	0	0	113.5	D272 F273 L274	D272-S276 PolarHBondContact O-N 3.23Å; F273-S276 WeakPolarHBondContact O-CB 3.49Å; F273-S276 PolarHBondContact O-N 3.16Å; F273-S276 PolarHBondContact O-OG 3.48Å; L274-S276 PolarHBondContact O-N 2.89Å
277	F	59.8	Low	55.1	Low	151 Å²	151	108.7 Å²	108.7	66%	0.662	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	-2	174.3	-66	-80.4	0	0	0	114	F273 L274 C275	F273-F277 HydrophobicContact CE1-CE2 4.04Å; F273-F277 HydrophobicContact CE2-CE2 4.07Å; F273-F277 AromaticContact CZ-CE2 3.79Å; F273-F277 HydrophobicContact CZ-CE2 3.79Å; F273-F277 HydrophobicContact CZ-CZ 4.46Å; F273-F277 VanDerWaalsContact O-CD2 3.31Å; F273-F277 WeakPolarHBondContact O-CD2 3.35Å; L274-F277 PolarHBondContact O-N 2.73Å; L274-F277 VanDerWaalsContact O-N 3.08Å; C275-F277 PolarHBondContact O-N 3.25Å
278	S	54.7	Low	54.1	Low	90 Å²	90	110.1 Å²	110.1	63%	0.629	61%	0.606	S	S	*	*	S	Bend	trans	-163.2	135.3	175.4	-70.1	0	0	0	0	111.9	C275	C275-S278 CarbonylContact C-O 3.58Å; C275-S278 WeakPolarHBondContact CA-O 3.25Å; C275-S278 CarbonylContact O-C 3.44Å; C275-S278 PolarHBondContact O-N 3.19Å
279	L	44	Very low	53.9	Low	179 Å²	179	104.5 Å²	104.5	94%	0.937	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-59.2	128.1	179.7	-72.4	163.7	0	0	0	111.8
280	P	52.8	Low	53.8	Low	63 Å²	63	107.9 Å²	107.9	41%	0.409	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-93.8	139.9	178	32.4	-29	0	0	0	113.4	C275	C275-P280 HydrophobicContact CB-CG 4.22Å
281	D	45.9	Very low	53.6	Low	151 Å²	151	111.1 Å²	111.1	81%	0.807	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-83.7	122.1	164	-165.4	3.8	0	0	0	108.6	S283	D281-S283 PolarHBondContact O-N 2.83Å
282	H	48.5	Very low	53.6	Low	158 Å²	158	108.2 Å²	108.2	73%	0.731	59%	0.593	S	S	*	*			trans	-94.1	89	-171	-74.8	-64.9	0	0	0	110.8
283	S	42.1	Very low	54.3	Low	100 Å²	100	105.7 Å²	105.7	70%	0.699	58%	0.582	S	S	*	*			trans	-151.3	-2.8	167.2	55.4	0	0	0	0	118	D281	D281-S283 PolarHBondContact O-N 2.83Å
284	D	42.3	Very low	55.2	Low	143 Å²	143	101.4 Å²	101.4	77%	0.765	57%	0.567	S	S	*	*	S	Bend	trans	-98.6	143.6	-179.4	-96.4	-32.2	0	0	0	114.9	F286	D284-F286 PolarHBondContact O-N 3.39Å
285	P	46.1	Very low	56.4	Low	113 Å²	113	96.7 Å²	96.7	73%	0.734	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-64.7	120.6	174.3	-10.8	25.3	0	0	0	110.5	P287	P285-P287 WeakPolarHBondContact O-CD 3.34Å
286	F	49.3	Very low	58	Low	145 Å²	145	99.4 Å²	99.4	64%	0.636	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-51.8	119.4	-175.1	-63.2	-88.2	0	0	0	114.2	L271 D284	L271-F286 HydrophobicContact CD2-CD1 4.25Å; D284-F286 PolarHBondContact O-N 3.39Å
287	P	46.6	Very low	59.6	Low	108 Å²	108	95.3 Å²	95.3	70%	0.701	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-81.1	120.7	164.2	30	-26.3	0	0	0	108.9	P285	P285-P287 WeakPolarHBondContact O-CD 3.34Å
288	G	53	Low	61.3	Low	39 Å²	39	88.6 Å²	88.6	40%	0.402	50%	0.504	S	S	.	.			trans	-66.2	-173.5	169.3	0	0	0	0	0	111.9	E290	G288-E290 PolarHBondContact O-N 2.87Å
289	V	57.8	Low	63.3	Low	31 Å²	31	86.3 Å²	86.3	19%	0.188	49%	0.485	C	S	.	.	S	Bend	trans	-54.9	133.6	167.4	-174.4	0	0	0	0	108.5	E263 E266 G267 E291 T293	E263-V289 WeakPolarHBondContact O-CG2 3.44Å; E263-V289 PolarHBondContact O-N 3.19Å; E263-V289 VanDerWaalsContact O-N 3.15Å; E266-V289 HydrophobicContact CB-CG2 3.8Å; G267-V289 VanDerWaalsContact N-CG2 3.33Å; V289-E291 PolarHBondContact O-N 3.49Å; V289-T293 HydrophobicContact CG1-CG2 3.62Å; V289-T293 VanDerWaalsContact CG1-OG1 3.3Å; V289-T293 WeakPolarHBondContact CG1-OG1 3.42Å
290	E	60.1	Low	65.9	Low	163 Å²	163	78.9 Å²	78.9	76%	0.762	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-51.3	132.8	178.2	-76.8	-171.5	172.1	0	0	110.5	G288 G292 T293	G288-E290 PolarHBondContact O-N 2.87Å; E290-G292 PolarHBondContact O-N 2.98Å; E290-G292 VanDerWaalsContact O-N 3.13Å; E290-T293 PolarHBondContact O-N 2.61Å; E290-T293 PolarHBondContact O-OG1 3.23Å
291	E	59	Low	68	Low	155 Å²	155	75.9 Å²	75.9	72%	0.724	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	122.8	-179.7	-176	173.4	-169.8	0	0	109.8	R202 V289	R202-E291 IonicContact NE-OE1 3.58Å; V289-E291 PolarHBondContact O-N 3.49Å
292	G	59.4	Low	70.5	Confident	7 Å²	7	68.7 Å²	68.7	7%	0.072	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	14.6	179.4	0	0	0	0	0	115.8	S204 K207 E290	S204-G292 WeakPolarHBondContact CB-O 3.1Å; S204-G292 WeakPolarHBondContact OG-CA 3.36Å; S204-G292 PolarHBondContact OG-O 3.13Å; S204-G292 VanDerWaalsContact OG-O 3.11Å; K207-G292 WeakPolarHBondContact CD-O 3.26Å; K207-G292 VanDerWaalsContact CE-O 3.24Å; K207-G292 WeakPolarHBondContact CE-O 3.2Å; K207-G292 PolarHBondContact NZ-O 2.92Å; E290-G292 PolarHBondContact O-N 2.98Å; E290-G292 VanDerWaalsContact O-N 3.13Å
293	T	73.9	Confident	72.8	Confident	60 Å²	60	61.3 Å²	61.3	37%	0.368	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-72.1	149.8	159.1	-52.2	0	0	0	0	110	V289 E290 L295	V289-T293 HydrophobicContact CG1-CG2 3.62Å; V289-T293 VanDerWaalsContact CG1-OG1 3.3Å; V289-T293 WeakPolarHBondContact CG1-OG1 3.42Å; E290-T293 PolarHBondContact O-N 2.61Å; E290-T293 PolarHBondContact O-OG1 3.23Å; T293-L295 PolarHBondContact O-N 3.1Å
294	V	84.1	Confident	75.5	Confident	44 Å²	44	56.6 Å²	56.6	27%	0.267	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-77.6	117.8	178.5	-176	0	0	0	0	109.3	K207 L208 V298	K207-V294 HydrophobicContact CB-CG2 4.06Å; L208-V294 HydrophobicContact CD1-CG1 4.19Å; L208-V294 HydrophobicContact CD2-CG1 4.03Å; L208-V294 HydrophobicContact CD2-CG2 4.14Å; L208-V294 HydrophobicContact CG-CG1 4.24Å; L208-V294 HydrophobicContact CG-CG2 4.18Å; V294-V298 HydrophobicContact CG1-CB 4.25Å; V294-V298 HydrophobicContact CG1-CG1 4Å; V294-V298 HydrophobicContact CG1-CG2 4.43Å
295	L	87.8	Confident	78.1	Confident	5 Å²	5	49.8 Å²	49.8	3%	0.026	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-66.8	148.1	177.5	-68.4	178.4	0	0	0	112.5	I259 Q262 E263 T293 C297 V298 I301	I259-L295 HydrophobicContact CB-CD1 4.47Å; I259-L295 HydrophobicContact CG2-CD1 3.91Å; Q262-L295 HydrophobicContact CB-CD1 3.77Å; Q262-L295 HydrophobicContact CB-CD2 4.27Å; E263-L295 HydrophobicContact CB-CD2 4.42Å; E263-L295 HydrophobicContact CG-CD1 4.41Å; E263-L295 HydrophobicContact CG-CD2 3.68Å; E263-L295 HydrophobicContact CG-CG 4.31Å; T293-L295 PolarHBondContact O-N 3.1Å; L295-C297 PolarHBondContact O-N 3.32Å; L295-V298 WeakPolarHBondContact O-CB 3.14Å; L295-V298 WeakPolarHBondContact O-CG1 3.49Å; L295-V298 PolarHBondContact O-N 3.15Å; L295-I301 HydrophobicContact CD1-CD1 3.96Å
296	S	90.8	Very high	80.5	Confident	97 Å²	97	44.8 Å²	44.8	68%	0.678	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-31.3	175.6	71.4	0	0	0	0	113.1	E266	E266-S296 WeakPolarHBondContact OE1-CB 3.06Å; E266-S296 PolarHBondContact OE1-N 2.76Å; E266-S296 PolarHBondContact OE1-OG 3.44Å; E266-S296 PolarHBondContact OE2-N 2.67Å
297	C	93.9	Very high	82.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	18.3	-179.2	63.1	0	0	0	0	114.1	F232 L295 N299 D300 I301	F232-C297 HydrophobicContact CE2-CB 4.09Å; F232-C297 HydrophobicContact CZ-CB 4.21Å; L295-C297 PolarHBondContact O-N 3.32Å; C297-N299 VanDerWaalsContact C-N 3.3Å; C297-N299 PolarHBondContact O-N 2.9Å; C297-D300 PolarHBondContact O-N 3.26Å; C297-D300 VanDerWaalsContact O-N 3.11Å; C297-I301 PolarHBondContact O-N 2.78Å; C297-I301 VanDerWaalsContact O-N 3.08Å
298	V	95.3	Very high	85.2	Confident	9 Å²	9	35 Å²	35	6%	0.055	20%	0.2	C	C	.	.	H	α-helix	trans	-55.4	-40	-175.7	65	0	0	0	0	113.5	L203 L205 L223 V294 L295 D300 I301 A302	L203-V298 HydrophobicContact CB-CG2 4.26Å; L203-V298 HydrophobicContact CD1-CG2 4.26Å; L203-V298 HydrophobicContact CD2-CG2 4.28Å; L205-V298 HydrophobicContact CD2-CG2 3.27Å; L223-V298 HydrophobicContact CD1-CG2 3.98Å; V294-V298 HydrophobicContact CG1-CB 4.25Å; V294-V298 HydrophobicContact CG1-CG1 4Å; V294-V298 HydrophobicContact CG1-CG2 4.43Å; L295-V298 WeakPolarHBondContact O-CB 3.14Å; L295-V298 WeakPolarHBondContact O-CG1 3.49Å; L295-V298 PolarHBondContact O-N 3.15Å; V298-D300 PolarHBondContact O-N 3.23Å; V298-I301 PolarHBondContact O-N 2.92Å; V298-A302 WeakPolarHBondContact O-CB 3.4Å; V298-A302 PolarHBondContact O-N 3.13Å
299	N	97.1	Very high	87.3	Confident	43 Å²	43	33.1 Å²	33.1	23%	0.23	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-41.8	178.8	-66.6	-2.4	0	0	0	111.5	L223 D226 C297 A302 A303	L223-N299 WeakPolarHBondContact O-CB 3.41Å; D226-N299 WeakPolarHBondContact CB-ND2 3.36Å; D226-N299 PolarHBondContact O-ND2 2.56Å; C297-N299 VanDerWaalsContact C-N 3.3Å; C297-N299 PolarHBondContact O-N 2.9Å; N299-A302 WeakPolarHBondContact O-CB 3.36Å; N299-A302 PolarHBondContact O-N 3.37Å; N299-A303 WeakPolarHBondContact O-CB 3.41Å; N299-A303 PolarHBondContact O-N 2.85Å
300	D	97.8	Very high	89.1	Confident	22 Å²	22	31.7 Å²	31.7	12%	0.118	17%	0.172	C	C	.	.	H	α-helix	trans	-69	-38.8	180	-58.3	-40	0	0	0	111.6	G227 D228 R231 F232 C297 V298 A303 A304	G227-D300 WeakPolarHBondContact CA-OD1 3.37Å; D228-D300 PolarHBondContact N-OD1 3.4Å; R231-D300 HydrophobicContact CB-CB 4.18Å; R231-D300 VanDerWaalsContact CD-CG 3.43Å; R231-D300 WeakPolarHBondContact CD-OD2 3.36Å; R231-D300 HydrophobicContact CG-CB 4.45Å; R231-D300 IonicContact CZ-OD2 3.64Å; R231-D300 IonicContact NE-OD2 3.35Å; R231-D300 IonicContact NH1-OD2 3.77Å; R231-D300 PolarHBondContact NH1-OD2 3.37Å; F232-D300 HydrophobicContact CD2-CB 3.98Å; F232-D300 HydrophobicContact CE2-CB 3.82Å; C297-D300 PolarHBondContact O-N 3.26Å; C297-D300 VanDerWaalsContact O-N 3.11Å; V298-D300 PolarHBondContact O-N 3.23Å; D300-A303 PolarHBondContact O-N 3.04Å; D300-A304 VanDerWaalsContact O-CB 3.28Å; D300-A304 WeakPolarHBondContact O-CB 3.33Å; D300-A304 PolarHBondContact O-N 3.1Å
301	I	97.6	Very high	90.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.7	-42.9	174	-61	175.2	0	0	0	110.1	L203 F232 V255 L258 I259 L295 C297 V298 T305	L203-I301 HydrophobicContact CD1-CB 4.49Å; L203-I301 HydrophobicContact CD1-CG2 4.07Å; L203-I301 HydrophobicContact CD2-CB 4.35Å; L203-I301 HydrophobicContact CD2-CD1 4.06Å; L203-I301 HydrophobicContact CD2-CG2 4.09Å; F232-I301 HydrophobicContact CD2-CG1 3.94Å; F232-I301 HydrophobicContact CE2-CG1 3.74Å; V255-I301 HydrophobicContact CG1-CG2 3.89Å; L258-I301 HydrophobicContact CD2-CD1 4.39Å; L258-I301 HydrophobicContact CD2-CG1 4.05Å; I259-I301 HydrophobicContact CG1-CD1 4.09Å; I259-I301 HydrophobicContact CG1-CG2 4.44Å; L295-I301 HydrophobicContact CD1-CD1 3.96Å; C297-I301 PolarHBondContact O-N 2.78Å; C297-I301 VanDerWaalsContact O-N 3.08Å; V298-I301 PolarHBondContact O-N 2.92Å; I301-T305 VanDerWaalsContact O-CB 3.26Å; I301-T305 WeakPolarHBondContact O-CB 3.48Å; I301-T305 PolarHBondContact O-N 2.88Å; I301-T305 PolarHBondContact O-OG1 3.04Å
302	A	97.7	Very high	92.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.7	-48	175.8	0	0	0	0	0	111.4	I220 L223 V298 N299 T305 Q306	I220-A302 HydrophobicContact CD1-CB 3.96Å; I220-A302 HydrophobicContact CG2-CB 4.24Å; L223-A302 HydrophobicContact CB-CB 3.98Å; V298-A302 WeakPolarHBondContact O-CB 3.4Å; V298-A302 PolarHBondContact O-N 3.13Å; N299-A302 WeakPolarHBondContact O-CB 3.36Å; N299-A302 PolarHBondContact O-N 3.37Å; A302-T305 PolarHBondContact O-N 2.71Å; A302-Q306 WeakPolarHBondContact O-CB 3.43Å; A302-Q306 PolarHBondContact O-N 2.91Å
303	A	97.6	Very high	94.3	Very high	4 Å²	4	17 Å²	17	3%	0.033	10%	0.103	C	C	.	.	H	α-helix	trans	-61.7	-47.3	178.3	0	0	0	0	0	112.5	A224 R229 N299 D300 T305 H307	A224-A303 HydrophobicContact CB-CB 4.09Å; R229-A303 HydrophobicContact CB-CB 4.03Å; N299-A303 WeakPolarHBondContact O-CB 3.41Å; N299-A303 PolarHBondContact O-N 2.85Å; D300-A303 PolarHBondContact O-N 3.04Å; A303-T305 VanDerWaalsContact C-N 3.35Å; A303-T305 PolarHBondContact O-N 3.14Å; A303-H307 WeakPolarHBondContact O-CB 3.06Å; A303-H307 PolarHBondContact O-N 3.43Å
304	A	97.6	Very high	95.3	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-65.4	-37.4	177.8	0	0	0	0	0	112.3	F232 F234 D300 T308	F232-A304 HydrophobicContact CB-CB 4.02Å; F232-A304 WeakPolarHBondContact O-CB 3.15Å; F234-A304 HydrophobicContact CD2-CB 4.05Å; F234-A304 HydrophobicContact CE2-CB 3.6Å; D300-A304 VanDerWaalsContact O-CB 3.28Å; D300-A304 WeakPolarHBondContact O-CB 3.33Å; D300-A304 PolarHBondContact O-N 3.1Å; A304-T308 WeakPolarHBondContact O-CB 3.39Å; A304-T308 PolarHBondContact O-N 3.36Å; A304-T308 PolarHBondContact O-OG1 3.42Å
305	T	97.8	Very high	95.8	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-65.2	-53.3	176.5	-60.2	0	0	0	0	110.6	L196 V199 V255 I301 A302 A303 H307 T308 V309	L196-T305 HydrophobicContact CD2-CG2 4.29Å; V199-T305 HydrophobicContact CG1-CG2 4.17Å; V199-T305 HydrophobicContact CG2-CG2 4.27Å; V255-T305 HydrophobicContact CG2-CG2 4.34Å; I301-T305 VanDerWaalsContact O-CB 3.26Å; I301-T305 WeakPolarHBondContact O-CB 3.48Å; I301-T305 PolarHBondContact O-N 2.88Å; I301-T305 PolarHBondContact O-OG1 3.04Å; A302-T305 PolarHBondContact O-N 2.71Å; A303-T305 VanDerWaalsContact C-N 3.35Å; A303-T305 PolarHBondContact O-N 3.14Å; T305-H307 VanDerWaalsContact C-N 3.3Å; T305-H307 PolarHBondContact O-N 3.01Å; T305-T308 PolarHBondContact O-N 3.09Å; T305-T308 VanDerWaalsContact O-N 3.13Å; T305-V309 WeakPolarHBondContact O-CG2 3.42Å; T305-V309 PolarHBondContact O-N 2.78Å
306	Q	97.6	Very high	96.2	Very high	9 Å²	9	15.7 Å²	15.7	4%	0.042	9%	0.088	C	C	.	.	H	α-helix	trans	-57.7	-45	178.5	-177.1	-176.2	76.3	0	0	111.2	I220 E221 A224 A302 T308 V309 A310 N346 Y348	I220-Q306 HydrophobicContact CG2-CB 4.1Å; E221-Q306 VanDerWaalsContact CA-NE2 3.26Å; A224-Q306 HydrophobicContact CB-CB 4.46Å; A302-Q306 WeakPolarHBondContact O-CB 3.43Å; A302-Q306 PolarHBondContact O-N 2.91Å; Q306-T308 VanDerWaalsContact C-N 3.29Å; Q306-T308 PolarHBondContact O-N 2.92Å; Q306-V309 PolarHBondContact O-N 3.3Å; Q306-A310 WeakPolarHBondContact O-CB 3.42Å; Q306-A310 PolarHBondContact O-N 2.79Å; Q306-N346 PolarHBondContact NE2-ND2 3.02Å; Q306-Y348 VanDerWaalsContact CD-CB 3.49Å; Q306-Y348 HydrophobicContact CG-CD1 3.83Å; Q306-Y348 HydrophobicContact CG-CG 4.16Å
307	H	96.7	Very high	96.5	Very high	38 Å²	38	11 Å²	11	18%	0.176	6%	0.056	C	C	.	.	H	α-helix	trans	-59.4	-40.6	177.8	-178.5	64.5	0	0	0	112.5	R229 A303 T305 S311 Y348	R229-H307 HydrophobicContact CB-CB 4Å; R229-H307 PolarHBondContact NH1-CE1 3.48Å; A303-H307 WeakPolarHBondContact O-CB 3.06Å; A303-H307 PolarHBondContact O-N 3.43Å; T305-H307 VanDerWaalsContact C-N 3.3Å; T305-H307 PolarHBondContact O-N 3.01Å; H307-S311 VanDerWaalsContact O-CB 3.23Å; H307-S311 WeakPolarHBondContact O-CB 3.19Å; H307-S311 PolarHBondContact O-N 3.26Å; H307-S311 PolarHBondContact O-OG 2.83Å; H307-Y348 HydrophobicContact CB-CE1 4.33Å; H307-Y348 AromaticContact ND1-CZ 3.81Å; H307-Y348 PolarHBondContact ND1-OH 2.85Å
308	T	96.4	Very high	96.6	Very high	8 Å²	8	11.5 Å²	11.5	5%	0.049	6%	0.058	C	C	.	.	H	α-helix	trans	-70.6	-40.5	-179.9	-53.9	0	0	0	0	111.7	F234 L251 A304 T305 Q306 S311 H312	F234-T308 HydrophobicContact CB-CG2 4.07Å; L251-T308 HydrophobicContact CD1-CG2 3.72Å; L251-T308 HydrophobicContact CD2-CG2 3.92Å; L251-T308 HydrophobicContact CG-CG2 4.42Å; A304-T308 WeakPolarHBondContact O-CB 3.39Å; A304-T308 PolarHBondContact O-N 3.36Å; A304-T308 PolarHBondContact O-OG1 3.42Å; T305-T308 PolarHBondContact O-N 3.09Å; T305-T308 VanDerWaalsContact O-N 3.13Å; Q306-T308 VanDerWaalsContact C-N 3.29Å; Q306-T308 PolarHBondContact O-N 2.92Å; T308-S311 PolarHBondContact O-N 2.93Å; T308-H312 WeakPolarHBondContact O-CB 3.16Å; T308-H312 PolarHBondContact O-N 3.11Å
309	V	97.1	Very high	96.7	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.006	6%	0.058	C	C	.	.	H	α-helix	trans	-60.1	-52	172.9	171.6	0	0	0	0	110.4	P192 L196 F248 L251 T305 Q306 S311 H312 L313 I349	P192-V309 HydrophobicContact CB-CG1 4Å; L196-V309 HydrophobicContact CD2-CG2 4.26Å; F248-V309 HydrophobicContact CD1-CG2 4.34Å; F248-V309 HydrophobicContact CE1-CG1 4.06Å; F248-V309 HydrophobicContact CE1-CG2 4.44Å; L251-V309 HydrophobicContact CD2-CG2 3.65Å; T305-V309 WeakPolarHBondContact O-CG2 3.42Å; T305-V309 PolarHBondContact O-N 2.78Å; Q306-V309 PolarHBondContact O-N 3.3Å; V309-S311 VanDerWaalsContact C-N 3.34Å; V309-S311 PolarHBondContact O-N 3.09Å; V309-H312 PolarHBondContact O-N 3.2Å; V309-L313 HydrophobicContact CG1-CD1 4.09Å; V309-L313 WeakPolarHBondContact O-CG 3.37Å; V309-L313 PolarHBondContact O-N 2.92Å; V309-I349 HydrophobicContact CG1-CD1 4.11Å
310	A	96.3	Very high	96.7	Very high	1 Å²	1	9.8 Å²	9.8	1%	0.008	5%	0.047	C	C	.	.	H	α-helix	trans	-59.3	-43.9	179.7	0	0	0	0	0	112	Q306 H312 L313 A314 Y348 I349 A352 I430	Q306-A310 WeakPolarHBondContact O-CB 3.42Å; Q306-A310 PolarHBondContact O-N 2.79Å; A310-H312 VanDerWaalsContact C-N 3.33Å; A310-H312 PolarHBondContact O-N 3.24Å; A310-L313 PolarHBondContact O-N 3.4Å; A310-A314 VanDerWaalsContact O-CB 3.26Å; A310-A314 WeakPolarHBondContact O-CB 3.47Å; A310-A314 PolarHBondContact O-N 3.44Å; A310-Y348 HydrophobicContact CB-CD1 3.8Å; A310-Y348 HydrophobicContact CB-CE1 3.81Å; A310-I349 HydrophobicContact CB-CG1 3.91Å; A310-A352 HydrophobicContact CB-CB 3.93Å; A310-I430 HydrophobicContact CB-CD1 4.38Å
311	S	94.6	Very high	96.7	Very high	14 Å²	14	8.9 Å²	8.9	10%	0.098	4%	0.042	C	C	.	.	H	α-helix	trans	-63.3	-37.8	177.5	-65.7	0	0	0	0	112.7	H307 T308 V309 K315	H307-S311 VanDerWaalsContact O-CB 3.23Å; H307-S311 WeakPolarHBondContact O-CB 3.19Å; H307-S311 PolarHBondContact O-N 3.26Å; H307-S311 PolarHBondContact O-OG 2.83Å; T308-S311 PolarHBondContact O-N 2.93Å; V309-S311 VanDerWaalsContact C-N 3.34Å; V309-S311 PolarHBondContact O-N 3.09Å; S311-K315 WeakPolarHBondContact O-CB 3.45Å; S311-K315 VanDerWaalsContact O-CG 3.25Å; S311-K315 WeakPolarHBondContact O-CG 3.47Å; S311-K315 PolarHBondContact O-N 2.6Å
312	H	95.7	Very high	96.6	Very high	2 Å²	2	10.3 Å²	10.3	1%	0.009	5%	0.05	C	C	.	.	H	α-helix	trans	-66	-49.6	176.1	-171.9	39.7	0	0	0	111.3	T236 P237 S247 F248 T308 V309 A310 A314 K315 R316	T236-H312 HydrophobicContact CG2-CB 3.99Å; P237-H312 PolarHBondContact O-CE1 3.47Å; P237-H312 PolarHBondContact O-ND1 3.15Å; S247-H312 PolarHBondContact N-NE2 2.99Å; S247-H312 PolarHBondContact O-CD2 3.08Å; S247-H312 PolarHBondContact O-NE2 3.39Å; F248-H312 HydrophobicContact CE1-CB 4.48Å; F248-H312 AromaticContact CE1-CD2 3.62Å; F248-H312 AromaticContact CZ-CD2 3.76Å; T308-H312 WeakPolarHBondContact O-CB 3.16Å; T308-H312 PolarHBondContact O-N 3.11Å; V309-H312 PolarHBondContact O-N 3.2Å; A310-H312 VanDerWaalsContact C-N 3.33Å; A310-H312 PolarHBondContact O-N 3.24Å; H312-A314 VanDerWaalsContact C-N 3.34Å; H312-A314 PolarHBondContact O-N 3.01Å; H312-K315 PolarHBondContact O-N 3.38Å; H312-R316 WeakPolarHBondContact O-CG 3.37Å; H312-R316 PolarHBondContact O-N 3.18Å; H312-R316 VanDerWaalsContact O-N 3.08Å
313	L	96.8	Very high	96.7	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-56.5	-47.6	176.3	-68.2	176.9	0	0	0	111.5	V165 F246 F248 V309 A310 K315 R316 T317 I349	V165-L313 HydrophobicContact CG1-CD1 4.22Å; V165-L313 HydrophobicContact CG1-CD2 3.7Å; F246-L313 HydrophobicContact CD1-CD2 3.88Å; F246-L313 HydrophobicContact CE1-CD2 3.59Å; F246-L313 HydrophobicContact CZ-CD2 4.33Å; F248-L313 HydrophobicContact CZ-CD2 3.9Å; F248-L313 HydrophobicContact CZ-CG 4.41Å; V309-L313 HydrophobicContact CG1-CD1 4.09Å; V309-L313 WeakPolarHBondContact O-CG 3.37Å; V309-L313 PolarHBondContact O-N 2.92Å; A310-L313 PolarHBondContact O-N 3.4Å; L313-K315 PolarHBondContact O-N 2.86Å; L313-R316 PolarHBondContact O-N 2.96Å; L313-T317 VanDerWaalsContact O-CB 3.3Å; L313-T317 WeakPolarHBondContact O-CB 3.36Å; L313-T317 PolarHBondContact O-N 2.87Å; L313-T317 PolarHBondContact O-OG1 3.31Å; L313-I349 HydrophobicContact CD1-CD1 4.21Å; L313-I349 HydrophobicContact CD1-CG2 3.87Å
314	A	95.6	Very high	96.7	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-60	-45.9	178.7	0	0	0	0	0	112.5	A310 H312 T317 H318 V356 I428	A310-A314 VanDerWaalsContact O-CB 3.26Å; A310-A314 WeakPolarHBondContact O-CB 3.47Å; A310-A314 PolarHBondContact O-N 3.44Å; H312-A314 VanDerWaalsContact C-N 3.34Å; H312-A314 PolarHBondContact O-N 3.01Å; A314-T317 PolarHBondContact O-N 3Å; A314-H318 VanDerWaalsContact O-CB 3.28Å; A314-H318 WeakPolarHBondContact O-CB 3.46Å; A314-H318 PolarHBondContact O-N 2.91Å; A314-V356 HydrophobicContact CB-CG2 3.71Å; A314-I428 HydrophobicContact CB-CD1 3.96Å
315	K	94.2	Very high	96.5	Very high	76 Å²	76	16.9 Å²	16.9	33%	0.33	7%	0.074	S	C	.	.	H	α-helix	trans	-63.3	-44.4	179.3	-75.7	170.9	-176	177.1	0	112.5	T236 S311 H312 L313 R319 L423	T236-K315 HydrophobicContact CG2-CD 4.21Å; T236-K315 PolarHBondContact OG1-NZ 3Å; T236-K315 VanDerWaalsContact OG1-NZ 3.11Å; S311-K315 WeakPolarHBondContact O-CB 3.45Å; S311-K315 VanDerWaalsContact O-CG 3.25Å; S311-K315 WeakPolarHBondContact O-CG 3.47Å; S311-K315 PolarHBondContact O-N 2.6Å; H312-K315 PolarHBondContact O-N 3.38Å; L313-K315 PolarHBondContact O-N 2.86Å; K315-R319 PolarHBondContact O-N 3Å; K315-R319 VanDerWaalsContact O-N 3.16Å; K315-L423 HydrophobicContact CB-CD1 3.92Å; K315-L423 HydrophobicContact CG-CD1 4.16Å; K315-L423 WeakPolarHBondContact O-CD1 3.3Å
316	R	96.2	Very high	96.4	Very high	5 Å²	5	22 Å²	22	2%	0.019	11%	0.106	C	C	.	.	H	α-helix	trans	-66.5	-42.8	178.4	-66.8	-58.2	-173.3	-150.9	-5.4	111.7	L172 M238 T241 D243 C245 F246 H312 L313 R319 A320	L172-R316 HydrophobicContact CD1-CB 4.07Å; M238-R316 PolarHBondContact O-NH2 3.3Å; T241-R316 PolarHBondContact O-NH1 3.45Å; D243-R316 WeakPolarHBondContact O-CD 3.43Å; D243-R316 PolarHBondContact O-NH1 3.23Å; D243-R316 IonicContact OD1-CZ 3.37Å; D243-R316 IonicContact OD1-NH1 3.42Å; D243-R316 IonicContact OD1-NH2 3.53Å; C245-R316 WeakPolarHBondContact O-CD 3.46Å; C245-R316 PolarHBondContact O-NE 3.4Å; F246-R316 HydrophobicContact CD1-CB 4.04Å; F246-R316 HydrophobicContact CD1-CG 3.77Å; F246-R316 HydrophobicContact CE1-CB 3.37Å; F246-R316 HydrophobicContact CE1-CG 3.65Å; F246-R316 HydrophobicContact CZ-CB 3.84Å; F246-R316 HydrophobicContact CZ-CG 4.43Å; H312-R316 WeakPolarHBondContact O-CG 3.37Å; H312-R316 PolarHBondContact O-N 3.18Å; H312-R316 VanDerWaalsContact O-N 3.08Å; L313-R316 PolarHBondContact O-N 2.96Å; R316-R319 PolarHBondContact O-N 3.35Å; R316-A320 PolarHBondContact O-N 3.25Å
317	T	97.2	Very high	96.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.3	-45.1	177.3	-54.4	0	0	0	0	111.3	L163 L172 L313 A314 R319 A320 V321 L337 L353	L163-T317 WeakPolarHBondContact CD2-OG1 3.47Å; L172-T317 HydrophobicContact CD2-CG2 4.26Å; L313-T317 VanDerWaalsContact O-CB 3.3Å; L313-T317 WeakPolarHBondContact O-CB 3.36Å; L313-T317 PolarHBondContact O-N 2.87Å; L313-T317 PolarHBondContact O-OG1 3.31Å; A314-T317 PolarHBondContact O-N 3Å; T317-R319 VanDerWaalsContact C-N 3.27Å; T317-R319 PolarHBondContact O-N 3.1Å; T317-A320 WeakPolarHBondContact O-CB 3.36Å; T317-A320 PolarHBondContact O-N 3.42Å; T317-A320 VanDerWaalsContact O-N 3.09Å; T317-V321 WeakPolarHBondContact O-CG2 3.33Å; T317-V321 PolarHBondContact O-N 2.92Å; T317-L337 HydrophobicContact CG2-CD1 4.02Å; T317-L337 HydrophobicContact CG2-CD2 3.63Å; T317-L353 HydrophobicContact CG2-CD2 4.11Å
318	H	96	Very high	96.4	Very high	9 Å²	9	34.5 Å²	34.5	4%	0.042	16%	0.157	C	C	.	.	H	α-helix	trans	-57.2	-42.1	175.9	-176.4	-166.7	0	0	0	111.5	A314 A320 V321 L322 V356 L423 I426	A314-H318 VanDerWaalsContact O-CB 3.28Å; A314-H318 WeakPolarHBondContact O-CB 3.46Å; A314-H318 PolarHBondContact O-N 2.91Å; H318-A320 PolarHBondContact O-N 3.34Å; H318-V321 PolarHBondContact O-N 3.41Å; H318-L322 WeakPolarHBondContact O-CG 3.47Å; H318-L322 PolarHBondContact O-N 3.2Å; H318-V356 HydrophobicContact CB-CG1 3.69Å; H318-L423 HydrophobicContact CB-CD2 4.1Å; H318-I426 WeakPolarHBondContact CE1-CD1 3.44Å
319	R	96.6	Very high	96.5	Very high	17 Å²	17	36 Å²	36	6%	0.064	16%	0.164	C	C	.	.	H	α-helix	trans	-64.2	-42.1	176.3	-168.7	176.1	-65.3	93.1	0.3	112.1	D243 K315 R316 T317 V321 L322 F323 I421 L423	D243-R319 WeakPolarHBondContact O-CD 3.23Å; D243-R319 PolarHBondContact O-NH1 3.49Å; K315-R319 PolarHBondContact O-N 3Å; K315-R319 VanDerWaalsContact O-N 3.16Å; R316-R319 PolarHBondContact O-N 3.35Å; T317-R319 VanDerWaalsContact C-N 3.27Å; T317-R319 PolarHBondContact O-N 3.1Å; R319-V321 VanDerWaalsContact C-N 3.31Å; R319-V321 PolarHBondContact O-N 3.07Å; R319-L322 PolarHBondContact O-N 3.25Å; R319-F323 WeakPolarHBondContact O-CB 3.49Å; R319-F323 PolarHBondContact O-N 3Å; R319-I421 HydrophobicContact CG-CB 3.93Å; R319-I421 HydrophobicContact CG-CG2 4.06Å; R319-I421 PolarHBondContact NE-O 3.04Å; R319-I421 VanDerWaalsContact NE-O 3.08Å; R319-L423 HydrophobicContact CB-CD2 3.82Å; R319-L423 HydrophobicContact CG-CD2 4.46Å
320	A	98	Very high	96.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.2	-42.5	175.7	0	0	0	0	0	111.5	L161 L172 L184 C244 R316 T317 H318 L322 F323 C324	L161-A320 HydrophobicContact CD1-CB 4.34Å; L161-A320 HydrophobicContact CD2-CB 4.36Å; L172-A320 HydrophobicContact CD1-CB 3.95Å; L172-A320 HydrophobicContact CD2-CB 4.16Å; L172-A320 HydrophobicContact CG-CB 4.46Å; L184-A320 HydrophobicContact CD1-CB 3.84Å; C244-A320 PolarHBondContact SG-N 2.68Å; C244-A320 VanDerWaalsContact SG-N 3.39Å; R316-A320 PolarHBondContact O-N 3.25Å; T317-A320 WeakPolarHBondContact O-CB 3.36Å; T317-A320 PolarHBondContact O-N 3.42Å; T317-A320 VanDerWaalsContact O-N 3.09Å; H318-A320 PolarHBondContact O-N 3.34Å; A320-L322 PolarHBondContact O-N 3.47Å; A320-F323 WeakPolarHBondContact O-CB 3.45Å; A320-F323 PolarHBondContact O-N 3.35Å; A320-C324 WeakPolarHBondContact O-CB 3.37Å; A320-C324 PolarHBondContact O-N 2.87Å; A320-C324 PolarHBondContact O-SG 3.03Å
321	V	97.4	Very high	96.5	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-58.8	-46.9	175.5	174.4	0	0	0	0	111.4	L161 T317 H318 R319 C324 R325 T360 L362	L161-V321 HydrophobicContact CD2-CG2 3.55Å; T317-V321 WeakPolarHBondContact O-CG2 3.33Å; T317-V321 PolarHBondContact O-N 2.92Å; H318-V321 PolarHBondContact O-N 3.41Å; R319-V321 VanDerWaalsContact C-N 3.31Å; R319-V321 PolarHBondContact O-N 3.07Å; V321-C324 PolarHBondContact O-N 2.69Å; V321-R325 WeakPolarHBondContact O-CB 3.33Å; V321-R325 PolarHBondContact O-N 2.94Å; V321-T360 HydrophobicContact CG1-CG2 3.98Å; V321-L362 HydrophobicContact CG1-CD1 3.57Å; V321-L362 HydrophobicContact CG1-CD2 4.03Å; V321-L362 HydrophobicContact CG1-CG 4.47Å; V321-L362 HydrophobicContact CG2-CD2 3.66Å
322	L	96.5	Very high	96.3	Very high	31 Å²	31	44.6 Å²	44.6	16%	0.162	22%	0.221	C	C	.	.	H	α-helix	trans	-64.1	-41	177.5	-65	-179.3	0	0	0	111.9	H318 R319 A320 R325 T326 I421 L423	H318-L322 WeakPolarHBondContact O-CG 3.47Å; H318-L322 PolarHBondContact O-N 3.2Å; R319-L322 PolarHBondContact O-N 3.25Å; A320-L322 PolarHBondContact O-N 3.47Å; L322-R325 PolarHBondContact O-N 3.14Å; L322-T326 PolarHBondContact O-N 2.97Å; L322-T326 PolarHBondContact O-OG1 3.17Å; L322-T326 VanDerWaalsContact O-OG1 3.13Å; L322-I421 HydrophobicContact CB-CG2 3.85Å; L322-I421 HydrophobicContact CD1-CG2 3.86Å; L322-L423 HydrophobicContact CD1-CD2 4.09Å
323	F	98.1	Very high	96.2	Very high	5 Å²	5	51.8 Å²	51.8	2%	0.022	26%	0.255	C	S	.	.	H	α-helix	trans	-59.6	-48.4	175	-179.1	-96.5	0	0	0	111.4	L184 R319 A320 R325 T326 N327 L329 I412 E415 V416 A419 I421	L184-F323 HydrophobicContact CD2-CD1 4.03Å; L184-F323 HydrophobicContact CD2-CE1 3.95Å; R319-F323 WeakPolarHBondContact O-CB 3.49Å; R319-F323 PolarHBondContact O-N 3Å; A320-F323 WeakPolarHBondContact O-CB 3.45Å; A320-F323 PolarHBondContact O-N 3.35Å; F323-R325 VanDerWaalsContact C-N 3.31Å; F323-R325 PolarHBondContact O-N 2.65Å; F323-T326 PolarHBondContact O-N 2.82Å; F323-N327 WeakPolarHBondContact CD2-ND2 3.45Å; F323-N327 VanDerWaalsContact CE2-ND2 3.34Å; F323-N327 WeakPolarHBondContact CE2-ND2 3.45Å; F323-N327 WeakPolarHBondContact O-CB 3.26Å; F323-N327 PolarHBondContact O-N 3.35Å; F323-N327 PolarHBondContact O-ND2 3.29Å; F323-L329 HydrophobicContact CD1-CD1 4.09Å; F323-L329 HydrophobicContact CE1-CD1 3.76Å; F323-I412 HydrophobicContact CE1-CD1 4.12Å; F323-E415 HydrophobicContact CZ-CB 4.33Å; F323-V416 HydrophobicContact CD1-CG2 3.88Å; F323-V416 HydrophobicContact CD2-CB 4.37Å; F323-V416 HydrophobicContact CD2-CG2 4.08Å; F323-V416 HydrophobicContact CE1-CG2 3.73Å; F323-V416 HydrophobicContact CE2-CB 4.32Å; F323-V416 HydrophobicContact CE2-CG2 3.94Å; F323-V416 HydrophobicContact CG-CG2 4.05Å; F323-V416 HydrophobicContact CZ-CG2 3.76Å; F323-A419 HydrophobicContact CD2-CB 3.93Å; F323-A419 HydrophobicContact CE2-CB 3.98Å; F323-I421 HydrophobicContact CB-CD1 3.56Å; F323-I421 HydrophobicContact CD2-CD1 3.9Å; F323-I421 HydrophobicContact CG-CD1 4.23Å
324	C	98.1	Very high	96	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.6	-39.3	177.9	-71.8	0	0	0	0	112.4	V174 A320 V321 N327 R328 L329 L330	V174-C324 VanDerWaalsContact CG2-SG 3.57Å; A320-C324 WeakPolarHBondContact O-CB 3.37Å; A320-C324 PolarHBondContact O-N 2.87Å; A320-C324 PolarHBondContact O-SG 3.03Å; V321-C324 PolarHBondContact O-N 2.69Å; C324-N327 CarbonylContact O-C 3.56Å; C324-R328 WeakPolarHBondContact O-CA 3.38Å; C324-R328 PolarHBondContact O-N 3.28Å; C324-L329 HydrophobicContact CB-CB 4.14Å; C324-L329 PolarHBondContact O-N 3.13Å; C324-L330 HydrophobicContact CB-CD1 3.64Å; C324-L330 HydrophobicContact CB-CG 3.81Å
325	R	94.8	Very high	96.1	Very high	136 Å²	136	58.8 Å²	58.8	51%	0.513	29%	0.294	S	S	.	.	H	α-helix	trans	-64.4	-49.1	177.3	178.9	172.7	-72.7	165.5	-1.2	111.7	V321 L322 F323 N327 R328 T360	V321-R325 WeakPolarHBondContact O-CB 3.33Å; V321-R325 PolarHBondContact O-N 2.94Å; L322-R325 PolarHBondContact O-N 3.14Å; F323-R325 VanDerWaalsContact C-N 3.31Å; F323-R325 PolarHBondContact O-N 2.65Å; R325-N327 VanDerWaalsContact C-N 3.27Å; R325-N327 PolarHBondContact O-N 3.08Å; R325-R328 PolarHBondContact O-N 3.45Å; R325-T360 PolarHBondContact NH2-O 2.75Å
326	T	95.2	Very high	96.3	Very high	108 Å²	108	55.4 Å²	55.4	66%	0.663	28%	0.279	S	S	*	.	H	α-helix	trans	-60.9	-38.2	179.5	-59.7	0	0	0	0	111.7	L322 F323	L322-T326 PolarHBondContact O-N 2.97Å; L322-T326 PolarHBondContact O-OG1 3.17Å; L322-T326 VanDerWaalsContact O-OG1 3.13Å; F323-T326 PolarHBondContact O-N 2.82Å
327	N	97.1	Very high	96.4	Very high	82 Å²	82	55.2 Å²	55.2	44%	0.439	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	6.5	-177.7	-65.7	-74.7	0	0	0	114.2	F323 C324 R325 L329	F323-N327 WeakPolarHBondContact CD2-ND2 3.45Å; F323-N327 VanDerWaalsContact CE2-ND2 3.34Å; F323-N327 WeakPolarHBondContact CE2-ND2 3.45Å; F323-N327 WeakPolarHBondContact O-CB 3.26Å; F323-N327 PolarHBondContact O-N 3.35Å; F323-N327 PolarHBondContact O-ND2 3.29Å; C324-N327 CarbonylContact O-C 3.56Å; R325-N327 VanDerWaalsContact C-N 3.27Å; R325-N327 PolarHBondContact O-N 3.08Å; N327-L329 VanDerWaalsContact C-N 3.26Å; N327-L329 HydrophobicContact CB-CD1 4.16Å; N327-L329 HydrophobicContact CB-CD2 4.41Å; N327-L329 HydrophobicContact CB-CG 3.86Å; N327-L329 PolarHBondContact O-N 2.87Å
328	R	97	Very high	96.5	Very high	228 Å²	228	55.2 Å²	55.2	86%	0.86	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	40.6	-179.7	-53.9	178.8	-175.1	171	0.9	113.5	C324 R325 L330	C324-R328 WeakPolarHBondContact O-CA 3.38Å; C324-R328 PolarHBondContact O-N 3.28Å; R325-R328 PolarHBondContact O-N 3.45Å; R328-L330 VanDerWaalsContact C-N 3.34Å
329	L	97.8	Very high	96.5	Very high	38 Å²	38	54.8 Å²	54.8	20%	0.199	28%	0.277	C	S	.	.			trans	-85.2	-6.4	180	-59.5	179.7	0	0	0	113.7	P159 V174 L182 F323 C324 N327	P159-L329 WeakPolarHBondContact CG-O 3.42Å; V174-L329 HydrophobicContact CG2-CB 4.34Å; V174-L329 HydrophobicContact CG2-CD1 4.38Å; L182-L329 HydrophobicContact CD1-CD2 4.31Å; F323-L329 HydrophobicContact CD1-CD1 4.09Å; F323-L329 HydrophobicContact CE1-CD1 3.76Å; C324-L329 HydrophobicContact CB-CB 4.14Å; C324-L329 PolarHBondContact O-N 3.13Å; N327-L329 VanDerWaalsContact C-N 3.26Å; N327-L329 HydrophobicContact CB-CD1 4.16Å; N327-L329 HydrophobicContact CB-CD2 4.41Å; N327-L329 HydrophobicContact CB-CG 3.86Å; N327-L329 PolarHBondContact O-N 2.87Å
330	L	97.5	Very high	96.4	Very high	25 Å²	25	54 Å²	54	13%	0.131	27%	0.274	C	S	.	.	S	Bend	trans	-123.3	154.4	178.7	-67.6	174.5	0	0	0	109.8	L161 C324 R328 P335 L362	L161-L330 HydrophobicContact CB-CD1 4.23Å; L161-L330 HydrophobicContact CB-CD2 4.1Å; C324-L330 HydrophobicContact CB-CD1 3.64Å; C324-L330 HydrophobicContact CB-CG 3.81Å; R328-L330 VanDerWaalsContact C-N 3.34Å; L330-P335 HydrophobicContact CB-CB 4.26Å; L330-L362 HydrophobicContact CD1-CD2 4.38Å
331	P	95.9	Very high	96.1	Very high	48 Å²	48	54.1 Å²	54.1	31%	0.312	28%	0.275	S	S	.	.			trans	-61.8	148.9	177.8	27.4	-35.9	0	0	0	111.3	P159 Q333	P159-P331 WeakPolarHBondContact O-CD 3.27Å; P331-Q333 VanDerWaalsContact C-N 3.28Å; P331-Q333 PolarHBondContact O-N 3.17Å
332	S	91.8	Very high	95.8	Very high	125 Å²	125	55.4 Å²	55.4	87%	0.874	29%	0.289	S	S	*	.	S	Bend	trans	-69.7	-27.2	177.2	53.4	0	0	0	0	112.7
333	Q	93	Very high	95.7	Very high	152 Å²	152	54.6 Å²	54.6	71%	0.71	29%	0.285	S	S	*	.	S	Bend	trans	-110.1	136.4	176.2	-63	-176.8	1.7	0	0	109.7	P331	P331-Q333 VanDerWaalsContact C-N 3.28Å; P331-Q333 PolarHBondContact O-N 3.17Å
334	N	92.8	Very high	95.4	Very high	127 Å²	127	54.3 Å²	54.3	68%	0.679	28%	0.284	S	S	*	.	S	Bend	trans	49.6	49.1	178.1	-54.8	-31	0	0	0	114.7	T336	N334-T336 PolarHBondContact O-N 2.67Å; N334-T336 PolarHBondContact O-OG1 2.71Å; N334-T336 VanDerWaalsContact O-OG1 3.08Å
335	P	97.4	Very high	95.2	Very high	21 Å²	21	55.7 Å²	55.7	14%	0.136	29%	0.294	C	S	.	.			trans	-59.8	134.8	174.8	29.3	-35.3	0	0	0	109.4	L330 L362 Q363	L330-P335 HydrophobicContact CB-CB 4.26Å; P335-L362 HydrophobicContact CB-CD1 4.18Å; P335-L362 HydrophobicContact CB-CG 4.03Å; P335-L362 HydrophobicContact CG-CD1 4.01Å; P335-L362 HydrophobicContact CG-CG 4.15Å; P335-L362 CarbonylContact O-C 3.37Å; P335-L362 VanDerWaalsContact O-CA 3.23Å; P335-L362 WeakPolarHBondContact O-CA 3.46Å; P335-Q363 PolarHBondContact O-N 3.5Å
336	T	98.3	Very high	95.2	Very high	5 Å²	5	49.6 Å²	49.6	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135.4	-169.4	-62.4	0	0	0	0	111	L156 L161 N334 V338 Q363 L365	L156-T336 HydrophobicContact CD1-CG2 3.9Å; L156-T336 HydrophobicContact CD2-CG2 4.33Å; L161-T336 PolarHBondContact N-O 2.89Å; N334-T336 PolarHBondContact O-N 2.67Å; N334-T336 PolarHBondContact O-OG1 2.71Å; N334-T336 VanDerWaalsContact O-OG1 3.08Å; T336-V338 HydrophobicContact CG2-CG2 4.14Å; T336-Q363 CarbonylContact C-O 3.59Å; T336-Q363 WeakPolarHBondContact CA-O 3.36Å; T336-L365 HydrophobicContact CG2-CB 4.37Å; T336-L365 HydrophobicContact CG2-CD1 3.57Å; T336-L365 HydrophobicContact CG2-CG 3.75Å
337	L	98.5	Very high	95.2	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	120.5	165.5	171	61.6	0	0	0	108.5	L161 L163 T317 L362 Q363 L364 L365	L161-L337 HydrophobicContact CB-CD1 4.38Å; L161-L337 HydrophobicContact CD2-CD1 3.97Å; L161-L337 HydrophobicContact CG-CD1 3.94Å; L161-L337 CarbonylContact O-C 3.6Å; L161-L337 WeakPolarHBondContact O-CA 3.45Å; L163-L337 HydrophobicContact CB-CD1 4.23Å; T317-L337 HydrophobicContact CG2-CD1 4.02Å; T317-L337 HydrophobicContact CG2-CD2 3.63Å; L337-L362 HydrophobicContact CB-CD2 3.93Å; L337-Q363 PolarHBondContact N-O 3.48Å; L337-L364 HydrophobicContact CB-CD1 4.34Å; L337-L364 HydrophobicContact CD2-CD1 3.9Å; L337-L364 HydrophobicContact CG-CD1 3.85Å; L337-L364 CarbonylContact O-C 3.49Å; L337-L364 WeakPolarHBondContact O-CA 3.37Å; L337-L365 PolarHBondContact O-N 2.78Å
338	V	98.2	Very high	95.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.6	172.2	179	0	0	0	0	108.8	V150 L156 F160 L161 V162 L163 T336 L365	V150-V338 HydrophobicContact CB-CG1 4.02Å; V150-V338 HydrophobicContact CG1-CB 4.43Å; V150-V338 HydrophobicContact CG1-CG1 3.75Å; V150-V338 HydrophobicContact CG1-CG2 3.75Å; L156-V338 HydrophobicContact CD2-CG2 3.64Å; F160-V338 HydrophobicContact CD2-CB 4.14Å; F160-V338 HydrophobicContact CD2-CG2 3.45Å; F160-V338 VanDerWaalsContact CD2-CG2 3.45Å; F160-V338 HydrophobicContact CE2-CB 4.29Å; F160-V338 HydrophobicContact CE2-CG2 3.78Å; F160-V338 HydrophobicContact CG-CG2 4.2Å; L161-V338 PolarHBondContact O-N 3.45Å; V162-V338 CarbonylContact C-O 3.6Å; V162-V338 WeakPolarHBondContact CA-O 3.24Å; V162-V338 HydrophobicContact CB-CB 4.43Å; V162-V338 HydrophobicContact CG2-CB 4.02Å; V162-V338 HydrophobicContact CG2-CG1 4.05Å; L163-V338 PolarHBondContact N-O 3.38Å; T336-V338 HydrophobicContact CG2-CG2 4.14Å; V338-L365 CarbonylContact C-O 3.41Å; V338-L365 WeakPolarHBondContact CA-O 3.39Å
339	L	97.3	Very high	95	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	118	175.6	173.2	62.7	0	0	0	109.6	L163 V165 A344 R350 L353 L364 L365 P367	L163-L339 HydrophobicContact CB-CD1 4.16Å; L163-L339 HydrophobicContact CD2-CD1 3.82Å; L163-L339 HydrophobicContact CG-CD1 3.97Å; L163-L339 WeakPolarHBondContact O-CA 3.38Å; V165-L339 HydrophobicContact CG2-CD1 3.75Å; L339-A344 HydrophobicContact CD1-CB 3.97Å; L339-A344 HydrophobicContact CD2-CB 4.23Å; L339-A344 HydrophobicContact CG-CB 3.65Å; L339-R350 HydrophobicContact CD2-CG 4.01Å; L339-L353 HydrophobicContact CD1-CD1 3.69Å; L339-L353 HydrophobicContact CD2-CD1 3.49Å; L339-L353 VanDerWaalsContact CD2-CD1 3.49Å; L339-L353 HydrophobicContact CG-CD1 4.16Å; L339-L364 HydrophobicContact CB-CD1 3.95Å; L339-L365 PolarHBondContact N-O 3.39Å; L339-P367 WeakPolarHBondContact O-CD 3.21Å
340	S	93.9	Very high	94.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	170.9	-175.9	-176.9	0	0	0	0	112.2	H146 L163 L164 V165	H146-S340 WeakPolarHBondContact O-CB 3.33Å; H146-S340 PolarHBondContact O-OG 2.99Å; L163-S340 PolarHBondContact O-N 3.06Å; L164-S340 WeakPolarHBondContact CA-O 3.48Å; V165-S340 PolarHBondContact N-O 3.41Å
341	G	91.6	Very high	94.8	Very high	2 Å²	2	38.3 Å²	38.3	2%	0.021	21%	0.213	C	C	.	.	S	Bend	trans	93.6	162.6	-173	0	0	0	0	0	114.4	V165 V343 A344 C372	V165-G341 CarbonylContact O-C 3.55Å; V165-G341 VanDerWaalsContact O-CA 3.27Å; V165-G341 WeakPolarHBondContact O-CA 3.29Å; G341-V343 VanDerWaalsContact C-N 3.31Å; G341-V343 PolarHBondContact O-N 3.17Å; G341-V343 VanDerWaalsContact O-N 3.17Å; G341-A344 WeakPolarHBondContact O-CA 3.37Å; G341-A344 WeakPolarHBondContact O-CB 3.49Å; G341-A344 PolarHBondContact O-N 2.78Å; G341-C372 CarbonylContact C-O 3.6Å; G341-C372 WeakPolarHBondContact CA-O 3.42Å; G341-C372 WeakPolarHBondContact O-CB 2.92Å
342	G	90.8	Very high	94.7	Very high	30 Å²	30	36 Å²	36	31%	0.309	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-56.2	-37.2	-171.3	0	0	0	0	0	115.4	V165 A344 S345 C372	V165-G342 PolarHBondContact O-N 3.31Å; G342-A344 PolarHBondContact O-N 2.98Å; G342-S345 VanDerWaalsContact O-CB 3.32Å; G342-S345 WeakPolarHBondContact O-CB 3.45Å; G342-S345 PolarHBondContact O-N 3.25Å; G342-S345 VanDerWaalsContact O-N 3.09Å; G342-S345 PolarHBondContact O-OG 2.92Å; G342-C372 PolarHBondContact N-O 2.8Å; G342-C372 VanDerWaalsContact N-O 3.1Å
343	V	94.6	Very high	94.9	Very high	13 Å²	13	30 Å²	30	8%	0.079	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-70.5	-22.9	178.1	176.9	0	0	0	0	111.3	V165 P192 G193 G341 S345 N346 I349	V165-V343 HydrophobicContact CB-CB 3.98Å; V165-V343 HydrophobicContact CB-CG1 4.29Å; V165-V343 HydrophobicContact CG2-CB 3.99Å; V165-V343 HydrophobicContact CG2-CG1 4.21Å; V165-V343 WeakPolarHBondContact O-CB 3.46Å; V165-V343 PolarHBondContact O-N 2.92Å; P192-V343 HydrophobicContact CB-CG1 4.45Å; P192-V343 HydrophobicContact CG-CG1 4.46Å; P192-V343 HydrophobicContact CG-CG2 4.34Å; G193-V343 VanDerWaalsContact CA-CG2 3.45Å; G341-V343 VanDerWaalsContact C-N 3.31Å; G341-V343 PolarHBondContact O-N 3.17Å; G341-V343 VanDerWaalsContact O-N 3.17Å; V343-S345 PolarHBondContact O-N 2.86Å; V343-S345 VanDerWaalsContact O-N 3.14Å; V343-N346 VanDerWaalsContact O-CB 3.29Å; V343-N346 WeakPolarHBondContact O-CB 3.22Å; V343-N346 PolarHBondContact O-N 3.24Å; V343-N346 VanDerWaalsContact O-N 3.11Å; V343-I349 HydrophobicContact CG1-CD1 3.52Å
344	A	92.9	Very high	95	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-59.8	-21.7	171.1	0	0	0	0	0	112	V165 L339 G341 G342 N346 R350	V165-A344 HydrophobicContact CG2-CB 4.36Å; L339-A344 HydrophobicContact CD1-CB 3.97Å; L339-A344 HydrophobicContact CD2-CB 4.23Å; L339-A344 HydrophobicContact CG-CB 3.65Å; G341-A344 WeakPolarHBondContact O-CA 3.37Å; G341-A344 WeakPolarHBondContact O-CB 3.49Å; G341-A344 PolarHBondContact O-N 2.78Å; G342-A344 PolarHBondContact O-N 2.98Å; A344-N346 PolarHBondContact O-N 3.23Å; A344-R350 VanDerWaalsContact O-CG 3.29Å; A344-R350 WeakPolarHBondContact O-CG 3.48Å; A344-R350 VanDerWaalsContact O-CZ 3.25Å; A344-R350 PolarHBondContact O-NE 3.46Å; A344-R350 PolarHBondContact O-NH2 2.56Å; A344-R350 VanDerWaalsContact O-NH2 3.11Å
345	S	92.4	Very high	95.1	Very high	29 Å²	29	19.9 Å²	19.9	20%	0.203	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-68.7	-12.6	177.5	-56.8	0	0	0	0	113.8	G342 V343 Q347	G342-S345 VanDerWaalsContact O-CB 3.32Å; G342-S345 WeakPolarHBondContact O-CB 3.45Å; G342-S345 PolarHBondContact O-N 3.25Å; G342-S345 VanDerWaalsContact O-N 3.09Å; G342-S345 PolarHBondContact O-OG 2.92Å; V343-S345 PolarHBondContact O-N 2.86Å; V343-S345 VanDerWaalsContact O-N 3.14Å; S345-Q347 PolarHBondContact O-N 2.89Å
346	N	95	Very high	95	Very high	8 Å²	8	18.9 Å²	18.9	4%	0.043	11%	0.107	C	C	.	.			trans	-74.2	117.9	177.6	-178.2	-80.4	0	0	0	111.4	E221 Q306 V343 A344 Y348 I349 R350	E221-N346 WeakPolarHBondContact CB-ND2 3.48Å; E221-N346 WeakPolarHBondContact CG-ND2 3.3Å; E221-N346 WeakPolarHBondContact OE1-CA 3.43Å; E221-N346 WeakPolarHBondContact OE2-CA 3.42Å; E221-N346 PolarHBondContact OE2-ND2 3.33Å; Q306-N346 PolarHBondContact NE2-ND2 3.02Å; V343-N346 VanDerWaalsContact O-CB 3.29Å; V343-N346 WeakPolarHBondContact O-CB 3.22Å; V343-N346 PolarHBondContact O-N 3.24Å; V343-N346 VanDerWaalsContact O-N 3.11Å; A344-N346 PolarHBondContact O-N 3.23Å; N346-Y348 PolarHBondContact O-N 3.04Å; N346-Y348 WeakPolarHBondContact OD1-CB 3.28Å; N346-Y348 PolarHBondContact OD1-N 3.08Å; N346-I349 HydrophobicContact CB-CB 4.13Å; N346-I349 HydrophobicContact CB-CD1 3.95Å; N346-I349 HydrophobicContact CB-CG1 4.23Å; N346-I349 PolarHBondContact O-N 3.43Å; N346-I349 WeakPolarHBondContact OD1-CG1 3.27Å; N346-I349 PolarHBondContact OD1-N 3.37Å; N346-R350 WeakPolarHBondContact O-CG 3.39Å; N346-R350 PolarHBondContact O-N 2.78Å
347	Q	94.6	Very high	94.9	Very high	101 Å²	101	18.8 Å²	18.8	47%	0.472	11%	0.106	S	C	.	.	H	α-helix	trans	-67.3	-35.6	-175	-61.9	-59.9	-16.1	0	0	112.5	E221 S345 R350 K351	E221-Q347 WeakPolarHBondContact OE1-CB 3.4Å; E221-Q347 PolarHBondContact OE1-N 2.86Å; S345-Q347 PolarHBondContact O-N 2.89Å; Q347-R350 PolarHBondContact O-N 3.41Å; Q347-K351 WeakPolarHBondContact O-CB 3.34Å; Q347-K351 WeakPolarHBondContact O-CG 3.48Å; Q347-K351 PolarHBondContact O-N 3.11Å
348	Y	95.4	Very high	94.7	Very high	21 Å²	21	26.2 Å²	26.2	8%	0.082	14%	0.141	C	C	.	.	H	α-helix	trans	-63.8	-43.5	176.2	-170.5	-88.3	0	0	0	111.7	R229 Q306 H307 A310 N346 K351 A352 I430	R229-Y348 WeakPolarHBondContact CD-OH 3.05Å; Q306-Y348 VanDerWaalsContact CD-CB 3.49Å; Q306-Y348 HydrophobicContact CG-CD1 3.83Å; Q306-Y348 HydrophobicContact CG-CG 4.16Å; H307-Y348 HydrophobicContact CB-CE1 4.33Å; H307-Y348 AromaticContact ND1-CZ 3.81Å; H307-Y348 PolarHBondContact ND1-OH 2.85Å; A310-Y348 HydrophobicContact CB-CD1 3.8Å; A310-Y348 HydrophobicContact CB-CE1 3.81Å; N346-Y348 PolarHBondContact O-N 3.04Å; N346-Y348 WeakPolarHBondContact OD1-CB 3.28Å; N346-Y348 PolarHBondContact OD1-N 3.08Å; Y348-K351 PolarHBondContact O-N 3.46Å; Y348-A352 WeakPolarHBondContact O-CB 3.03Å; Y348-A352 PolarHBondContact O-N 3.4Å; Y348-I430 HydrophobicContact CD1-CG2 4.38Å; Y348-I430 HydrophobicContact CD2-CG2 4.16Å; Y348-I430 HydrophobicContact CE1-CD1 3.71Å; Y348-I430 HydrophobicContact CE1-CG2 3.87Å; Y348-I430 HydrophobicContact CE2-CB 4.43Å; Y348-I430 HydrophobicContact CE2-CG2 3.64Å; Y348-I430 VanDerWaalsContact CZ-CG2 3.48Å
349	I	95.6	Very high	94.5	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-64.9	-42.4	174.8	-69.6	171.1	0	0	0	110.5	V309 A310 L313 V343 N346 A352 L353	V309-I349 HydrophobicContact CG1-CD1 4.11Å; A310-I349 HydrophobicContact CB-CG1 3.91Å; L313-I349 HydrophobicContact CD1-CD1 4.21Å; L313-I349 HydrophobicContact CD1-CG2 3.87Å; V343-I349 HydrophobicContact CG1-CD1 3.52Å; N346-I349 HydrophobicContact CB-CB 4.13Å; N346-I349 HydrophobicContact CB-CD1 3.95Å; N346-I349 HydrophobicContact CB-CG1 4.23Å; N346-I349 PolarHBondContact O-N 3.43Å; N346-I349 WeakPolarHBondContact OD1-CG1 3.27Å; N346-I349 PolarHBondContact OD1-N 3.37Å; I349-A352 PolarHBondContact O-N 2.85Å; I349-L353 HydrophobicContact CG2-CD1 3.8Å; I349-L353 WeakPolarHBondContact O-CG 3.46Å; I349-L353 PolarHBondContact O-N 2.76Å
350	R	95.3	Very high	94.3	Very high	35 Å²	35	29.4 Å²	29.4	13%	0.132	17%	0.166	C	C	.	.	H	α-helix	trans	-57.4	-50.1	173.7	-72	-176	-174.3	-126	-13	111.4	L339 A344 N346 Q347 A352 L353 A354 P367 C372	L339-R350 HydrophobicContact CD2-CG 4.01Å; A344-R350 VanDerWaalsContact O-CG 3.29Å; A344-R350 WeakPolarHBondContact O-CG 3.48Å; A344-R350 VanDerWaalsContact O-CZ 3.25Å; A344-R350 PolarHBondContact O-NE 3.46Å; A344-R350 PolarHBondContact O-NH2 2.56Å; A344-R350 VanDerWaalsContact O-NH2 3.11Å; N346-R350 WeakPolarHBondContact O-CG 3.39Å; N346-R350 PolarHBondContact O-N 2.78Å; Q347-R350 PolarHBondContact O-N 3.41Å; R350-A352 VanDerWaalsContact C-N 3.32Å; R350-A352 PolarHBondContact O-N 2.97Å; R350-L353 PolarHBondContact O-N 3.02Å; R350-A354 WeakPolarHBondContact O-CB 3.42Å; R350-A354 PolarHBondContact O-N 2.75Å; R350-P367 PolarHBondContact NH1-O 2.85Å; R350-P367 PolarHBondContact NH2-O 3.17Å; R350-P367 VanDerWaalsContact NH2-O 3.1Å; R350-C372 PolarHBondContact NH2-SG 2.93Å
351	K	94.8	Very high	94.4	Very high	85 Å²	85	31.9 Å²	31.9	37%	0.37	19%	0.192	S	C	.	.	H	α-helix	trans	-56.6	-45.2	176.4	-75	177.1	177.3	-177.9	0	111.2	Q347 Y348 L353 A354 V355 I430 D432	Q347-K351 WeakPolarHBondContact O-CB 3.34Å; Q347-K351 WeakPolarHBondContact O-CG 3.48Å; Q347-K351 PolarHBondContact O-N 3.11Å; Y348-K351 PolarHBondContact O-N 3.46Å; K351-L353 PolarHBondContact O-N 3.29Å; K351-A354 WeakPolarHBondContact O-CB 3.19Å; K351-A354 PolarHBondContact O-N 3.09Å; K351-V355 PolarHBondContact O-N 3.19Å; K351-I430 HydrophobicContact CB-CG2 4.34Å; K351-D432 PolarHBondContact NZ-O 3.28Å
352	A	94.8	Very high	94.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.7	-40.2	179.6	0	0	0	0	0	113	A310 Y348 I349 R350 I430	A310-A352 HydrophobicContact CB-CB 3.93Å; Y348-A352 WeakPolarHBondContact O-CB 3.03Å; Y348-A352 PolarHBondContact O-N 3.4Å; I349-A352 PolarHBondContact O-N 2.85Å; R350-A352 VanDerWaalsContact C-N 3.32Å; R350-A352 PolarHBondContact O-N 2.97Å; A352-I430 HydrophobicContact CB-CD1 3.6Å; A352-I430 HydrophobicContact CB-CG1 3.89Å; A352-I430 HydrophobicContact CB-CG2 4.23Å
353	L	96.2	Very high	94.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-75.5	-29.7	177.4	-70.8	164.3	0	0	0	112.3	L163 T317 L339 I349 R350 K351 V355 V356 A357 L364	L163-L353 HydrophobicContact CD2-CD1 3.62Å; L163-L353 HydrophobicContact CD2-CD2 3.81Å; L163-L353 HydrophobicContact CD2-CG 4.4Å; T317-L353 HydrophobicContact CG2-CD2 4.11Å; L339-L353 HydrophobicContact CD1-CD1 3.69Å; L339-L353 HydrophobicContact CD2-CD1 3.49Å; L339-L353 VanDerWaalsContact CD2-CD1 3.49Å; L339-L353 HydrophobicContact CG-CD1 4.16Å; I349-L353 HydrophobicContact CG2-CD1 3.8Å; I349-L353 WeakPolarHBondContact O-CG 3.46Å; I349-L353 PolarHBondContact O-N 2.76Å; R350-L353 PolarHBondContact O-N 3.02Å; K351-L353 PolarHBondContact O-N 3.29Å; L353-V355 VanDerWaalsContact C-N 3.31Å; L353-V355 PolarHBondContact O-N 3.29Å; L353-V356 WeakPolarHBondContact O-CB 3.23Å; L353-V356 PolarHBondContact O-N 3.34Å; L353-V356 VanDerWaalsContact O-N 3.16Å; L353-A357 PolarHBondContact O-N 3.17Å; L353-L364 HydrophobicContact CB-CD2 4.4Å
354	A	95.8	Very high	95.1	Very high	40 Å²	40	37 Å²	37	33%	0.331	21%	0.208	S	C	.	.	H	α-helix	trans	-61	-41.7	172.6	0	0	0	0	0	111.2	R350 K351 V356 A357 E358 L364	R350-A354 WeakPolarHBondContact O-CB 3.42Å; R350-A354 PolarHBondContact O-N 2.75Å; K351-A354 WeakPolarHBondContact O-CB 3.19Å; K351-A354 PolarHBondContact O-N 3.09Å; A354-V356 VanDerWaalsContact C-N 3.28Å; A354-V356 PolarHBondContact O-N 3.26Å; A354-A357 PolarHBondContact O-N 3.19Å; A354-E358 WeakPolarHBondContact O-CB 3.35Å; A354-E358 PolarHBondContact O-N 3.04Å; A354-L364 HydrophobicContact CB-CD2 3.86Å
355	V	94.4	Very high	95.3	Very high	26 Å²	26	37.5 Å²	37.5	16%	0.158	21%	0.211	C	C	.	.	H	α-helix	trans	-59	-40	174	174.4	0	0	0	0	111.5	K351 L353 A359 I428	K351-V355 PolarHBondContact O-N 3.19Å; L353-V355 VanDerWaalsContact C-N 3.31Å; L353-V355 PolarHBondContact O-N 3.29Å; V355-A359 WeakPolarHBondContact O-CB 3.38Å; V355-A359 PolarHBondContact O-N 2.78Å; V355-I428 HydrophobicContact CB-CG2 4.48Å; V355-I428 HydrophobicContact CG1-CG2 4.2Å
356	V	95.1	Very high	95.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-67.4	-46	176.2	175.3	0	0	0	0	111	A314 H318 L353 A354 A359 T360	A314-V356 HydrophobicContact CB-CG2 3.71Å; H318-V356 HydrophobicContact CB-CG1 3.69Å; L353-V356 WeakPolarHBondContact O-CB 3.23Å; L353-V356 PolarHBondContact O-N 3.34Å; L353-V356 VanDerWaalsContact O-N 3.16Å; A354-V356 VanDerWaalsContact C-N 3.28Å; A354-V356 PolarHBondContact O-N 3.26Å; V356-A359 PolarHBondContact O-N 3.08Å; V356-T360 WeakPolarHBondContact O-CB 3.37Å; V356-T360 WeakPolarHBondContact O-CG2 3.32Å; V356-T360 PolarHBondContact O-N 3.22Å; V356-T360 PolarHBondContact O-OG1 3.5Å
357	A	95.8	Very high	95.3	Very high	2 Å²	2	37.5 Å²	37.5	2%	0.017	21%	0.211	C	C	.	.	H	α-helix	trans	-60.8	-49.5	179.9	0	0	0	0	0	111	L353 A354 T360 G361 L362 L364	L353-A357 PolarHBondContact O-N 3.17Å; A354-A357 PolarHBondContact O-N 3.19Å; A357-T360 CarbonylContact O-C 3.54Å; A357-T360 PolarHBondContact O-N 3.32Å; A357-T360 VanDerWaalsContact O-N 3.16Å; A357-T360 PolarHBondContact O-OG1 3.06Å; A357-G361 PolarHBondContact O-N 3.15Å; A357-L362 CarbonylContact C-O 3.49Å; A357-L362 HydrophobicContact CB-CB 4.25Å; A357-L362 WeakPolarHBondContact CB-O 3.34Å; A357-L362 PolarHBondContact O-N 3.29Å; A357-L364 HydrophobicContact CB-CB 3.83Å
358	E	94.6	Very high	95.1	Very high	158 Å²	158	35.8 Å²	35.8	74%	0.738	21%	0.208	S	C	*	.	H	α-helix	trans	-58.7	-51.5	177	-176.5	-178.8	-171.7	0	0	111.8	A354 T360 G361	A354-E358 WeakPolarHBondContact O-CB 3.35Å; A354-E358 PolarHBondContact O-N 3.04Å; E358-T360 PolarHBondContact O-N 3.06Å; E358-T360 VanDerWaalsContact O-N 3.11Å; E358-G361 PolarHBondContact O-N 3.28Å
359	A	93	Very high	94.7	Very high	60 Å²	60	37.3 Å²	37.3	50%	0.496	22%	0.222	S	C	.	.	H	α-helix	trans	-64.6	-19.7	-179.2	0	0	0	0	0	113.4	V355 V356 I426	V355-A359 WeakPolarHBondContact O-CB 3.38Å; V355-A359 PolarHBondContact O-N 2.78Å; V356-A359 PolarHBondContact O-N 3.08Å; A359-I426 HydrophobicContact CB-CD1 3.77Å; A359-I426 HydrophobicContact CB-CG2 4.35Å
360	T	93.9	Very high	94.4	Very high	6 Å²	6	44.1 Å²	44.1	4%	0.037	25%	0.248	C	C	.	.	H	α-helix	trans	-104.7	2.9	176.1	58.7	0	0	0	0	113.1	V321 R325 V356 A357 E358 L362	V321-T360 HydrophobicContact CG1-CG2 3.98Å; R325-T360 PolarHBondContact NH2-O 2.75Å; V356-T360 WeakPolarHBondContact O-CB 3.37Å; V356-T360 WeakPolarHBondContact O-CG2 3.32Å; V356-T360 PolarHBondContact O-N 3.22Å; V356-T360 PolarHBondContact O-OG1 3.5Å; A357-T360 CarbonylContact O-C 3.54Å; A357-T360 PolarHBondContact O-N 3.32Å; A357-T360 VanDerWaalsContact O-N 3.16Å; A357-T360 PolarHBondContact O-OG1 3.06Å; E358-T360 PolarHBondContact O-N 3.06Å; E358-T360 VanDerWaalsContact O-N 3.11Å; T360-L362 VanDerWaalsContact C-N 3.29Å; T360-L362 WeakPolarHBondContact O-CD1 3.26Å; T360-L362 PolarHBondContact O-N 3.34Å
361	G	95	Very high	94.2	Very high	53 Å²	53	42.7 Å²	42.7	55%	0.546	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	27	-179.3	0	0	0	0	0	114.2	A357 E358	A357-G361 PolarHBondContact O-N 3.15Å; E358-G361 PolarHBondContact O-N 3.28Å
362	L	97.3	Very high	93.9	Very high	14 Å²	14	38.7 Å²	38.7	7%	0.073	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-94.7	145.4	171.7	-87.7	67.2	0	0	0	110.4	V321 L330 P335 L337 A357 T360	V321-L362 HydrophobicContact CG1-CD1 3.57Å; V321-L362 HydrophobicContact CG1-CD2 4.03Å; V321-L362 HydrophobicContact CG1-CG 4.47Å; V321-L362 HydrophobicContact CG2-CD2 3.66Å; L330-L362 HydrophobicContact CD1-CD2 4.38Å; P335-L362 HydrophobicContact CB-CD1 4.18Å; P335-L362 HydrophobicContact CB-CG 4.03Å; P335-L362 HydrophobicContact CG-CD1 4.01Å; P335-L362 HydrophobicContact CG-CG 4.15Å; P335-L362 CarbonylContact O-C 3.37Å; P335-L362 VanDerWaalsContact O-CA 3.23Å; P335-L362 WeakPolarHBondContact O-CA 3.46Å; L337-L362 HydrophobicContact CB-CD2 3.93Å; A357-L362 CarbonylContact C-O 3.49Å; A357-L362 HydrophobicContact CB-CB 4.25Å; A357-L362 WeakPolarHBondContact CB-O 3.34Å; A357-L362 PolarHBondContact O-N 3.29Å; T360-L362 VanDerWaalsContact C-N 3.29Å; T360-L362 WeakPolarHBondContact O-CD1 3.26Å; T360-L362 PolarHBondContact O-N 3.34Å
363	Q	97.3	Very high	93.6	Very high	97 Å²	97	41.6 Å²	41.6	45%	0.453	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	128.1	163.3	-173.9	175.1	14.5	0	0	109.1	P335 T336 L337 L365	P335-Q363 PolarHBondContact O-N 3.5Å; T336-Q363 CarbonylContact C-O 3.59Å; T336-Q363 WeakPolarHBondContact CA-O 3.36Å; L337-Q363 PolarHBondContact N-O 3.48Å; Q363-L365 HydrophobicContact CG-CD2 3.99Å; Q363-L365 HydrophobicContact CG-CG 4.28Å
364	L	97.4	Very high	93.5	Very high	40 Å²	40	42.7 Å²	42.7	21%	0.209	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	123	170.5	178.3	63.4	0	0	0	109.5	L337 L339 L353 A354 A357	L337-L364 HydrophobicContact CB-CD1 4.34Å; L337-L364 HydrophobicContact CD2-CD1 3.9Å; L337-L364 HydrophobicContact CG-CD1 3.85Å; L337-L364 CarbonylContact O-C 3.49Å; L337-L364 WeakPolarHBondContact O-CA 3.37Å; L339-L364 HydrophobicContact CB-CD1 3.95Å; L353-L364 HydrophobicContact CB-CD2 4.4Å; A354-L364 HydrophobicContact CB-CD2 3.86Å; A357-L364 HydrophobicContact CB-CB 3.83Å
365	L	96.9	Very high	93.5	Very high	12 Å²	12	41.2 Å²	41.2	6%	0.063	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131.1	172	-59.8	-179.9	0	0	0	110.3	V150 Q154 L156 T336 L337 V338 L339 Q363	V150-L365 HydrophobicContact CG2-CB 3.79Å; V150-L365 HydrophobicContact CG2-CD1 4.02Å; Q154-L365 VanDerWaalsContact NE2-CD2 3.3Å; L156-L365 HydrophobicContact CD1-CD1 4.36Å; L156-L365 HydrophobicContact CD2-CD1 4.23Å; T336-L365 HydrophobicContact CG2-CB 4.37Å; T336-L365 HydrophobicContact CG2-CD1 3.57Å; T336-L365 HydrophobicContact CG2-CG 3.75Å; L337-L365 PolarHBondContact O-N 2.78Å; V338-L365 CarbonylContact C-O 3.41Å; V338-L365 WeakPolarHBondContact CA-O 3.39Å; L339-L365 PolarHBondContact N-O 3.39Å; Q363-L365 HydrophobicContact CG-CD2 3.99Å; Q363-L365 HydrophobicContact CG-CG 4.28Å
366	C	95.1	Very high	93.7	Very high	36 Å²	36	40.1 Å²	40.1	24%	0.243	23%	0.23	C	C	.	.			trans	-131.8	125.7	177.8	-52.5	0	0	0	0	108.4
367	P	92.4	Very high	93.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.23	C	C	.	.			trans	-56.6	153.6	169.8	-22.4	33.8	0	0	0	111.4	T149 V150 L153 L339 R350 F371 C372	T149-P367 HydrophobicContact CG2-CB 4.17Å; T149-P367 HydrophobicContact CG2-CG 4.15Å; V150-P367 HydrophobicContact CB-CG 4.32Å; L153-P367 HydrophobicContact CD1-CB 4.08Å; L339-P367 WeakPolarHBondContact O-CD 3.21Å; R350-P367 PolarHBondContact NH1-O 2.85Å; R350-P367 PolarHBondContact NH2-O 3.17Å; R350-P367 VanDerWaalsContact NH2-O 3.1Å; P367-F371 HydrophobicContact CB-CB 4.11Å; P367-C372 PolarHBondContact O-SG 3.02Å
368	P	90.9	Very high	94	Very high	65 Å²	65	40 Å²	40	42%	0.422	23%	0.229	S	C	.	.			trans	-52.8	146.3	164.6	-24.5	33.1	0	0	0	110.7	L153 R370 F371 C372	L153-P368 HydrophobicContact CD1-CG 4.18Å; P368-R370 PolarHBondContact O-N 2.93Å; P368-F371 HydrophobicContact CB-CD2 4.31Å; P368-F371 HydrophobicContact CG-CD2 4.2Å; P368-F371 PolarHBondContact O-N 3.22Å; P368-C372 PolarHBondContact O-N 3.46Å
369	S	86.9	Confident	94.2	Very high	54 Å²	54	32.5 Å²	32.5	38%	0.378	19%	0.194	S	C	.	.	H	α-helix	trans	-54.2	-33.4	-173.1	-51	0	0	0	0	113.7	F371 C372	S369-F371 PolarHBondContact O-N 3.27Å; S369-C372 PolarHBondContact O-N 3.47Å; S369-C372 VanDerWaalsContact O-N 3.09Å
370	R	89.6	Confident	94.4	Very high	143 Å²	143	29.7 Å²	29.7	54%	0.54	17%	0.17	S	C	.	.	H	α-helix	trans	-60.6	-24	176.7	78.2	178.6	-172.4	121.4	-10.4	114.2	E58 P368	E58-R370 IonicContact OE1-NH1 2.66Å; E58-R370 PolarHBondContact OE1-NH1 2.89Å; P368-R370 PolarHBondContact O-N 2.93Å
371	F	91.8	Very high	94.6	Very high	6 Å²	6	29.7 Å²	29.7	3%	0.026	17%	0.169	C	C	.	.	H	α-helix	trans	-104	-4.5	179.1	-64.5	-52.7	0	0	0	113.2	I55 T149 M152 L153 P367 P368 S369 A377	I55-F371 HydrophobicContact CD1-CE1 3.61Å; I55-F371 HydrophobicContact CD1-CZ 3.62Å; T149-F371 HydrophobicContact CG2-CB 3.75Å; M152-F371 HydrophobicContact CE-CD1 3.92Å; M152-F371 HydrophobicContact CE-CD2 3.99Å; M152-F371 HydrophobicContact CE-CE1 3.73Å; M152-F371 HydrophobicContact CE-CE2 3.78Å; M152-F371 HydrophobicContact CE-CG 4.04Å; M152-F371 HydrophobicContact CE-CZ 3.61Å; L153-F371 HydrophobicContact CD1-CD2 4.27Å; L153-F371 HydrophobicContact CD2-CD2 4.03Å; L153-F371 HydrophobicContact CD2-CE2 3.75Å; P367-F371 HydrophobicContact CB-CB 4.11Å; P368-F371 HydrophobicContact CB-CD2 4.31Å; P368-F371 HydrophobicContact CG-CD2 4.2Å; P368-F371 PolarHBondContact O-N 3.22Å; S369-F371 PolarHBondContact O-N 3.27Å; F371-A377 HydrophobicContact CE1-CB 4.18Å
372	C	87.5	Confident	94.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-83.5	-22.7	174.3	-69	0	0	0	0	112.6	H146 G341 G342 R350 P367 P368 S369	H146-C372 PolarHBondContact CE1-O 2.87Å; G341-C372 CarbonylContact C-O 3.6Å; G341-C372 WeakPolarHBondContact CA-O 3.42Å; G341-C372 WeakPolarHBondContact O-CB 2.92Å; G342-C372 PolarHBondContact N-O 2.8Å; G342-C372 VanDerWaalsContact N-O 3.1Å; R350-C372 PolarHBondContact NH2-SG 2.93Å; P367-C372 PolarHBondContact O-SG 3.02Å; P368-C372 PolarHBondContact O-N 3.46Å; S369-C372 PolarHBondContact O-N 3.47Å; S369-C372 VanDerWaalsContact O-N 3.09Å
373	T	89.1	Confident	94.8	Very high	61 Å²	61	26.5 Å²	26.5	37%	0.374	14%	0.14	S	C	.	.	S	Bend	trans	-89.4	165.3	172.5	52.7	0	0	0	0	111	N375	T373-N375 PolarHBondContact O-N 3.21Å; T373-N375 PolarHBondContact O-ND2 2.79Å
374	D	94.2	Very high	94.9	Very high	24 Å²	24	22 Å²	22	13%	0.128	12%	0.119	C	C	.	.			trans	-64	130.3	-178	-59.2	-12.3	0	0	0	111	E38 E43 H142 H146 M378	E38-D374 HydrophobicContact CG-CB 4.15Å; E43-D374 HydrophobicContact CB-CB 4Å; E43-D374 HydrophobicContact CG-CB 4.11Å; H142-D374 VanDerWaalsContact CE1-CG 3.42Å; H142-D374 IonicContact CE1-OD1 2.73Å; H142-D374 PolarHBondContact CE1-OD1 3.14Å; H142-D374 IonicContact CE1-OD2 3.73Å; H142-D374 IonicContact NE2-OD1 3.42Å; H142-D374 PolarHBondContact NE2-OD1 3.47Å; H142-D374 IonicContact NE2-OD2 3.17Å; H146-D374 IonicContact CE1-OD1 3.52Å; H146-D374 PolarHBondContact CE1-OD1 3.35Å; H146-D374 IonicContact NE2-OD1 3.25Å; H146-D374 PolarHBondContact NE2-OD1 2.97Å; D374-M378 HydrophobicContact CB-CE 4.24Å
375	N	96.4	Very high	94.9	Very high	9 Å²	9	20.3 Å²	20.3	5%	0.048	11%	0.11	C	C	.	.			trans	-155.8	161.6	-177.2	62.6	79.4	0	0	0	111.3	T373 A377 M378	T373-N375 PolarHBondContact O-N 3.21Å; T373-N375 PolarHBondContact O-ND2 2.79Å; N375-A377 VanDerWaalsContact C-N 3.29Å; N375-A377 PolarHBondContact O-N 3.33Å; N375-A377 WeakPolarHBondContact OD1-CA 3.38Å; N375-A377 VanDerWaalsContact OD1-CB 3.29Å; N375-A377 WeakPolarHBondContact OD1-CB 3.44Å; N375-A377 PolarHBondContact OD1-N 2.74Å; N375-M378 VanDerWaalsContact O-CG 3.27Å; N375-M378 WeakPolarHBondContact O-CG 3.46Å; N375-M378 PolarHBondContact OD1-N 3.12Å
376	G	98.1	Very high	94.9	Very high	3 Å²	3	20.6 Å²	20.6	3%	0.031	11%	0.11	C	C	.	.	H	α-helix	trans	-68.9	-25.3	177.2	0	0	0	0	0	113.7	V379 A380	G376-V379 PolarHBondContact O-N 3.33Å; G376-A380 WeakPolarHBondContact O-CB 3.45Å; G376-A380 PolarHBondContact O-N 2.94Å
377	A	98.2	Very high	95	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-68.4	-40.1	-175.7	0	0	0	0	0	112.7	A47 M49 I55 F371 N375 V379 A380 W381	A47-A377 HydrophobicContact CB-CB 4.03Å; M49-A377 HydrophobicContact CE-CB 3.89Å; I55-A377 HydrophobicContact CD1-CB 3.77Å; I55-A377 HydrophobicContact CG1-CB 4.22Å; F371-A377 HydrophobicContact CE1-CB 4.18Å; N375-A377 VanDerWaalsContact C-N 3.29Å; N375-A377 PolarHBondContact O-N 3.33Å; N375-A377 WeakPolarHBondContact OD1-CA 3.38Å; N375-A377 VanDerWaalsContact OD1-CB 3.29Å; N375-A377 WeakPolarHBondContact OD1-CB 3.44Å; N375-A377 PolarHBondContact OD1-N 2.74Å; A377-V379 VanDerWaalsContact C-N 3.27Å; A377-V379 PolarHBondContact O-N 2.92Å; A377-A380 PolarHBondContact O-N 3.44Å; A377-W381 WeakPolarHBondContact O-CB 3.31Å; A377-W381 PolarHBondContact O-N 3.32Å
378	M	97.6	Very high	95.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63	-35	175.1	67.3	-180	-171.1	0	0	112.2	E38 H142 A145 H146 T149 D374 N375 N382	E38-M378 HydrophobicContact CG-CE 3.85Å; E38-M378 WeakPolarHBondContact OE2-CE 3.34Å; H142-M378 VanDerWaalsContact CE1-CE 3.47Å; H142-M378 WeakPolarHBondContact CE1-CE 3.4Å; H142-M378 WeakPolarHBondContact ND1-CE 3.45Å; A145-M378 HydrophobicContact CB-CB 4.15Å; A145-M378 HydrophobicContact CB-CG 3.96Å; A145-M378 HydrophobicContact CB-SD 4.34Å; H146-M378 PolarHBondContact CE1-SD 3.45Å; T149-M378 WeakPolarHBondContact OG1-CB 3.33Å; D374-M378 HydrophobicContact CB-CE 4.24Å; N375-M378 VanDerWaalsContact O-CG 3.27Å; N375-M378 WeakPolarHBondContact O-CG 3.46Å; N375-M378 PolarHBondContact OD1-N 3.12Å; M378-N382 PolarHBondContact O-N 2.97Å
379	V	98.7	Very high	95.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-72.3	-43.6	177.8	-177.1	0	0	0	0	110.3	E38 A108 T110 V140 G376 A377 W381 N382 G383	E38-V379 HydrophobicContact CB-CG2 3.81Å; E38-V379 HydrophobicContact CG-CG2 4.36Å; E38-V379 WeakPolarHBondContact OE2-CG2 3.29Å; A108-V379 HydrophobicContact CB-CG1 4.13Å; T110-V379 WeakPolarHBondContact OG1-CG2 3.38Å; V140-V379 HydrophobicContact CB-CG1 4.04Å; V140-V379 HydrophobicContact CG1-CG1 4.2Å; V140-V379 HydrophobicContact CG2-CG1 3.91Å; G376-V379 PolarHBondContact O-N 3.33Å; A377-V379 VanDerWaalsContact C-N 3.27Å; A377-V379 PolarHBondContact O-N 2.92Å; V379-W381 VanDerWaalsContact C-N 3.32Å; V379-W381 PolarHBondContact O-N 3.49Å; V379-N382 PolarHBondContact O-N 3.16Å; V379-G383 PolarHBondContact O-N 3.1Å
380	A	98.6	Very high	95.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.5	-45.4	174.9	0	0	0	0	0	110.6	M49 G376 A377 G383 V384	M49-A380 HydrophobicContact CB-CB 3.82Å; M49-A380 HydrophobicContact CE-CB 4.48Å; M49-A380 HydrophobicContact SD-CB 4.48Å; G376-A380 WeakPolarHBondContact O-CB 3.45Å; G376-A380 PolarHBondContact O-N 2.94Å; A377-A380 PolarHBondContact O-N 3.44Å; A380-G383 CarbonylContact O-C 3.5Å; A380-G383 WeakPolarHBondContact O-CA 3.41Å; A380-G383 PolarHBondContact O-N 3Å; A380-G383 VanDerWaalsContact O-N 3.15Å; A380-V384 WeakPolarHBondContact O-CG2 3.36Å; A380-V384 PolarHBondContact O-N 2.96Å
381	W	98.1	Very high	96	Very high	6 Å²	6	21.5 Å²	21.5	2%	0.023	12%	0.117	C	C	.	.	H	α-helix	trans	-62.8	-45.2	178.1	178.9	-111.7	0	0	0	112.9	M49 L148 R151 M152 A377 V379 G383 V384 E385	M49-W381 HydrophobicContact CE-CB 4.35Å; M49-W381 HydrophobicContact SD-CB 3.77Å; M49-W381 HydrophobicContact SD-CD2 4.42Å; M49-W381 HydrophobicContact SD-CE3 3.73Å; M49-W381 HydrophobicContact SD-CG 4.49Å; L148-W381 PolarHBondContact O-NE1 3.22Å; L148-W381 VanDerWaalsContact O-NE1 3.1Å; R151-W381 HydrophobicContact CB-CZ2 3.91Å; R151-W381 WeakPolarHBondContact O-CZ2 3.35Å; M152-W381 VanDerWaalsContact CA-CE2 3.49Å; M152-W381 HydrophobicContact CB-CB 4.4Å; M152-W381 HydrophobicContact CB-CD2 3.61Å; M152-W381 HydrophobicContact CB-CE3 4.07Å; M152-W381 HydrophobicContact CB-CG 3.74Å; M152-W381 HydrophobicContact CB-CZ2 4.36Å; M152-W381 HydrophobicContact CG-CB 4.42Å; M152-W381 HydrophobicContact CG-CD2 3.98Å; M152-W381 HydrophobicContact CG-CE3 4Å; M152-W381 HydrophobicContact CG-CG 4.16Å; M152-W381 VanDerWaalsContact N-CE2 3.33Å; M152-W381 HydrophobicContact SD-CB 4.24Å; A377-W381 WeakPolarHBondContact O-CB 3.31Å; A377-W381 PolarHBondContact O-N 3.32Å; V379-W381 VanDerWaalsContact C-N 3.32Å; V379-W381 PolarHBondContact O-N 3.49Å; W381-G383 PolarHBondContact O-N 2.92Å; W381-V384 HydrophobicContact CE3-CB 4.22Å; W381-V384 HydrophobicContact CE3-CG1 4.15Å; W381-V384 HydrophobicContact CZ3-CG1 4.08Å; W381-V384 WeakPolarHBondContact O-CB 3.46Å; W381-V384 PolarHBondContact O-N 2.83Å; W381-V384 VanDerWaalsContact O-N 3.08Å; W381-E385 HydrophobicContact CD2-CG 4.24Å; W381-E385 HydrophobicContact CZ2-CG 3.91Å; W381-E385 WeakPolarHBondContact O-CG 3.39Å; W381-E385 PolarHBondContact O-N 2.7Å
382	N	98.3	Very high	96.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-58	-41.3	173.5	-171.5	-83.3	0	0	0	110.9	V140 A145 L148 M378 V379 E385 R386	V140-N382 HydrophobicContact CG1-CB 3.94Å; V140-N382 HydrophobicContact CG2-CB 4.37Å; A145-N382 HydrophobicContact CB-CB 4.19Å; L148-N382 WeakPolarHBondContact CD1-ND2 3.21Å; M378-N382 PolarHBondContact O-N 2.97Å; V379-N382 PolarHBondContact O-N 3.16Å; N382-E385 PolarHBondContact O-N 3.48Å; N382-R386 WeakPolarHBondContact O-CB 3.44Å; N382-R386 WeakPolarHBondContact O-CG 3.29Å; N382-R386 PolarHBondContact O-N 2.92Å; N382-R386 WeakPolarHBondContact OD1-CD 3.47Å; N382-R386 PolarHBondContact OD1-NE 3.4Å
383	G	98.3	Very high	96.7	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.7	-41.8	172.7	0	0	0	0	0	113.6	V379 A380 W381 R386 L387	V379-G383 PolarHBondContact O-N 3.1Å; A380-G383 CarbonylContact O-C 3.5Å; A380-G383 WeakPolarHBondContact O-CA 3.41Å; A380-G383 PolarHBondContact O-N 3Å; A380-G383 VanDerWaalsContact O-N 3.15Å; W381-G383 PolarHBondContact O-N 2.92Å; G383-R386 PolarHBondContact O-N 3.33Å; G383-L387 WeakPolarHBondContact O-CB 3.42Å; G383-L387 WeakPolarHBondContact O-CG 3.47Å; G383-L387 PolarHBondContact O-N 3.16Å
384	V	97.9	Very high	97.1	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.012	14%	0.143	C	C	.	.	H	α-helix	trans	-61.2	-45.8	174.4	168.5	0	0	0	0	110.8	V34 M49 A380 W381 L387 R388	V34-V384 HydrophobicContact CB-CG2 3.9Å; V34-V384 HydrophobicContact CG2-CG2 3.64Å; M49-V384 HydrophobicContact CG-CG2 4.49Å; A380-V384 WeakPolarHBondContact O-CG2 3.36Å; A380-V384 PolarHBondContact O-N 2.96Å; W381-V384 HydrophobicContact CE3-CB 4.22Å; W381-V384 HydrophobicContact CE3-CG1 4.15Å; W381-V384 HydrophobicContact CZ3-CG1 4.08Å; W381-V384 WeakPolarHBondContact O-CB 3.46Å; W381-V384 PolarHBondContact O-N 2.83Å; W381-V384 VanDerWaalsContact O-N 3.08Å; V384-L387 PolarHBondContact O-N 3.07Å; V384-R388 WeakPolarHBondContact O-CG 3.3Å; V384-R388 PolarHBondContact O-N 3.44Å
385	E	97.7	Very high	97.3	Very high	5 Å²	5	26.6 Å²	26.6	2%	0.023	16%	0.156	C	C	.	.	H	α-helix	trans	-64.6	-42.5	178.4	-63.3	-135.3	103.6	0	0	111.9	R151 V178 W381 N382 L387 R388 E389	R151-E385 WeakPolarHBondContact CD-OE2 3.34Å; R151-E385 IonicContact CZ-OE1 3.73Å; R151-E385 VanDerWaalsContact CZ-OE1 3.3Å; R151-E385 IonicContact CZ-OE2 2.67Å; R151-E385 VanDerWaalsContact NE-CD 3.28Å; R151-E385 IonicContact NE-OE1 3.75Å; R151-E385 PolarHBondContact NE-OE1 2.8Å; R151-E385 IonicContact NE-OE2 3.57Å; R151-E385 PolarHBondContact NE-OE2 2.7Å; R151-E385 IonicContact NH2-OE1 3.7Å; R151-E385 PolarHBondContact NH2-OE1 2.95Å; R151-E385 IonicContact NH2-OE2 3.78Å; V178-E385 HydrophobicContact CG1-CB 3.88Å; V178-E385 HydrophobicContact CG2-CB 3.72Å; W381-E385 HydrophobicContact CD2-CG 4.24Å; W381-E385 HydrophobicContact CZ2-CG 3.91Å; W381-E385 WeakPolarHBondContact O-CG 3.39Å; W381-E385 PolarHBondContact O-N 2.7Å; N382-E385 PolarHBondContact O-N 3.48Å; E385-L387 VanDerWaalsContact C-N 3.35Å; E385-L387 PolarHBondContact O-N 3.31Å; E385-R388 WeakPolarHBondContact O-CB 3.48Å; E385-R388 PolarHBondContact O-N 2.98Å; E385-R388 IonicContact OE1-NH1 3.51Å; E385-E389 PolarHBondContact O-N 2.94Å; E385-E389 VanDerWaalsContact O-N 3.1Å
386	R	97.9	Very high	97.2	Very high	19 Å²	19	26.8 Å²	26.8	7%	0.072	16%	0.157	C	C	.	.	H	α-helix	trans	-62.1	-39.4	174	-74.4	-178.7	175.3	-90.6	0.8	112.5	I138 E144 V178 D179 N382 G383 E389 G390 I391	I138-R386 HydrophobicContact CG2-CB 4.12Å; I138-R386 HydrophobicContact CG2-CG 4.37Å; E144-R386 IonicContact OE1-NH2 2.69Å; E144-R386 IonicContact OE2-CZ 2.71Å; E144-R386 IonicContact OE2-NH2 3.51Å; E144-R386 PolarHBondContact OE2-NH2 3.33Å; V178-R386 HydrophobicContact CG1-CG 3.67Å; D179-R386 IonicContact OD2-NH1 2.89Å; N382-R386 WeakPolarHBondContact O-CB 3.44Å; N382-R386 WeakPolarHBondContact O-CG 3.29Å; N382-R386 PolarHBondContact O-N 2.92Å; N382-R386 WeakPolarHBondContact OD1-CD 3.47Å; N382-R386 PolarHBondContact OD1-NE 3.4Å; G383-R386 PolarHBondContact O-N 3.33Å; R386-E389 PolarHBondContact O-N 2.98Å; R386-G390 PolarHBondContact O-N 2.82Å; R386-I391 HydrophobicContact CB-CG1 4.15Å; R386-I391 HydrophobicContact CG-CD1 4.33Å; R386-I391 HydrophobicContact CG-CG1 4.08Å; R386-I391 PolarHBondContact O-N 3.33Å; R386-I391 VanDerWaalsContact O-N 3.07Å
387	L	96.1	Very high	97	Very high	16 Å²	16	32.8 Å²	32.8	8%	0.084	18%	0.184	C	C	.	.	H	α-helix	trans	-63.5	-40.1	173.2	-81	-172.3	0	0	0	112.6	R32 V34 A105 A106 I138 G383 V384 E385 E389 G390 I393	R32-L387 HydrophobicContact CB-CD1 4.28Å; R32-L387 PolarHBondContact NH1-O 3.08Å; V34-L387 HydrophobicContact CG2-CD1 3.38Å; V34-L387 HydrophobicContact CG2-CG 4.29Å; A105-L387 HydrophobicContact CB-CD1 3.91Å; A106-L387 HydrophobicContact CB-CD1 4.09Å; A106-L387 HydrophobicContact CB-CD2 4.07Å; A106-L387 HydrophobicContact CB-CG 4.34Å; I138-L387 HydrophobicContact CD1-CD2 3.83Å; I138-L387 HydrophobicContact CD1-CG 3.73Å; G383-L387 WeakPolarHBondContact O-CB 3.42Å; G383-L387 WeakPolarHBondContact O-CG 3.47Å; G383-L387 PolarHBondContact O-N 3.16Å; V384-L387 PolarHBondContact O-N 3.07Å; E385-L387 VanDerWaalsContact C-N 3.35Å; E385-L387 PolarHBondContact O-N 3.31Å; L387-E389 VanDerWaalsContact C-N 3.32Å; L387-G390 PolarHBondContact O-N 3.37Å; L387-I393 HydrophobicContact CD2-CD1 3.56Å; L387-I393 HydrophobicContact CD2-CG1 3.96Å
388	R	94.8	Very high	96.9	Very high	103 Å²	103	35.8 Å²	35.8	39%	0.389	20%	0.203	S	C	.	.	H	α-helix	trans	-62.7	-40.8	177.8	-74.1	170.1	179.5	160.8	-3.3	111.3	E51 V384 E385	E51-R388 PolarHBondContact O-NH2 3.34Å; V384-R388 WeakPolarHBondContact O-CG 3.3Å; V384-R388 PolarHBondContact O-N 3.44Å; E385-R388 WeakPolarHBondContact O-CB 3.48Å; E385-R388 PolarHBondContact O-N 2.98Å; E385-R388 IonicContact OE1-NH1 3.51Å
389	E	95.8	Very high	96.6	Very high	101 Å²	101	43.8 Å²	43.8	47%	0.472	24%	0.24	S	C	.	.	H	α-helix	trans	-83.7	-16.3	179.2	-65.7	-169.4	169.5	0	0	113.8	V178 E385 R386 L387 I391	V178-E389 VanDerWaalsContact CG2-CD 3.42Å; V178-E389 HydrophobicContact CG2-CG 4.3Å; V178-E389 VanDerWaalsContact CG2-OE1 3.32Å; V178-E389 WeakPolarHBondContact CG2-OE1 3.24Å; E385-E389 PolarHBondContact O-N 2.94Å; E385-E389 VanDerWaalsContact O-N 3.1Å; R386-E389 PolarHBondContact O-N 2.98Å; L387-E389 VanDerWaalsContact C-N 3.32Å; E389-I391 HydrophobicContact CB-CD1 4.19Å; E389-I391 HydrophobicContact CB-CG1 4.01Å; E389-I391 HydrophobicContact CB-CG2 4.2Å; E389-I391 WeakPolarHBondContact OE2-CD1 3.46Å
390	G	95.8	Very high	96.5	Very high	54 Å²	54	45 Å²	45	56%	0.557	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.6	31.9	-178.5	0	0	0	0	0	113.2	R386 L387	R386-G390 PolarHBondContact O-N 2.82Å; L387-G390 PolarHBondContact O-N 3.37Å
391	I	96.3	Very high	96.4	Very high	43 Å²	43	49.7 Å²	49.7	22%	0.221	28%	0.28	C	S	.	.			trans	-114.9	146.2	-174.4	62.3	172.6	0	0	0	111.7	V178 D179 R386 E389 I393	V178-I391 HydrophobicContact CB-CD1 4.16Å; V178-I391 HydrophobicContact CG1-CD1 4.27Å; D179-I391 HydrophobicContact CB-CD1 4.39Å; R386-I391 HydrophobicContact CB-CG1 4.15Å; R386-I391 HydrophobicContact CG-CD1 4.33Å; R386-I391 HydrophobicContact CG-CG1 4.08Å; R386-I391 PolarHBondContact O-N 3.33Å; R386-I391 VanDerWaalsContact O-N 3.07Å; E389-I391 HydrophobicContact CB-CD1 4.19Å; E389-I391 HydrophobicContact CB-CG1 4.01Å; E389-I391 HydrophobicContact CB-CG2 4.2Å; E389-I391 WeakPolarHBondContact OE2-CD1 3.46Å; I391-I393 PolarHBondContact O-N 2.89Å
392	G	95.3	Very high	96.4	Very high	32 Å²	32	53.5 Å²	53.5	33%	0.33	30%	0.295	S	S	.	.	S	Bend	trans	62.3	23.7	174	0	0	0	0	0	115.2	P139	P139-G392 WeakPolarHBondContact CD-O 3.26Å
393	I	97.6	Very high	96.3	Very high	68 Å²	68	57.4 Å²	57.4	35%	0.349	31%	0.313	S	S	.	.			trans	-93	114.6	177.8	-53	166.2	0	0	0	108.1	P136 I138 L387 I391	P136-I393 HydrophobicContact CB-CG2 3.56Å; P136-I393 HydrophobicContact CG-CG2 4.43Å; I138-I393 HydrophobicContact CD1-CG1 4.4Å; I138-I393 HydrophobicContact CG1-CG1 4.4Å; L387-I393 HydrophobicContact CD2-CD1 3.56Å; L387-I393 HydrophobicContact CD2-CG1 3.96Å; I391-I393 PolarHBondContact O-N 2.89Å
394	L	98.1	Very high	96.3	Very high	50 Å²	50	60 Å²	60	26%	0.262	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-103.6	146.7	-177.5	-54.2	-179	0	0	0	110.8	P136 F137 P139 V398 V400	P136-L394 CarbonylContact C-O 3.56Å; P136-L394 VanDerWaalsContact CA-O 3.29Å; P136-L394 WeakPolarHBondContact CA-O 3.41Å; F137-L394 PolarHBondContact N-O 3.1Å; F137-L394 WeakPolarHBondContact O-CB 3.48Å; F137-L394 PolarHBondContact O-N 3.06Å; P139-L394 HydrophobicContact CG-CD1 3.89Å; L394-V398 HydrophobicContact CB-CB 4.25Å; L394-V398 HydrophobicContact CB-CG1 4.48Å; L394-V398 HydrophobicContact CD1-CG1 4.16Å; L394-V400 HydrophobicContact CD1-CG2 3.47Å; L394-V400 VanDerWaalsContact CD1-CG2 3.47Å
395	A	97.1	Very high	96.1	Very high	48 Å²	48	71 Å²	71	40%	0.397	37%	0.371	S	S	.	.			trans	-67.8	149.3	169.2	0	0	0	0	0	110.2	E397 V398	A395-E397 WeakPolarHBondContact CB-OE2 3.36Å; A395-E397 PolarHBondContact O-N 2.9Å; A395-E397 VanDerWaalsContact O-N 3.09Å; A395-V398 HydrophobicContact CB-CG2 4.18Å; A395-V398 WeakPolarHBondContact O-CB 3.41Å; A395-V398 PolarHBondContact O-N 3.18Å
396	P	94.1	Very high	95.9	Very high	12 Å²	12	71.4 Å²	71.4	8%	0.078	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-21	-174.3	16.5	-25.2	0	0	0	114.7	V130 R131 K135	V130-P396 HydrophobicContact CB-CB 4.34Å; V130-P396 HydrophobicContact CG2-CB 4.23Å; R131-P396 HydrophobicContact CG-CB 4.37Å; R131-P396 WeakPolarHBondContact CG-O 3.47Å; R131-P396 PolarHBondContact NE-O 3.11Å; K135-P396 WeakPolarHBondContact O-CB 3.34Å
397	E	94.2	Very high	95.7	Very high	130 Å²	130	74.9 Å²	74.9	61%	0.607	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-19.9	179.5	-53.6	75.5	-164.2	0	0	112.5	A395 E399	A395-E397 WeakPolarHBondContact CB-OE2 3.36Å; A395-E397 PolarHBondContact O-N 2.9Å; A395-E397 VanDerWaalsContact O-N 3.09Å; E397-E399 PolarHBondContact O-N 3.29Å
398	V	95.7	Very high	95.7	Very high	63 Å²	63	74.2 Å²	74.2	38%	0.382	40%	0.397	S	S	.	.			trans	-67	122.5	-176.9	178.4	0	0	0	0	109.8	L394 A395	L394-V398 HydrophobicContact CB-CB 4.25Å; L394-V398 HydrophobicContact CB-CG1 4.48Å; L394-V398 HydrophobicContact CD1-CG1 4.16Å; A395-V398 HydrophobicContact CB-CG2 4.18Å; A395-V398 WeakPolarHBondContact O-CB 3.41Å; A395-V398 PolarHBondContact O-N 3.18Å
399	E	92.2	Very high	95.8	Very high	167 Å²	167	71 Å²	71	78%	0.78	40%	0.396	S	S	*	.			trans	-72.8	135.2	171.2	-68.5	-165.4	158.6	0	0	110.9	E397	E397-E399 PolarHBondContact O-N 3.29Å
400	V	96.3	Very high	95.9	Very high	25 Å²	25	70.3 Å²	70.3	15%	0.152	40%	0.398	C	S	.	.			trans	-123.9	142.2	177.7	178.9	0	0	0	0	107.9	V111 L123 Q127 F137 P139 L394	V111-V400 HydrophobicContact CG1-CG1 4.28Å; L123-V400 HydrophobicContact CD1-CB 4.21Å; L123-V400 HydrophobicContact CD1-CG1 4.24Å; L123-V400 WeakPolarHBondContact CD2-O 3.32Å; Q127-V400 PolarHBondContact NE2-O 3.44Å; Q127-V400 VanDerWaalsContact NE2-O 3.1Å; F137-V400 HydrophobicContact CD1-CG2 3.92Å; F137-V400 HydrophobicContact CE1-CB 4.18Å; F137-V400 HydrophobicContact CE1-CG1 4.21Å; F137-V400 HydrophobicContact CE1-CG2 3.91Å; P139-V400 HydrophobicContact CB-CG1 4.24Å; L394-V400 HydrophobicContact CD1-CG2 3.47Å; L394-V400 VanDerWaalsContact CD1-CG2 3.47Å
401	S	96.9	Very high	96	Very high	99 Å²	99	70.9 Å²	70.9	69%	0.692	39%	0.389	S	S	*	.			trans	-106	152.2	172.3	-61.6	0	0	0	0	110.2
402	Y	97.4	Very high	96.1	Very high	87 Å²	87	69.5 Å²	69.5	34%	0.341	38%	0.382	S	S	.	.			trans	-91.5	150.3	170.9	64.5	-93.1	0	0	0	110.9	V111 A116 L119 A120 L123 P404	V111-Y402 CarbonylContact O-C 3.56Å; V111-Y402 VanDerWaalsContact O-CA 3.24Å; V111-Y402 WeakPolarHBondContact O-CA 3.35Å; V111-Y402 VanDerWaalsContact O-CB 3.3Å; V111-Y402 WeakPolarHBondContact O-CB 3.43Å; A116-Y402 HydrophobicContact CB-CE2 3.82Å; A116-Y402 WeakPolarHBondContact O-CE2 3.27Å; L119-Y402 HydrophobicContact CB-CD2 3.95Å; L119-Y402 HydrophobicContact CB-CG 3.94Å; L119-Y402 HydrophobicContact CD1-CD2 4.15Å; A120-Y402 HydrophobicContact CB-CD1 4.21Å; A120-Y402 HydrophobicContact CB-CE1 3.61Å; L123-Y402 HydrophobicContact CD2-CD1 4.09Å; Y402-P404 HydrophobicContact CD2-CG 3.89Å; Y402-P404 HydrophobicContact CE2-CG 3.82Å
403	E	97.9	Very high	96.2	Very high	82 Å²	82	69.2 Å²	69.2	38%	0.383	37%	0.373	S	S	.	.			trans	-122.6	100.8	179.5	-59.7	172.4	-115.1	0	0	109.1	V111 K112 P113 R405 A406	V111-E403 PolarHBondContact O-N 2.94Å; K112-E403 WeakPolarHBondContact CA-O 3.25Å; K112-E403 HydrophobicContact CB-CB 3.8Å; K112-E403 WeakPolarHBondContact CB-O 3.47Å; K112-E403 HydrophobicContact CD-CB 4.13Å; K112-E403 HydrophobicContact CD-CG 4.3Å; K112-E403 VanDerWaalsContact CD-OE1 3.23Å; K112-E403 WeakPolarHBondContact CD-OE1 3.49Å; K112-E403 IonicContact NZ-OE1 3.52Å; K112-E403 PolarHBondContact NZ-OE1 3.36Å; K112-E403 IonicContact NZ-OE2 3.44Å; P113-E403 WeakPolarHBondContact CA-O 3.41Å; E403-R405 PolarHBondContact O-N 3.14Å; E403-A406 HydrophobicContact CB-CB 4.35Å
404	P	96.3	Very high	96.2	Very high	54 Å²	54	69.4 Å²	69.4	35%	0.351	39%	0.386	S	S	.	.	S	Bend	trans	-60.1	-31.3	-177.6	-25.9	35.6	0	0	0	113.4	P113 G114 A116 Y402	P113-P404 WeakPolarHBondContact CB-O 3.41Å; G114-P404 PolarHBondContact N-O 3.33Å; G114-P404 VanDerWaalsContact O-CA 3.26Å; G114-P404 WeakPolarHBondContact O-CA 3.45Å; G114-P404 WeakPolarHBondContact O-CB 3.46Å; A116-P404 HydrophobicContact CB-CB 4.12Å; A116-P404 HydrophobicContact CB-CG 3.55Å; Y402-P404 HydrophobicContact CD2-CG 3.89Å; Y402-P404 HydrophobicContact CE2-CG 3.82Å
405	R	94.1	Very high	96.1	Very high	232 Å²	232	72.3 Å²	72.3	88%	0.875	40%	0.398	S	S	*	.	S	Bend	trans	-119.8	117	174.1	-65	-177.7	-179.6	174	0.3	108.3	E403	E403-R405 PolarHBondContact O-N 3.14Å
406	A	94.6	Very high	96.1	Very high	15 Å²	15	70.1 Å²	70.1	12%	0.124	38%	0.379	C	S	.	.			trans	-140.2	121.7	175.6	0	0	0	0	0	108.7	K112 P113 E403	K112-A406 HydrophobicContact CB-CB 3.75Å; K112-A406 HydrophobicContact CD-CB 3.76Å; K112-A406 HydrophobicContact CG-CB 3.95Å; P113-A406 HydrophobicContact CB-CB 4.38Å; E403-A406 HydrophobicContact CB-CB 4.35Å
407	P	93.8	Very high	96.2	Very high	91 Å²	91	75.8 Å²	75.8	59%	0.591	40%	0.399	S	S	*	.			trans	-69.8	147	173.4	29.8	-33.1	0	0	0	110.5	G409	P407-G409 PolarHBondContact O-N 3.44Å
408	L	95.9	Very high	96.3	Very high	3 Å²	3	73.6 Å²	73.6	2%	0.016	40%	0.403	C	S	.	.			trans	-82.5	112.9	173.8	178.7	66.8	0	0	0	109.7	M143 E144 L164 A173 F181 L183	M143-L408 HydrophobicContact CB-CD1 4.17Å; M143-L408 HydrophobicContact CB-CD2 4.26Å; E144-L408 HydrophobicContact CG-CD1 3.69Å; L164-L408 HydrophobicContact CD1-CD2 4.06Å; A173-L408 HydrophobicContact CB-CD2 3.97Å; F181-L408 HydrophobicContact CB-CD1 4.23Å; F181-L408 HydrophobicContact CB-CG 4.08Å; F181-L408 HydrophobicContact CD1-CD1 4.11Å; F181-L408 HydrophobicContact CD1-CD2 4.14Å; F181-L408 HydrophobicContact CD1-CG 4.24Å; F181-L408 HydrophobicContact CD2-CD1 4.02Å; F181-L408 HydrophobicContact CE1-CD1 4.49Å; F181-L408 HydrophobicContact CE2-CD1 4.44Å; F181-L408 HydrophobicContact CG-CD1 3.86Å; F181-L408 HydrophobicContact CG-CG 4.12Å; L183-L408 WeakPolarHBondContact CB-O 3.48Å
409	G	96.4	Very high	96.3	Very high	34 Å²	34	72.9 Å²	72.9	35%	0.351	40%	0.404	S	S	.	.	S	Bend	trans	65.5	-163.8	172.1	0	0	0	0	0	115.4	F181 P407	F181-G409 CarbonylContact O-C 3.55Å; F181-G409 VanDerWaalsContact O-CA 3.25Å; F181-G409 WeakPolarHBondContact O-CA 3.27Å; P407-G409 PolarHBondContact O-N 3.44Å
410	V	98.2	Very high	96.4	Very high	87 Å²	87	67.6 Å²	67.6	53%	0.527	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	125.6	178.4	-179.4	0	0	0	0	109.8	F181 L182 L183 I412	F181-V410 PolarHBondContact O-N 3.19Å; L182-V410 HydrophobicContact CD2-CB 4.13Å; L183-V410 PolarHBondContact N-O 3.41Å; V410-I412 HydrophobicContact CG1-CG2 4.32Å; V410-I412 PolarHBondContact O-N 2.93Å
411	D	98	Very high	96.3	Very high	67 Å²	67	67.6 Å²	67.6	36%	0.358	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	111.9	179.6	-167.9	-23.5	0	0	0	111.6	L183 R186 T413	L183-D411 HydrophobicContact CD2-CB 4.47Å; R186-D411 IonicContact CZ-OD2 3.99Å; R186-D411 IonicContact NH1-OD2 3.66Å; R186-D411 IonicContact NH2-OD2 3.81Å; D411-T413 WeakPolarHBondContact OD1-CB 3.34Å; D411-T413 WeakPolarHBondContact OD1-CG2 3.41Å; D411-T413 PolarHBondContact OD1-N 3.48Å; D411-T413 PolarHBondContact OD1-OG1 3Å
412	I	98.2	Very high	95.9	Very high	13 Å²	13	73.7 Å²	73.7	7%	0.067	40%	0.395	C	S	.	.			trans	-115.5	22	175.3	62.8	167.3	0	0	0	112.1	L182 L183 L184 F323 V410 A414 E415 V416	L182-I412 HydrophobicContact CB-CD1 3.9Å; L182-I412 HydrophobicContact CB-CG1 4.28Å; L182-I412 HydrophobicContact CD1-CD1 4.13Å; L182-I412 HydrophobicContact CG-CD1 4.45Å; L183-I412 VanDerWaalsContact O-CG1 3.27Å; L183-I412 WeakPolarHBondContact O-CG1 3.44Å; L183-I412 PolarHBondContact O-N 3.03Å; L184-I412 HydrophobicContact CD2-CD1 3.55Å; L184-I412 HydrophobicContact CD2-CG1 3.83Å; F323-I412 HydrophobicContact CE1-CD1 4.12Å; V410-I412 HydrophobicContact CG1-CG2 4.32Å; V410-I412 PolarHBondContact O-N 2.93Å; I412-A414 PolarHBondContact O-N 3.46Å; I412-E415 HydrophobicContact CB-CB 4.43Å; I412-E415 HydrophobicContact CB-CG 4.4Å; I412-E415 WeakPolarHBondContact O-CB 3.17Å; I412-E415 PolarHBondContact O-N 3.36Å; I412-V416 PolarHBondContact O-N 3.22Å; I412-V416 VanDerWaalsContact O-N 3.15Å
413	T	97.1	Very high	95.5	Very high	26 Å²	26	72 Å²	72	16%	0.16	39%	0.392	C	S	.	.	H	α-helix	trans	-59	-30.9	179.5	56.7	0	0	0	0	112.9	L183 L184 D411 V416 R417	L183-T413 PolarHBondContact O-N 3.17Å; L184-T413 WeakPolarHBondContact O-CG2 3.4Å; D411-T413 WeakPolarHBondContact OD1-CB 3.34Å; D411-T413 WeakPolarHBondContact OD1-CG2 3.41Å; D411-T413 PolarHBondContact OD1-N 3.48Å; D411-T413 PolarHBondContact OD1-OG1 3Å; T413-V416 PolarHBondContact O-N 2.93Å; T413-R417 PolarHBondContact O-N 2.9Å
414	A	96.9	Very high	94.8	Very high	73 Å²	73	71.6 Å²	71.6	60%	0.603	40%	0.397	S	S	*	.	H	α-helix	trans	-65.3	-40.7	175.3	0	0	0	0	0	112.2	I412 R417 A418	I412-A414 PolarHBondContact O-N 3.46Å; A414-R417 PolarHBondContact O-N 3.42Å; A414-A418 WeakPolarHBondContact O-CB 3.41Å; A414-A418 PolarHBondContact O-N 3.45Å
415	E	97.7	Very high	93.6	Very high	111 Å²	111	75 Å²	75	52%	0.519	42%	0.422	S	S	.	.	H	α-helix	trans	-66.8	-42.7	177.2	-61.8	169.1	-159.7	0	0	110.9	F323 I412 R417 A418 A419	F323-E415 HydrophobicContact CZ-CB 4.33Å; I412-E415 HydrophobicContact CB-CB 4.43Å; I412-E415 HydrophobicContact CB-CG 4.4Å; I412-E415 WeakPolarHBondContact O-CB 3.17Å; I412-E415 PolarHBondContact O-N 3.36Å; E415-R417 VanDerWaalsContact C-N 3.31Å; E415-R417 PolarHBondContact O-N 2.88Å; E415-A418 PolarHBondContact O-N 3.23Å; E415-A419 PolarHBondContact O-N 2.9Å
416	V	96.7	Very high	92.4	Very high	1 Å²	1	66.2 Å²	66.2	1%	0.006	39%	0.392	C	S	.	.	H	α-helix	trans	-58.1	-44.6	174.7	175.2	0	0	0	0	111.1	L184 C244 F323 I412 T413 A419	L184-V416 HydrophobicContact CB-CG2 4.14Å; L184-V416 HydrophobicContact CD2-CG2 4.05Å; C244-V416 HydrophobicContact CB-CG1 4.05Å; C244-V416 WeakPolarHBondContact SG-CG1 3.39Å; F323-V416 HydrophobicContact CD1-CG2 3.88Å; F323-V416 HydrophobicContact CD2-CB 4.37Å; F323-V416 HydrophobicContact CD2-CG2 4.08Å; F323-V416 HydrophobicContact CE1-CG2 3.73Å; F323-V416 HydrophobicContact CE2-CB 4.32Å; F323-V416 HydrophobicContact CE2-CG2 3.94Å; F323-V416 HydrophobicContact CG-CG2 4.05Å; F323-V416 HydrophobicContact CZ-CG2 3.76Å; I412-V416 PolarHBondContact O-N 3.22Å; I412-V416 VanDerWaalsContact O-N 3.15Å; T413-V416 PolarHBondContact O-N 2.93Å; V416-A419 PolarHBondContact O-N 3.19Å
417	R	95.8	Very high	90.7	Very high	132 Å²	132	75.3 Å²	75.3	50%	0.498	42%	0.423	S	S	.	.	H	α-helix	trans	-65.2	-43.1	177.1	-179	178.4	-70.3	171.2	-1.3	111.7	D243 T413 A414 E415 A419 A420	D243-R417 HydrophobicContact CB-CB 4.19Å; D243-R417 IonicContact OD2-CZ 3Å; D243-R417 IonicContact OD2-NE 2.89Å; D243-R417 IonicContact OD2-NH2 3.57Å; D243-R417 PolarHBondContact OD2-NH2 3.24Å; T413-R417 PolarHBondContact O-N 2.9Å; A414-R417 PolarHBondContact O-N 3.42Å; E415-R417 VanDerWaalsContact C-N 3.31Å; E415-R417 PolarHBondContact O-N 2.88Å; R417-A419 VanDerWaalsContact C-N 3.27Å; R417-A419 PolarHBondContact O-N 3.29Å; R417-A420 PolarHBondContact O-N 3.03Å; R417-A420 VanDerWaalsContact O-N 3.13Å
418	A	96.6	Very high	89.2	Confident	83 Å²	83	73 Å²	73	69%	0.686	41%	0.405	S	S	*	.	H	α-helix	trans	-63.4	-32.4	179.7	0	0	0	0	0	112.5	A414 E415 A420	A414-A418 WeakPolarHBondContact O-CB 3.41Å; A414-A418 PolarHBondContact O-N 3.45Å; E415-A418 PolarHBondContact O-N 3.23Å; A418-A420 PolarHBondContact O-N 3.44Å
419	A	96	Very high	87.6	Confident	49 Å²	49	80.1 Å²	80.1	41%	0.405	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-16.4	176	0	0	0	0	0	113.9	F323 E415 V416 R417 I421	F323-A419 HydrophobicContact CD2-CB 3.93Å; F323-A419 HydrophobicContact CE2-CB 3.98Å; E415-A419 PolarHBondContact O-N 2.9Å; V416-A419 PolarHBondContact O-N 3.19Å; R417-A419 VanDerWaalsContact C-N 3.27Å; R417-A419 PolarHBondContact O-N 3.29Å; A419-I421 HydrophobicContact CB-CD1 4.17Å; A419-I421 HydrophobicContact CB-CG1 3.99Å; A419-I421 PolarHBondContact O-N 3.48Å
420	A	93.7	Very high	86	Confident	55 Å²	55	78.7 Å²	78.7	46%	0.455	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	37.1	172.3	0	0	0	0	0	114.8	R417 A418 R422	R417-A420 PolarHBondContact O-N 3.03Å; R417-A420 VanDerWaalsContact O-N 3.13Å; A418-A420 PolarHBondContact O-N 3.44Å; A420-R422 PolarHBondContact O-N 3.31Å
421	I	93.1	Very high	84.2	Confident	25 Å²	25	77.9 Å²	77.9	13%	0.128	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-66	118.6	-170.5	-64.7	171.3	0	0	0	111.1	R319 L322 F323 A419	R319-I421 HydrophobicContact CG-CB 3.93Å; R319-I421 HydrophobicContact CG-CG2 4.06Å; R319-I421 PolarHBondContact NE-O 3.04Å; R319-I421 VanDerWaalsContact NE-O 3.08Å; L322-I421 HydrophobicContact CB-CG2 3.85Å; L322-I421 HydrophobicContact CD1-CG2 3.86Å; F323-I421 HydrophobicContact CB-CD1 3.56Å; F323-I421 HydrophobicContact CD2-CD1 3.9Å; F323-I421 HydrophobicContact CG-CD1 4.23Å; A419-I421 HydrophobicContact CB-CD1 4.17Å; A419-I421 HydrophobicContact CB-CG1 3.99Å; A419-I421 PolarHBondContact O-N 3.48Å
422	R	90.4	Very high	81.9	Confident	228 Å²	228	82.4 Å²	82.4	86%	0.86	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-83.6	132.8	172.2	-65.3	-173.2	178.4	-173.8	0	109.9	A420	A420-R422 PolarHBondContact O-N 3.31Å
423	L	88	Confident	81.1	Confident	51 Å²	51	85.9 Å²	85.9	27%	0.267	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-78.3	131.3	177.7	-65	-179.9	0	0	0	109.9	K315 H318 R319 L322	K315-L423 HydrophobicContact CB-CD1 3.92Å; K315-L423 HydrophobicContact CG-CD1 4.16Å; K315-L423 WeakPolarHBondContact O-CD1 3.3Å; H318-L423 HydrophobicContact CB-CD2 4.1Å; R319-L423 HydrophobicContact CB-CD2 3.82Å; R319-L423 HydrophobicContact CG-CD2 4.46Å; L322-L423 HydrophobicContact CD1-CD2 4.09Å
424	P	83.7	Confident	80.3	Confident	74 Å²	74	89 Å²	89	48%	0.481	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-64.8	155.5	167.5	27.5	-31.4	0	0	0	109.9	I426	P424-I426 PolarHBondContact O-N 3.05Å
425	S	70.8	Confident	79.4	Confident	126 Å²	126	89.9 Å²	89.9	88%	0.881	47%	0.468	S	S	*	.			trans	-68.4	94.1	176.3	-172.5	0	0	0	0	109.7
426	I	68.1	Low	78.3	Confident	47 Å²	47	88.6 Å²	88.6	24%	0.241	47%	0.465	C	S	.	.			trans	-94.2	117.1	164.5	-60.6	-174.1	0	0	0	106	H318 A359 P424 I428	H318-I426 WeakPolarHBondContact CE1-CD1 3.44Å; A359-I426 HydrophobicContact CB-CD1 3.77Å; A359-I426 HydrophobicContact CB-CG2 4.35Å; P424-I426 PolarHBondContact O-N 3.05Å; I426-I428 HydrophobicContact CG2-CG1 4.21Å; I426-I428 PolarHBondContact O-N 3.09Å
427	R	59.7	Low	77.1	Confident	206 Å²	206	94.1 Å²	94.1	78%	0.777	49%	0.494	S	S	*	.			trans	-66.7	93.2	162.8	-77.2	-173.9	178.9	178.7	-0.7	106.4	K429	R427-K429 HydrophobicContact CB-CG 4.45Å; R427-K429 PolarHBondContact O-N 3.1Å
428	I	62.6	Low	75.9	Confident	41 Å²	41	91.6 Å²	91.6	21%	0.21	49%	0.493	C	S	.	.			trans	-68	81.5	169.8	-49.2	177.5	0	0	0	106.4	A314 V355 I426 I430	A314-I428 HydrophobicContact CB-CD1 3.96Å; V355-I428 HydrophobicContact CB-CG2 4.48Å; V355-I428 HydrophobicContact CG1-CG2 4.2Å; I426-I428 HydrophobicContact CG2-CG1 4.21Å; I426-I428 PolarHBondContact O-N 3.09Å; I428-I430 HydrophobicContact CG2-CD1 4.15Å; I428-I430 HydrophobicContact CG2-CG1 3.51Å; I428-I430 PolarHBondContact O-N 2.94Å
429	K	62.7	Low	74.4	Confident	153 Å²	153	92.2 Å²	92.2	67%	0.665	48%	0.479	S	S	*	.			trans	-77.5	83.6	167.1	-72.7	-171	179.3	-176.4	0	105.8	R427 P431	R427-K429 HydrophobicContact CB-CG 4.45Å; R427-K429 PolarHBondContact O-N 3.1Å; K429-P431 VanDerWaalsContact O-CD 3.26Å; K429-P431 WeakPolarHBondContact O-CD 3.2Å
430	I	63	Low	72.7	Confident	4 Å²	4	95.5 Å²	95.5	2%	0.021	49%	0.485	C	S	.	.			trans	-65	116.7	168.6	-50.1	175.1	0	0	0	105	A310 Y348 K351 A352 I428 D432	A310-I430 HydrophobicContact CB-CD1 4.38Å; Y348-I430 HydrophobicContact CD1-CG2 4.38Å; Y348-I430 HydrophobicContact CD2-CG2 4.16Å; Y348-I430 HydrophobicContact CE1-CD1 3.71Å; Y348-I430 HydrophobicContact CE1-CG2 3.87Å; Y348-I430 HydrophobicContact CE2-CB 4.43Å; Y348-I430 HydrophobicContact CE2-CG2 3.64Å; Y348-I430 VanDerWaalsContact CZ-CG2 3.48Å; K351-I430 HydrophobicContact CB-CG2 4.34Å; A352-I430 HydrophobicContact CB-CD1 3.6Å; A352-I430 HydrophobicContact CB-CG1 3.89Å; A352-I430 HydrophobicContact CB-CG2 4.23Å; I428-I430 HydrophobicContact CG2-CD1 4.15Å; I428-I430 HydrophobicContact CG2-CG1 3.51Å; I428-I430 PolarHBondContact O-N 2.94Å; I430-D432 PolarHBondContact O-N 3.42Å
431	P	59	Low	71	Confident	70 Å²	70	98.9 Å²	98.9	46%	0.455	49%	0.488	S	S	.	.			trans	-57.1	137.1	174.7	-15.9	28.2	0	0	0	107.9	K429	K429-P431 VanDerWaalsContact O-CD 3.26Å; K429-P431 WeakPolarHBondContact O-CD 3.2Å
432	D	50.9	Low	69	Low	162 Å²	162	105.6 Å²	105.6	87%	0.866	52%	0.52	S	S	*	.			trans	-58	0	175.1	-60.7	-39.5	0	0	0	110.7	R229 K351 I430	R229-D432 IonicContact NE-OD1 2.77Å; R229-D432 PolarHBondContact NE-OD1 3.28Å; R229-D432 IonicContact NH2-OD1 3.19Å; K351-D432 PolarHBondContact NZ-O 3.28Å; I430-D432 PolarHBondContact O-N 3.42Å

Retrieved 432 of 432 residues in 3175.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).