A0A087Y4X1_POEFO Loading...

REL proto-oncogene, NF-kB subunit

AlphaFold DB , UniProt , Accession A0A087Y4X1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 642 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.8	Very low	39	Very low	231 Å²	231	147.9 Å²	147.9	100%	1.138	83%	0.826	S	S	*	*				0	93.2	0	-91.2	-167.6	177	0	0	105.3
2	D	33.6	Very low	38.8	Very low	151 Å²	151	143.3 Å²	143.3	81%	0.807	80%	0.798	S	S	*	*			trans	-111.1	135.5	-153.2	-62	-97.5	0	0	0	108.7	L4	D2-L4 PolarHBondContact O-N 3.2Å
3	V	38.3	Very low	39.5	Very low	127 Å²	127	140.8 Å²	140.8	77%	0.77	79%	0.793	S	S	*	*			trans	-75.6	113.3	-167	179.2	0	0	0	0	109.4	M5	V3-M5 HydrophobicContact CG1-CE 4.26Å; V3-M5 PolarHBondContact O-N 3.15Å; V3-M5 VanDerWaalsContact O-N 3.15Å
4	L	41.2	Very low	39.9	Very low	162 Å²	162	143.1 Å²	143.1	85%	0.848	79%	0.793	S	S	*	*			trans	-58.5	115	172.5	-78.2	160.6	0	0	0	110.1	D2	D2-L4 PolarHBondContact O-N 3.2Å
5	M	37.6	Very low	40.5	Very low	149 Å²	149	142.8 Å²	142.8	73%	0.734	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-69.1	132.3	160.4	-68.9	-69.6	98.8	0	0	108.5	V3	V3-M5 HydrophobicContact CG1-CE 4.26Å; V3-M5 PolarHBondContact O-N 3.15Å; V3-M5 VanDerWaalsContact O-N 3.15Å
6	P	40.1	Very low	41.6	Very low	120 Å²	120	143.5 Å²	143.5	78%	0.779	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66.2	141.1	174.3	28.4	-33.7	0	0	0	110.2
7	S	37.5	Very low	43.7	Very low	112 Å²	112	138.7 Å²	138.7	78%	0.783	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-59.3	152.2	-172.8	-58.5	0	0	0	0	113.9	L9	S7-L9 PolarHBondContact O-N 3.24Å
8	I	42.7	Very low	46	Very low	152 Å²	152	139.2 Å²	139.2	78%	0.779	77%	0.766	S	S	*	*			trans	-45.9	121.2	162.5	-62.3	158.8	0	0	0	108.7	E10	I8-E10 PolarHBondContact O-N 3.21Å
9	L	40.6	Very low	48.3	Very low	169 Å²	169	132.8 Å²	132.8	89%	0.885	73%	0.732	S	S	*	*			trans	-73.2	105.5	158.9	-75.3	173.2	0	0	0	107	S7 G11	S7-L9 PolarHBondContact O-N 3.24Å; L9-G11 VanDerWaalsContact C-N 3.33Å; L9-G11 PolarHBondContact O-N 3.48Å
10	E	41.4	Very low	50.5	Low	187 Å²	187	129.5 Å²	129.5	87%	0.874	72%	0.716	S	S	*	*			trans	-60.6	100.4	162.5	-70.2	-179.7	112.9	0	0	107.5	I8 D12	I8-E10 PolarHBondContact O-N 3.21Å; E10-D12 PolarHBondContact O-N 3.23Å
11	G	37.8	Very low	52.6	Low	67 Å²	67	124.5 Å²	124.5	69%	0.691	69%	0.689	S	S	*	*			trans	-65.7	118	171.9	0	0	0	0	0	108.6	L9 P13	L9-G11 VanDerWaalsContact C-N 3.33Å; L9-G11 PolarHBondContact O-N 3.48Å; G11-P13 VanDerWaalsContact O-N 3.12Å
12	D	36.7	Very low	55.3	Low	92 Å²	92	118.6 Å²	118.6	49%	0.492	66%	0.659	S	S	.	*			trans	-44.6	116.9	-178.5	-177	-14.1	0	0	0	110.7	E10 H14 L15	E10-D12 PolarHBondContact O-N 3.23Å; D12-H14 PolarHBondContact O-N 2.82Å; D12-H14 PolarHBondContact OD1-N 3.2Å; D12-L15 HydrophobicContact CB-CD1 4.48Å; D12-L15 PolarHBondContact O-N 3.16Å
13	P	48.4	Very low	58.3	Low	112 Å²	112	113.2 Å²	113.2	73%	0.727	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-62.6	-15	-174.2	24.7	-33.9	0	0	0	113.1	G11 L15	G11-P13 VanDerWaalsContact O-N 3.12Å; P13-L15 VanDerWaalsContact C-N 3.3Å; P13-L15 PolarHBondContact O-N 2.94Å
14	H	45.3	Very low	61.1	Low	172 Å²	172	112.5 Å²	112.5	80%	0.796	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-75.2	-9.1	173.2	-90.5	-62.5	0	0	0	115.3	D12	D12-H14 PolarHBondContact O-N 2.82Å; D12-H14 PolarHBondContact OD1-N 3.2Å
15	L	48.4	Very low	63.8	Low	139 Å²	139	105.7 Å²	105.7	73%	0.728	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-95.3	1.3	178.2	-70.3	175.9	0	0	0	114.7	D12 P13 A17	D12-L15 HydrophobicContact CB-CD1 4.48Å; D12-L15 PolarHBondContact O-N 3.16Å; P13-L15 VanDerWaalsContact C-N 3.3Å; P13-L15 PolarHBondContact O-N 2.94Å; L15-A17 PolarHBondContact O-N 2.87Å
16	M	58.7	Low	66.7	Low	154 Å²	154	100.5 Å²	100.5	76%	0.759	55%	0.554	S	S	*	*	S	Bend	trans	-78.7	101.5	166	-69.4	-64.5	101.1	0	0	109.8
17	A	76.5	Confident	69.5	Low	62 Å²	62	94.8 Å²	94.8	51%	0.512	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-53.8	148.7	175.4	0	0	0	0	0	111.8	L15 N65	L15-A17 PolarHBondContact O-N 2.87Å; A17-N65 WeakPolarHBondContact O-CB 3.32Å; A17-N65 PolarHBondContact O-ND2 2.87Å
18	E	86.1	Confident	72.3	Confident	147 Å²	147	92.9 Å²	92.9	69%	0.687	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-59.9	142.9	-170.4	-68.5	-153.3	109.8	0	0	113.7	T20 N65	E18-T20 PolarHBondContact O-N 3.2Å; E18-T20 PolarHBondContact O-OG1 2.95Å; E18-N65 PolarHBondContact O-ND2 2.78Å
19	P	89.9	Confident	74.9	Confident	19 Å²	19	88.7 Å²	88.7	12%	0.123	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-53.1	121.8	169.6	-29.4	36.9	0	0	0	112.1	L64 Y66 L167 L178	P19-L64 WeakPolarHBondContact CA-O 3.36Å; P19-Y66 HydrophobicContact CG-CD2 4.29Å; P19-L167 HydrophobicContact CB-CD1 3.53Å; P19-L167 HydrophobicContact CG-CD1 4.02Å; P19-L178 HydrophobicContact CB-CD1 4.49Å; P19-L178 HydrophobicContact CB-CD2 4.19Å; P19-L178 WeakPolarHBondContact O-CD2 3.27Å
20	T	91.1	Very high	77.5	Confident	66 Å²	66	81.3 Å²	81.3	41%	0.405	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	162.6	-175.2	38.8	0	0	0	0	110.9	E18 L64	E18-T20 PolarHBondContact O-N 3.2Å; E18-T20 PolarHBondContact O-OG1 2.95Å; T20-L64 PolarHBondContact N-O 2.87Å; T20-L64 VanDerWaalsContact N-O 3.14Å; T20-L64 PolarHBondContact O-N 2.86Å
21	V	94.1	Very high	80	Confident	25 Å²	25	73.6 Å²	73.6	15%	0.152	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	135.7	-177.3	-80.2	0	0	0	0	110.6	L61 I63 V165 L178 I181	V21-L61 HydrophobicContact CB-CD1 4.23Å; V21-L61 HydrophobicContact CG1-CD2 4.21Å; V21-I63 HydrophobicContact CG1-CG1 4.26Å; V21-V165 HydrophobicContact CG1-CB 4.11Å; V21-V165 HydrophobicContact CG1-CG2 3.83Å; V21-L178 HydrophobicContact CG1-CD1 3.75Å; V21-L178 HydrophobicContact CG2-CB 4.46Å; V21-I181 HydrophobicContact CB-CD1 4.2Å; V21-I181 HydrophobicContact CG2-CD1 4.21Å; V21-I181 HydrophobicContact CG2-CG2 3.89Å
22	Q	95.4	Very high	82.6	Confident	107 Å²	107	71 Å²	71	50%	0.5	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	144.1	-179.9	-173.6	176.6	3.5	0	0	109.6	F24 Q62 L64	Q22-F24 PolarHBondContact O-N 3.24Å; Q22-Q62 PolarHBondContact N-O 2.83Å; Q22-Q62 PolarHBondContact O-N 2.81Å; Q22-L64 HydrophobicContact CB-CD1 4.34Å
23	I	97.4	Very high	85.4	Confident	38 Å²	38	69.8 Å²	69.8	20%	0.195	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	115.9	170.5	-59.6	168.9	0	0	0	107.8	E25 Q26 I181 T183	I23-E25 VanDerWaalsContact CG2-C 3.42Å; I23-E25 WeakPolarHBondContact CG2-O 3.4Å; I23-Q26 HydrophobicContact CG2-CG 4.02Å; I23-I181 HydrophobicContact CG1-CD1 3.72Å; I23-I181 HydrophobicContact CG1-CG1 4.42Å; I23-T183 HydrophobicContact CD1-CG2 3.96Å
24	F	96.9	Very high	87.8	Confident	112 Å²	112	64.6 Å²	64.6	49%	0.491	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-38.9	175.3	-176.2	-97.9	0	0	0	111.3	Q22 S60 Q62 V110	Q22-F24 PolarHBondContact O-N 3.24Å; F24-S60 WeakPolarHBondContact CB-O 3.4Å; F24-S60 PolarHBondContact N-O 3.15Å; F24-Q62 HydrophobicContact CB-CB 4.1Å; F24-Q62 HydrophobicContact CD2-CB 4.38Å; F24-V110 HydrophobicContact CB-CG1 4.29Å; F24-V110 HydrophobicContact CD1-CG1 3.95Å; F24-V110 HydrophobicContact CD2-CG2 4.22Å; F24-V110 HydrophobicContact CE1-CG1 4.44Å; F24-V110 HydrophobicContact CE2-CG2 4.42Å; F24-V110 HydrophobicContact CG-CG1 4.01Å; F24-V110 HydrophobicContact CG-CG2 4.47Å
25	E	98	Very high	90.2	Very high	19 Å²	19	60.1 Å²	60.1	9%	0.089	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	126.8	172.2	-169	172.3	172.1	0	0	110.2	I23 G48 E49 K50 T57 P59 S60	I23-E25 VanDerWaalsContact CG2-C 3.42Å; I23-E25 WeakPolarHBondContact CG2-O 3.4Å; E25-G48 VanDerWaalsContact OE1-C 3.24Å; E25-G48 VanDerWaalsContact OE1-CA 3.27Å; E25-G48 WeakPolarHBondContact OE1-CA 3.33Å; E25-E49 PolarHBondContact OE1-N 3.08Å; E25-K50 WeakPolarHBondContact OE1-CB 3.43Å; E25-K50 PolarHBondContact OE1-N 2.85Å; E25-T57 WeakPolarHBondContact OE1-CB 3.37Å; E25-T57 PolarHBondContact OE1-OG1 3.4Å; E25-T57 VanDerWaalsContact OE2-CB 3.25Å; E25-T57 WeakPolarHBondContact OE2-CB 3.49Å; E25-T57 PolarHBondContact OE2-OG1 3.27Å; E25-P59 WeakPolarHBondContact O-CA 3.38Å; E25-S60 PolarHBondContact N-O 2.65Å; E25-S60 VanDerWaalsContact N-O 3.11Å; E25-S60 PolarHBondContact O-N 3.16Å
26	Q	98.4	Very high	92.5	Very high	39 Å²	39	58.2 Å²	58.2	18%	0.182	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-69.5	160.3	175.1	-68.5	-77.6	9.1	0	0	110.7	I23 G48 E49 N184	I23-Q26 HydrophobicContact CG2-CG 4.02Å; Q26-G48 CarbonylContact O-C 3.58Å; Q26-G48 WeakPolarHBondContact O-CA 3.31Å; Q26-E49 HydrophobicContact CB-CB 4.05Å; Q26-E49 WeakPolarHBondContact O-CB 3.29Å; Q26-E49 PolarHBondContact O-N 2.91Å; Q26-N184 HydrophobicContact CB-CB 4.45Å; Q26-N184 VanDerWaalsContact CD-CG 3.49Å; Q26-N184 HydrophobicContact CG-CB 4.49Å; Q26-N184 WeakPolarHBondContact CG-ND2 3.29Å
27	P	98.1	Very high	94.2	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-70.3	145.9	165.3	32.1	-35	0	0	0	111	Q29 I46 P47 P59 T183 I186	P27-Q29 PolarHBondContact O-N 2.98Å; P27-I46 HydrophobicContact CB-CG2 3.53Å; P27-P47 WeakPolarHBondContact CA-O 3.2Å; P27-P59 HydrophobicContact CB-CB 4.33Å; P27-P59 HydrophobicContact CB-CG 3.85Å; P27-T183 HydrophobicContact CG-CG2 4.42Å; P27-I186 HydrophobicContact CB-CD1 3.67Å; P27-I186 HydrophobicContact CB-CG1 3.76Å; P27-I186 HydrophobicContact CG-CD1 3.9Å; P27-I186 HydrophobicContact CG-CG1 3.71Å
28	K	97	Very high	95	Very high	72 Å²	72	60.9 Å²	60.9	31%	0.313	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-62.6	124	168.4	-170.7	-177.6	172.3	-176.1	0	108.8	R30 P47 E196	K28-R30 WeakPolarHBondContact CD-O 3.36Å; K28-R30 WeakPolarHBondContact CE-O 3.05Å; K28-R30 WeakPolarHBondContact CG-O 3.36Å; K28-P47 HydrophobicContact CB-CB 4.2Å; K28-P47 HydrophobicContact CB-CG 4.23Å; K28-P47 PolarHBondContact N-O 3.19Å; K28-E196 WeakPolarHBondContact CE-OE1 3.45Å; K28-E196 IonicContact NZ-OE1 3.97Å; K28-E196 PolarHBondContact NZ-OE1 3.21Å
29	Q	96.9	Very high	95.3	Very high	64 Å²	64	56.3 Å²	56.3	30%	0.299	27%	0.273	S	S	.	.	S	Bend	trans	-70.8	-34	-172.4	-57.7	-169.2	53.5	0	0	113	P27 N184 P185 Y187	P27-Q29 PolarHBondContact O-N 2.98Å; Q29-N184 HydrophobicContact CG-CB 3.98Å; Q29-P185 VanDerWaalsContact CA-O 3.32Å; Q29-P185 WeakPolarHBondContact CA-O 3.36Å; Q29-P185 VanDerWaalsContact CB-O 3.23Å; Q29-P185 WeakPolarHBondContact CB-O 3.15Å; Q29-P185 VanDerWaalsContact CG-O 3.28Å; Q29-P185 WeakPolarHBondContact CG-O 3.28Å; Q29-Y187 HydrophobicContact CB-CD2 4.23Å; Q29-Y187 HydrophobicContact CB-CE2 4.49Å; Q29-Y187 WeakPolarHBondContact O-CB 3.35Å; Q29-Y187 WeakPolarHBondContact O-CD2 3.43Å; Q29-Y187 PolarHBondContact O-N 3.1Å
30	R	95.3	Very high	94.8	Very high	14 Å²	14	59.1 Å²	59.1	5%	0.053	31%	0.305	C	S	.	.	S	Bend	trans	-116.8	173.2	-177.1	-52.9	-62.1	-177	164.5	2	112.3	K28 M32 T194 E196 D281 E283	K28-R30 WeakPolarHBondContact CD-O 3.36Å; K28-R30 WeakPolarHBondContact CE-O 3.05Å; K28-R30 WeakPolarHBondContact CG-O 3.36Å; R30-M32 PolarHBondContact O-N 3.02Å; R30-M32 VanDerWaalsContact O-N 3.16Å; R30-T194 PolarHBondContact NH1-O 3.29Å; R30-E196 HydrophobicContact CB-CB 4.09Å; R30-E196 HydrophobicContact CB-CG 4.15Å; R30-D281 IonicContact CZ-OD2 3.75Å; R30-D281 IonicContact NH1-OD2 3.66Å; R30-D281 PolarHBondContact NH1-OD2 3.16Å; R30-D281 IonicContact NH2-OD2 2.82Å; R30-D281 PolarHBondContact NH2-OD2 3.1Å; R30-E283 WeakPolarHBondContact CG-OE1 3.32Å; R30-E283 IonicContact CZ-OE2 2.7Å; R30-E283 IonicContact NE-OE1 3.87Å; R30-E283 IonicContact NE-OE2 2.96Å; R30-E283 PolarHBondContact NE-OE2 2.84Å; R30-E283 IonicContact NH2-OE2 3.32Å; R30-E283 PolarHBondContact NH2-OE2 3.35Å
31	G	92.7	Very high	94.2	Very high	25 Å²	25	66 Å²	66	26%	0.258	32%	0.324	S	S	.	.	S	Bend	trans	85.8	-34	174.9	0	0	0	0	0	114.7	N189 E196	G31-N189 WeakPolarHBondContact CA-ND2 3.42Å; G31-N189 WeakPolarHBondContact O-CB 3.44Å; G31-N189 PolarHBondContact O-ND2 3.24Å; G31-E196 WeakPolarHBondContact CA-OE2 3.14Å
32	M	94.4	Very high	93.8	Very high	14 Å²	14	69.6 Å²	69.6	7%	0.069	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-69.1	132.4	175.7	-166.8	-167.9	179.3	0	0	111.6	R30 I46 I118 I186 Y187 N189	R30-M32 PolarHBondContact O-N 3.02Å; R30-M32 VanDerWaalsContact O-N 3.16Å; M32-I46 HydrophobicContact CE-CG1 3.67Å; M32-I46 HydrophobicContact SD-CB 4.11Å; M32-I46 HydrophobicContact SD-CG1 3.49Å; M32-I46 WeakPolarHBondContact SD-CG1 3.5Å; M32-I46 HydrophobicContact SD-CG2 4.49Å; M32-I118 HydrophobicContact CE-CB 4.28Å; M32-I118 HydrophobicContact CE-CD1 4.18Å; M32-I118 HydrophobicContact CE-CG1 4.15Å; M32-I118 HydrophobicContact SD-CD1 3.96Å; M32-I186 HydrophobicContact CB-CG2 4.44Å; M32-I186 HydrophobicContact SD-CG2 4.11Å; M32-Y187 VanDerWaalsContact O-O 3.12Å; M32-N189 VanDerWaalsContact O-CB 3.23Å; M32-N189 WeakPolarHBondContact O-CB 3.42Å; M32-N189 PolarHBondContact O-N 3.14Å
33	R	95.5	Very high	93.4	Very high	66 Å²	66	64.9 Å²	64.9	25%	0.249	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-102.3	133.1	171.6	163.9	170.9	172.8	-150.8	-8.3	111.3	E39 D188 N189 R190	R33-E39 IonicContact CZ-OE1 3.36Å; R33-E39 IonicContact CZ-OE2 2.68Å; R33-E39 IonicContact NH1-OE2 3.46Å; R33-E39 IonicContact NH2-OE1 2.7Å; R33-E39 PolarHBondContact NH2-OE1 2.84Å; R33-E39 IonicContact NH2-OE2 3.08Å; R33-E39 PolarHBondContact NH2-OE2 2.93Å; R33-D188 WeakPolarHBondContact CA-OD1 3.49Å; R33-N189 HydrophobicContact CB-CB 4.43Å; R33-R190 HydrophobicContact CG-CB 4.16Å
34	F	97.2	Very high	93	Very high	2 Å²	2	64.7 Å²	64.7	1%	0.009	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-76.6	152.8	170.5	-54.5	-12.4	0	0	0	110.9	H88 I118 C120 V159 I186 D188	F34-H88 AromaticContact CD2-CD2 3.72Å; F34-H88 AromaticContact CD2-NE2 3.84Å; F34-H88 AromaticContact CE2-CD2 3.99Å; F34-I118 HydrophobicContact CB-CG2 4.16Å; F34-I118 HydrophobicContact CD1-CB 3.76Å; F34-I118 HydrophobicContact CD1-CD1 3.88Å; F34-I118 HydrophobicContact CD1-CG1 4.43Å; F34-I118 HydrophobicContact CD1-CG2 3.68Å; F34-I118 HydrophobicContact CD2-CG2 3.98Å; F34-I118 HydrophobicContact CE1-CB 4.21Å; F34-I118 HydrophobicContact CE1-CD1 3.44Å; F34-I118 VanDerWaalsContact CE1-CD1 3.44Å; F34-I118 HydrophobicContact CE1-CG1 4.42Å; F34-I118 HydrophobicContact CE1-CG2 4.07Å; F34-I118 HydrophobicContact CE2-CG2 4.33Å; F34-I118 HydrophobicContact CG-CB 4.17Å; F34-I118 HydrophobicContact CG-CG2 3.66Å; F34-I118 HydrophobicContact CZ-CD1 4.08Å; F34-I118 HydrophobicContact CZ-CG2 4.38Å; F34-C120 HydrophobicContact CB-CB 3.91Å; F34-V159 HydrophobicContact CE2-CG1 4.17Å; F34-V159 HydrophobicContact CZ-CG1 4.31Å; F34-V159 HydrophobicContact CZ-CG2 4.02Å; F34-I186 HydrophobicContact CE1-CG2 4.03Å; F34-I186 HydrophobicContact CZ-CG2 4.48Å; F34-D188 HydrophobicContact CB-CB 4.43Å; F34-D188 HydrophobicContact CD1-CB 4.32Å; F34-D188 HydrophobicContact CD2-CB 3.62Å; F34-D188 HydrophobicContact CE1-CB 4.47Å; F34-D188 HydrophobicContact CE2-CB 3.82Å; F34-D188 HydrophobicContact CG-CB 3.88Å; F34-D188 HydrophobicContact CZ-CB 4.24Å; F34-D188 PolarHBondContact N-OD1 3.31Å
35	R	97	Very high	92.9	Very high	78 Å²	78	61.4 Å²	61.4	29%	0.294	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.6	-169.2	-62.7	-62.5	-176.4	140.8	6.3	113.1	E39 A43 I118 Q119 C120	R35-E39 WeakPolarHBondContact CA-OE1 3.3Å; R35-E39 WeakPolarHBondContact CD-OE1 3.34Å; R35-E39 VanDerWaalsContact CD-OE2 3.31Å; R35-E39 WeakPolarHBondContact CD-OE2 3.28Å; R35-E39 IonicContact CZ-OE2 2.87Å; R35-E39 IonicContact NE-OE2 2.77Å; R35-E39 IonicContact NH1-OE2 3.08Å; R35-E39 PolarHBondContact NH1-OE2 2.59Å; R35-A43 HydrophobicContact CB-CB 4.14Å; R35-A43 HydrophobicContact CG-CB 4.4Å; R35-I118 PolarHBondContact N-O 3.49Å; R35-Q119 CarbonylContact O-C 3.58Å; R35-Q119 VanDerWaalsContact O-CA 3.23Å; R35-Q119 WeakPolarHBondContact O-CA 3.44Å; R35-C120 PolarHBondContact O-N 3.44Å
36	Y	96.3	Very high	92.9	Very high	100 Å²	100	60.5 Å²	60.5	39%	0.392	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	147.1	173.8	-68.5	-69.3	0	0	0	110.9	C38 E39 C120 R122	Y36-C38 PolarHBondContact O-N 2.86Å; Y36-E39 PolarHBondContact N-OE1 2.62Å; Y36-E39 WeakPolarHBondContact O-CB 3.06Å; Y36-E39 PolarHBondContact O-N 2.57Å; Y36-C120 VanDerWaalsContact CD1-O 3.29Å; Y36-C120 WeakPolarHBondContact CD1-O 3.44Å; Y36-C120 HydrophobicContact CE1-CB 4.46Å; Y36-R122 HydrophobicContact CD1-CG 3.86Å; Y36-R122 HydrophobicContact CE1-CG 3.59Å
37	K	93.7	Very high	92.9	Very high	173 Å²	173	60.2 Å²	60.2	75%	0.752	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-51.7	-30	176	-171.6	170.3	-179.6	172.2	0	113.9	E39 Q119	K37-E39 VanDerWaalsContact C-N 3.33Å; K37-E39 PolarHBondContact O-N 3.05Å; K37-Q119 HydrophobicContact CB-CG 4.37Å
38	C	93.6	Very high	92.8	Very high	99 Å²	99	60.2 Å²	60.2	67%	0.669	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-79.6	-1.9	178	58	0	0	0	0	115.3	Y36 G40	Y36-C38 PolarHBondContact O-N 2.86Å; C38-G40 PolarHBondContact O-N 2.89Å
39	E	93.1	Very high	92.8	Very high	50 Å²	50	61 Å²	61	23%	0.234	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-76.2	-8.8	178.4	-69.1	-170.2	-123.9	0	0	114.1	R33 R35 Y36 K37 R41	R33-E39 IonicContact CZ-OE1 3.36Å; R33-E39 IonicContact CZ-OE2 2.68Å; R33-E39 IonicContact NH1-OE2 3.46Å; R33-E39 IonicContact NH2-OE1 2.7Å; R33-E39 PolarHBondContact NH2-OE1 2.84Å; R33-E39 IonicContact NH2-OE2 3.08Å; R33-E39 PolarHBondContact NH2-OE2 2.93Å; R35-E39 WeakPolarHBondContact CA-OE1 3.3Å; R35-E39 WeakPolarHBondContact CD-OE1 3.34Å; R35-E39 VanDerWaalsContact CD-OE2 3.31Å; R35-E39 WeakPolarHBondContact CD-OE2 3.28Å; R35-E39 IonicContact CZ-OE2 2.87Å; R35-E39 IonicContact NE-OE2 2.77Å; R35-E39 IonicContact NH1-OE2 3.08Å; R35-E39 PolarHBondContact NH1-OE2 2.59Å; Y36-E39 PolarHBondContact N-OE1 2.62Å; Y36-E39 WeakPolarHBondContact O-CB 3.06Å; Y36-E39 PolarHBondContact O-N 2.57Å; K37-E39 VanDerWaalsContact C-N 3.33Å; K37-E39 PolarHBondContact O-N 3.05Å; E39-R41 PolarHBondContact O-N 3.03Å
40	G	79.3	Confident	92.8	Very high	78 Å²	78	65.2 Å²	65.2	80%	0.804	35%	0.347	S	S	*	.			trans	64.1	11.4	170	0	0	0	0	0	115.9	C38	C38-G40 PolarHBondContact O-N 2.89Å
41	R	77.6	Confident	92.8	Very high	212 Å²	212	66.1 Å²	66.1	80%	0.8	36%	0.355	S	S	*	.	S	Bend	trans	-127.4	163.4	-177.7	-65.4	177.4	-174.8	-104.2	-0.9	109.9	E39 A43	E39-R41 PolarHBondContact O-N 3.03Å; R41-A43 PolarHBondContact O-N 2.99Å
42	S	85.4	Confident	92.8	Very high	100 Å²	100	67.7 Å²	67.7	70%	0.699	36%	0.363	S	S	*	.			trans	-49.2	139.7	166.8	170.4	0	0	0	0	110.6	G44	S42-G44 PolarHBondContact O-N 3.1Å; S42-G44 PolarHBondContact OG-N 3.01Å
43	A	87	Confident	92.6	Very high	8 Å²	8	73.6 Å²	73.6	7%	0.066	40%	0.395	C	S	.	.			trans	-72.3	9.5	178.7	0	0	0	0	0	113.8	R35 R41 V91	R35-A43 HydrophobicContact CB-CB 4.14Å; R35-A43 HydrophobicContact CG-CB 4.4Å; R41-A43 PolarHBondContact O-N 2.99Å; A43-V91 HydrophobicContact CB-CG2 3.49Å; A43-V91 VanDerWaalsContact CB-CG2 3.49Å
44	G	90.5	Very high	92.5	Very high	34 Å²	34	78.3 Å²	78.3	35%	0.351	43%	0.425	S	S	.	.			trans	90.2	-152.8	-179.7	0	0	0	0	0	112.2	S42	S42-G44 PolarHBondContact O-N 3.1Å; S42-G44 PolarHBondContact OG-N 3.01Å
45	S	94.9	Very high	92.4	Very high	43 Å²	43	83.2 Å²	83.2	30%	0.301	45%	0.451	S	S	.	.			trans	-146.2	134.7	170	-62.5	0	0	0	0	108.7	P47 L116	S45-P47 WeakPolarHBondContact O-CD 3.45Å; S45-L116 CarbonylContact C-O 3.58Å; S45-L116 WeakPolarHBondContact CA-O 3.28Å
46	I	97.4	Very high	92.3	Very high	0 Å²	0	87.3 Å²	87.3	0%	0	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-63.6	119.6	170.6	-58.8	158.8	0	0	0	107	P27 M32 P59 L90 L116 I118 L161 I186	P27-I46 HydrophobicContact CB-CG2 3.53Å; M32-I46 HydrophobicContact CE-CG1 3.67Å; M32-I46 HydrophobicContact SD-CB 4.11Å; M32-I46 HydrophobicContact SD-CG1 3.49Å; M32-I46 WeakPolarHBondContact SD-CG1 3.5Å; M32-I46 HydrophobicContact SD-CG2 4.49Å; I46-P59 HydrophobicContact CB-CG 4.04Å; I46-P59 HydrophobicContact CG2-CG 3.48Å; I46-P59 VanDerWaalsContact CG2-CG 3.48Å; I46-P59 WeakPolarHBondContact O-CD 3.11Å; I46-L90 HydrophobicContact CD1-CD1 4.17Å; I46-L116 HydrophobicContact CD1-CB 3.94Å; I46-L116 HydrophobicContact CD1-CD1 4.49Å; I46-L116 WeakPolarHBondContact CG1-O 3.42Å; I46-L116 PolarHBondContact N-O 3.41Å; I46-I118 HydrophobicContact CD1-CD1 4.21Å; I46-I118 HydrophobicContact CD1-CG1 4.3Å; I46-I118 HydrophobicContact CG1-CD1 4.22Å; I46-I118 HydrophobicContact CG1-CG1 4.47Å; I46-L161 HydrophobicContact CD1-CD1 4.21Å; I46-L161 HydrophobicContact CD1-CD2 4.01Å; I46-I186 HydrophobicContact CD1-CD1 3.98Å; I46-I186 HydrophobicContact CG1-CD1 4.18Å; I46-I186 HydrophobicContact CG2-CD1 3.74Å
47	P	97.4	Very high	92.3	Very high	33 Å²	33	83.8 Å²	83.8	21%	0.214	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-75.9	154.3	173.9	-0.3	16.7	0	0	0	110.4	P27 K28 S45	P27-P47 WeakPolarHBondContact CA-O 3.2Å; K28-P47 HydrophobicContact CB-CB 4.2Å; K28-P47 HydrophobicContact CB-CG 4.23Å; K28-P47 PolarHBondContact N-O 3.19Å; S45-P47 WeakPolarHBondContact O-CD 3.45Å
48	G	97.8	Very high	92.5	Very high	0 Å²	0	78 Å²	78	0%	0	43%	0.429	C	S	.	.	B	Isolated β-bridge	trans	-68.2	155.2	162.6	0	0	0	0	0	111.4	E25 Q26 K50 S51 T57	E25-G48 VanDerWaalsContact OE1-C 3.24Å; E25-G48 VanDerWaalsContact OE1-CA 3.27Å; E25-G48 WeakPolarHBondContact OE1-CA 3.33Å; Q26-G48 CarbonylContact O-C 3.58Å; Q26-G48 WeakPolarHBondContact O-CA 3.31Å; G48-K50 PolarHBondContact O-N 2.8Å; G48-S51 WeakPolarHBondContact O-CB 3.37Å; G48-S51 PolarHBondContact O-N 3.08Å; G48-T57 PolarHBondContact N-O 2.77Å
49	E	96.8	Very high	92.7	Very high	88 Å²	88	73.4 Å²	73.4	41%	0.411	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-27.1	179.8	-174.6	172.1	-110.4	0	0	113	E25 Q26 N184	E25-E49 PolarHBondContact OE1-N 3.08Å; Q26-E49 HydrophobicContact CB-CB 4.05Å; Q26-E49 WeakPolarHBondContact O-CB 3.29Å; Q26-E49 PolarHBondContact O-N 2.91Å; E49-N184 PolarHBondContact OE1-ND2 2.81Å
50	K	95.1	Very high	92.9	Very high	153 Å²	153	71.5 Å²	71.5	67%	0.665	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	9.1	177.5	-59.5	168.9	-175.2	166.6	0	112.7	E25 G48	E25-K50 WeakPolarHBondContact OE1-CB 3.43Å; E25-K50 PolarHBondContact OE1-N 2.85Å; G48-K50 PolarHBondContact O-N 2.8Å
51	S	95.9	Very high	93.7	Very high	32 Å²	32	67.8 Å²	67.8	22%	0.224	35%	0.352	C	S	.	.			trans	-71.6	131.2	-176.1	-175.3	0	0	0	0	111.4	G48 R56 T57	G48-S51 WeakPolarHBondContact O-CB 3.37Å; G48-S51 PolarHBondContact O-N 3.08Å; S51-R56 WeakPolarHBondContact OG-CA 3.19Å; S51-T57 WeakPolarHBondContact CA-OG1 3.35Å; S51-T57 WeakPolarHBondContact CB-OG1 3.17Å; S51-T57 PolarHBondContact N-OG1 2.75Å; S51-T57 PolarHBondContact OG-N 3.03Å
52	S	93.3	Very high	94.6	Very high	59 Å²	59	60.2 Å²	60.2	41%	0.413	33%	0.325	S	S	.	.			trans	-119	170.8	173.3	61.3	0	0	0	0	110.6	N54 N55 R56	S52-N54 VanDerWaalsContact C-N 3.31Å; S52-N54 PolarHBondContact O-N 2.83Å; S52-N55 PolarHBondContact N-O 3.06Å; S52-N55 CarbonylContact O-C 3.55Å; S52-N55 PolarHBondContact OG-N 3.22Å; S52-N55 PolarHBondContact OG-O 2.86Å; S52-N55 VanDerWaalsContact OG-O 3.06Å; S52-R56 WeakPolarHBondContact O-CG 3.4Å
53	D	89.9	Confident	94.9	Very high	138 Å²	138	55.8 Å²	55.8	74%	0.738	29%	0.294	S	S	*	.	S	Bend	trans	-64.2	-36.6	175.4	-77.7	-53.7	0	0	0	112.7
54	N	93.2	Very high	95.2	Very high	165 Å²	165	57.7 Å²	57.7	88%	0.882	30%	0.303	S	S	*	.	S	Bend	trans	-79.7	-36.8	179	-67.7	73.4	0	0	0	113.4	S52	S52-N54 VanDerWaalsContact C-N 3.31Å; S52-N54 PolarHBondContact O-N 2.83Å
55	N	94.6	Very high	95.1	Very high	104 Å²	104	60.5 Å²	60.5	56%	0.556	31%	0.31	S	S	*	.	S	Bend	trans	-127.5	98.9	179	-178.7	35.3	0	0	0	109.6	S52	S52-N55 PolarHBondContact N-O 3.06Å; S52-N55 CarbonylContact O-C 3.55Å; S52-N55 PolarHBondContact OG-N 3.22Å; S52-N55 PolarHBondContact OG-O 2.86Å; S52-N55 VanDerWaalsContact OG-O 3.06Å
56	R	95	Very high	94.8	Very high	164 Å²	164	60.9 Å²	60.9	62%	0.619	31%	0.305	S	S	*	.			trans	-86.9	115.1	-177.6	-69.3	-178.7	179.8	174.3	-0.7	111	S51 S52	S51-R56 WeakPolarHBondContact OG-CA 3.19Å; S52-R56 WeakPolarHBondContact O-CG 3.4Å
57	T	96.9	Very high	94.3	Very high	26 Å²	26	65.4 Å²	65.4	16%	0.16	34%	0.335	C	S	.	.			trans	-107.5	171	173.8	63.4	0	0	0	0	110.3	E25 G48 S51	E25-T57 WeakPolarHBondContact OE1-CB 3.37Å; E25-T57 PolarHBondContact OE1-OG1 3.4Å; E25-T57 VanDerWaalsContact OE2-CB 3.25Å; E25-T57 WeakPolarHBondContact OE2-CB 3.49Å; E25-T57 PolarHBondContact OE2-OG1 3.27Å; G48-T57 PolarHBondContact N-O 2.77Å; S51-T57 WeakPolarHBondContact CA-OG1 3.35Å; S51-T57 WeakPolarHBondContact CB-OG1 3.17Å; S51-T57 PolarHBondContact N-OG1 2.75Å; S51-T57 PolarHBondContact OG-N 3.03Å
58	Y	97.6	Very high	93.9	Very high	53 Å²	53	64.6 Å²	64.6	21%	0.208	33%	0.333	C	S	.	.			trans	-140.1	154.2	-171.5	-63.2	-84.3	0	0	0	110.3	S60 Q114	Y58-S60 PolarHBondContact O-N 2.79Å; Y58-S60 PolarHBondContact O-OG 3.32Å; Y58-Q114 HydrophobicContact CD1-CB 4.37Å; Y58-Q114 HydrophobicContact CD1-CG 4.36Å; Y58-Q114 HydrophobicContact CD2-CG 3.74Å; Y58-Q114 HydrophobicContact CE1-CB 4.48Å; Y58-Q114 HydrophobicContact CE2-CG 4.08Å; Y58-Q114 HydrophobicContact CG-CB 4.38Å; Y58-Q114 HydrophobicContact CG-CG 3.89Å
59	P	97.9	Very high	93.6	Very high	2 Å²	2	69.8 Å²	69.8	1%	0.013	36%	0.356	C	S	.	.			trans	-53	129.4	173.3	-19.2	29.7	0	0	0	109.2	E25 P27 I46 F113 L161	E25-P59 WeakPolarHBondContact O-CA 3.38Å; P27-P59 HydrophobicContact CB-CB 4.33Å; P27-P59 HydrophobicContact CB-CG 3.85Å; I46-P59 HydrophobicContact CB-CG 4.04Å; I46-P59 HydrophobicContact CG2-CG 3.48Å; I46-P59 VanDerWaalsContact CG2-CG 3.48Å; I46-P59 WeakPolarHBondContact O-CD 3.11Å; P59-F113 HydrophobicContact CB-CD2 4.33Å; P59-F113 WeakPolarHBondContact O-CD2 3.25Å; P59-F113 PolarHBondContact O-N 2.98Å; P59-L161 HydrophobicContact CB-CD1 4.27Å; P59-L161 HydrophobicContact CG-CD1 4.46Å
60	S	97.3	Very high	93.5	Very high	10 Å²	10	65.6 Å²	65.6	7%	0.07	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	136.8	-167.6	-65.3	0	0	0	0	111.9	F24 E25 Y58 I111 A112	F24-S60 WeakPolarHBondContact CB-O 3.4Å; F24-S60 PolarHBondContact N-O 3.15Å; E25-S60 PolarHBondContact N-O 2.65Å; E25-S60 VanDerWaalsContact N-O 3.11Å; E25-S60 PolarHBondContact O-N 3.16Å; Y58-S60 PolarHBondContact O-N 2.79Å; Y58-S60 PolarHBondContact O-OG 3.32Å; S60-I111 CarbonylContact C-O 3.48Å; S60-I111 WeakPolarHBondContact CA-O 3.26Å; S60-A112 WeakPolarHBondContact OG-CA 2.79Å; S60-A112 WeakPolarHBondContact OG-CB 3.32Å
61	L	96.6	Very high	93.5	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	139	176.3	-170.7	75.2	0	0	0	110.1	V21 I63 V72 V110 I111 F113 I163 V165 I181	V21-L61 HydrophobicContact CB-CD1 4.23Å; V21-L61 HydrophobicContact CG1-CD2 4.21Å; L61-I63 HydrophobicContact CD2-CG1 4.37Å; L61-V72 HydrophobicContact CD2-CG2 4.18Å; L61-V110 CarbonylContact O-C 3.51Å; L61-V110 VanDerWaalsContact O-CA 3.28Å; L61-V110 WeakPolarHBondContact O-CA 3.42Å; L61-I111 PolarHBondContact N-O 2.84Å; L61-I111 PolarHBondContact O-N 3.32Å; L61-F113 HydrophobicContact CB-CE2 3.88Å; L61-F113 HydrophobicContact CB-CZ 3.8Å; L61-F113 HydrophobicContact CD2-CZ 4.49Å; L61-I163 HydrophobicContact CD1-CD1 4.18Å; L61-I163 HydrophobicContact CD1-CG2 4.03Å; L61-I163 HydrophobicContact CD2-CG2 3.89Å; L61-I163 HydrophobicContact CG-CG2 4.5Å; L61-V165 HydrophobicContact CD2-CG2 3.5Å; L61-I181 HydrophobicContact CD1-CD1 3.49Å; L61-I181 VanDerWaalsContact CD1-CD1 3.49Å; L61-I181 HydrophobicContact CD1-CG1 4.35Å
62	Q	95.2	Very high	93.5	Very high	52 Å²	52	58.4 Å²	58.4	24%	0.243	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	137.7	163.8	-177.7	170.3	-4.4	0	0	110.2	Q22 F24 L64 R109 V110	Q22-Q62 PolarHBondContact N-O 2.83Å; Q22-Q62 PolarHBondContact O-N 2.81Å; F24-Q62 HydrophobicContact CB-CB 4.1Å; F24-Q62 HydrophobicContact CD2-CB 4.38Å; Q62-L64 HydrophobicContact CG-CD2 3.89Å; Q62-R109 WeakPolarHBondContact CA-O 3.33Å; Q62-V110 HydrophobicContact CB-CG2 4.23Å; Q62-V110 HydrophobicContact CG-CG2 4.16Å
63	I	93.3	Very high	93.6	Very high	7 Å²	7	58.6 Å²	58.6	4%	0.036	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	130	172	-50.7	-178.9	0	0	0	107.9	V21 L61 F104 R109 I111 V165	V21-I63 HydrophobicContact CG1-CG1 4.26Å; L61-I63 HydrophobicContact CD2-CG1 4.37Å; I63-F104 HydrophobicContact CD1-CD1 4.35Å; I63-F104 HydrophobicContact CD1-CD2 4.2Å; I63-F104 HydrophobicContact CD1-CE1 3.65Å; I63-F104 HydrophobicContact CD1-CE2 3.49Å; I63-F104 VanDerWaalsContact CD1-CE2 3.49Å; I63-F104 HydrophobicContact CD1-CZ 3.16Å; I63-R109 PolarHBondContact N-O 3.47Å; I63-I111 HydrophobicContact CD1-CD1 3.9Å; I63-V165 HydrophobicContact CD1-CG1 4.22Å
64	L	91.6	Very high	94	Very high	48 Å²	48	52 Å²	52	25%	0.251	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	150.2	-178.2	-57.9	178.3	0	0	0	109.9	P19 T20 Q22 Q62 Y66	P19-L64 WeakPolarHBondContact CA-O 3.36Å; T20-L64 PolarHBondContact N-O 2.87Å; T20-L64 VanDerWaalsContact N-O 3.14Å; T20-L64 PolarHBondContact O-N 2.86Å; Q22-L64 HydrophobicContact CB-CD1 4.34Å; Q62-L64 HydrophobicContact CG-CD2 3.89Å; L64-Y66 PolarHBondContact O-N 3.26Å; L64-Y66 VanDerWaalsContact O-N 3.1Å
65	N	90.4	Very high	94.2	Very high	94 Å²	94	44.9 Å²	44.9	50%	0.503	22%	0.218	S	C	.	.	S	Bend	trans	54.2	27.5	176	-41.5	-31.3	0	0	0	115.2	A17 E18	A17-N65 WeakPolarHBondContact O-CB 3.32Å; A17-N65 PolarHBondContact O-ND2 2.87Å; E18-N65 PolarHBondContact O-ND2 2.78Å
66	Y	88.4	Confident	94.4	Very high	51 Å²	51	40.2 Å²	40.2	20%	0.2	19%	0.193	C	C	.	.			trans	-139.3	141	176	-170.4	-108.2	0	0	0	111.4	P19 L64 G68 K69 F104 L167 Q168	P19-Y66 HydrophobicContact CG-CD2 4.29Å; L64-Y66 PolarHBondContact O-N 3.26Å; L64-Y66 VanDerWaalsContact O-N 3.1Å; Y66-G68 VanDerWaalsContact CE1-C 3.46Å; Y66-K69 WeakPolarHBondContact CE1-O 3.5Å; Y66-K69 PolarHBondContact OH-O 3.46Å; Y66-F104 HydrophobicContact CE1-CE2 4.5Å; Y66-L167 HydrophobicContact CD1-CD1 4.43Å; Y66-L167 HydrophobicContact CD1-CD2 3.75Å; Y66-L167 HydrophobicContact CD2-CD1 3.77Å; Y66-L167 HydrophobicContact CE1-CB 4.25Å; Y66-L167 HydrophobicContact CE1-CD2 3.76Å; Y66-L167 HydrophobicContact CE1-CG 4.4Å; Y66-L167 HydrophobicContact CE2-CB 4.09Å; Y66-L167 HydrophobicContact CE2-CD1 3.93Å; Y66-L167 HydrophobicContact CE2-CG 4.42Å; Y66-L167 HydrophobicContact CG-CD1 4.02Å; Y66-L167 HydrophobicContact CG-CD2 4.14Å; Y66-Q168 PolarHBondContact OH-N 2.89Å; Y66-Q168 PolarHBondContact OH-O 3.4Å
67	C	85.1	Confident	94.5	Very high	94 Å²	94	32.4 Å²	32.4	64%	0.635	16%	0.164	S	C	*	.			trans	-139.8	101	172.3	-169	0	0	0	0	107.3
68	G	89.2	Confident	94.6	Very high	17 Å²	17	31.7 Å²	31.7	18%	0.175	16%	0.16	C	C	.	.	S	Bend	trans	174.7	177	-170.4	0	0	0	0	0	111	Y66 P106	Y66-G68 VanDerWaalsContact CE1-C 3.46Å; G68-P106 WeakPolarHBondContact O-CA 3.35Å
69	K	92.9	Very high	94.5	Very high	108 Å²	108	32.6 Å²	32.6	47%	0.47	16%	0.164	S	C	.	.			trans	-78.6	155	174.5	-58.1	-179.5	-172.6	167.4	0	110.6	Y66 F104 Q168 Y174	Y66-K69 WeakPolarHBondContact CE1-O 3.5Å; Y66-K69 PolarHBondContact OH-O 3.46Å; K69-F104 VanDerWaalsContact CA-O 3.29Å; K69-F104 WeakPolarHBondContact CA-O 3.41Å; K69-Q168 HydrophobicContact CB-CB 4.26Å; K69-Q168 WeakPolarHBondContact O-CB 3.47Å; K69-Q168 PolarHBondContact O-N 2.85Å; K69-Y174 HydrophobicContact CB-CE1 4.37Å
70	G	93.9	Very high	94.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	-177.7	171	0	0	0	0	0	111.7	E103 F104 F166 Y174	G70-E103 CarbonylContact O-C 3.6Å; G70-E103 VanDerWaalsContact O-CA 3.28Å; G70-E103 WeakPolarHBondContact O-CA 3.34Å; G70-F104 VanDerWaalsContact C-CD1 3.46Å; G70-F104 PolarHBondContact N-O 2.95Å; G70-F104 VanDerWaalsContact N-O 3.1Å; G70-F104 VanDerWaalsContact O-CD1 3.28Å; G70-F104 WeakPolarHBondContact O-CD1 3.27Å; G70-F104 PolarHBondContact O-N 2.9Å; G70-F166 CarbonylContact C-O 3.54Å; G70-F166 VanDerWaalsContact CA-O 3.29Å; G70-F166 WeakPolarHBondContact CA-O 3.5Å; G70-Y174 VanDerWaalsContact CA-CE1 3.47Å
71	K	95.1	Very high	94	Very high	33 Å²	33	44 Å²	44	14%	0.143	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	130	-178	-169.5	168.1	63.5	159.9	0	110.1	E101 A102 E103 F166 Y174	K71-E101 HydrophobicContact CD-CG 3.78Å; K71-E101 WeakPolarHBondContact CD-OE2 3.3Å; K71-E101 WeakPolarHBondContact CE-OE2 3.28Å; K71-E101 HydrophobicContact CG-CG 3.91Å; K71-E101 IonicContact NZ-OE2 3.71Å; K71-E101 PolarHBondContact NZ-OE2 2.77Å; K71-A102 WeakPolarHBondContact CA-O 3.41Å; K71-E103 HydrophobicContact CB-CG 4.11Å; K71-E103 HydrophobicContact CD-CG 4Å; K71-E103 HydrophobicContact CG-CG 3.9Å; K71-F166 PolarHBondContact N-O 2.88Å; K71-F166 PolarHBondContact O-N 3.36Å; K71-Y174 HydrophobicContact CB-CD1 4.25Å; K71-Y174 HydrophobicContact CB-CD2 4.14Å; K71-Y174 HydrophobicContact CB-CE2 4.42Å; K71-Y174 HydrophobicContact CB-CG 4.04Å; K71-Y174 HydrophobicContact CD-CD2 4.19Å
72	V	95.8	Very high	93.8	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	139.5	176.8	60.6	0	0	0	0	109.7	L61 V74 Y100 E101 A102 I111 F113 I163 Q164 V165	L61-V72 HydrophobicContact CD2-CG2 4.18Å; V72-V74 HydrophobicContact CG2-CG2 4.45Å; V72-Y100 HydrophobicContact CG1-CE1 4.11Å; V72-E101 WeakPolarHBondContact O-CA 3.42Å; V72-A102 WeakPolarHBondContact CG1-O 3.19Å; V72-A102 PolarHBondContact N-O 3.47Å; V72-A102 PolarHBondContact O-N 3.03Å; V72-I111 HydrophobicContact CG1-CD1 4.33Å; V72-I111 HydrophobicContact CG1-CG2 4.32Å; V72-F113 HydrophobicContact CG1-CE1 4.08Å; V72-F113 HydrophobicContact CG2-CE1 3.84Å; V72-F113 HydrophobicContact CG2-CZ 3.88Å; V72-I163 HydrophobicContact CG2-CG2 3.78Å; V72-Q164 WeakPolarHBondContact CA-O 3.07Å; V72-V165 HydrophobicContact CB-CG2 4.25Å; V72-V165 HydrophobicContact CG2-CG2 4.03Å
73	R	96.5	Very high	93.8	Very high	63 Å²	63	45.8 Å²	45.8	24%	0.238	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	139.8	171.5	-65.1	-172.6	175.8	172.6	-11.7	110.2	Y75 Y100 E101 I163 Q164 F166	R73-Y75 HydrophobicContact CB-CE2 3.8Å; R73-Y75 WeakPolarHBondContact CD-OH 3.5Å; R73-Y100 CarbonylContact C-O 3.37Å; R73-Y100 WeakPolarHBondContact CA-O 3.31Å; R73-E101 HydrophobicContact CG-CB 4.25Å; R73-E101 HydrophobicContact CG-CG 4.02Å; R73-E101 IonicContact CZ-OE2 2.78Å; R73-E101 IonicContact NE-OE2 2.71Å; R73-E101 PolarHBondContact NE-OE2 2.85Å; R73-E101 IonicContact NH2-OE2 3.16Å; R73-E101 PolarHBondContact NH2-OE2 2.92Å; R73-I163 WeakPolarHBondContact O-CA 3.32Å; R73-Q164 PolarHBondContact N-O 2.87Å; R73-Q164 PolarHBondContact O-N 3.3Å; R73-F166 HydrophobicContact CB-CE2 4.43Å; R73-F166 HydrophobicContact CG-CD2 4.49Å; R73-F166 HydrophobicContact CG-CE2 4.06Å
74	V	97.9	Very high	93.9	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	123.9	174	-170.5	0	0	0	0	110	V72 L90 F99 Y100 F113 L161 C162 I163	V72-V74 HydrophobicContact CG2-CG2 4.45Å; V74-L90 HydrophobicContact CB-CD2 4.16Å; V74-L90 HydrophobicContact CG1-CD2 4.18Å; V74-L90 WeakPolarHBondContact O-CD2 3.44Å; V74-F99 WeakPolarHBondContact O-CA 3.25Å; V74-F99 WeakPolarHBondContact O-CB 3.4Å; V74-Y100 HydrophobicContact CB-CD1 4.39Å; V74-Y100 HydrophobicContact CG2-CD1 3.97Å; V74-Y100 PolarHBondContact N-O 2.94Å; V74-Y100 PolarHBondContact O-N 3.38Å; V74-F113 HydrophobicContact CG2-CD1 4Å; V74-F113 HydrophobicContact CG2-CE1 3.67Å; V74-F113 HydrophobicContact CG2-CE2 4.25Å; V74-F113 HydrophobicContact CG2-CG 4.42Å; V74-F113 HydrophobicContact CG2-CZ 3.82Å; V74-L161 HydrophobicContact CG1-CB 3.82Å; V74-L161 HydrophobicContact CG1-CD1 4.39Å; V74-L161 HydrophobicContact CG1-CD2 4.36Å; V74-L161 HydrophobicContact CG1-CG 4.41Å; V74-C162 WeakPolarHBondContact CA-O 3.4Å; V74-I163 HydrophobicContact CG1-CG1 4.21Å; V74-I163 HydrophobicContact CG2-CG1 4.18Å; V74-I163 HydrophobicContact CG2-CG2 4.29Å
75	Y	97.7	Very high	94.2	Very high	16 Å²	16	43.8 Å²	43.8	6%	0.063	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	154.4	-178.1	-57.8	-79.2	0	0	0	110.5	R73 F99 I138 P140 L161 C162 Q164	R73-Y75 HydrophobicContact CB-CE2 3.8Å; R73-Y75 WeakPolarHBondContact CD-OH 3.5Å; Y75-F99 HydrophobicContact CD1-CB 3.48Å; Y75-F99 VanDerWaalsContact CD1-CB 3.48Å; Y75-F99 HydrophobicContact CD1-CD2 4.36Å; Y75-F99 AromaticContact CD1-CG 3.97Å; Y75-F99 HydrophobicContact CD1-CG 3.97Å; Y75-F99 HydrophobicContact CE1-CB 3.76Å; Y75-F99 HydrophobicContact CE1-CD1 4.26Å; Y75-F99 AromaticContact CE1-CD2 3.78Å; Y75-F99 HydrophobicContact CE1-CD2 3.78Å; Y75-F99 HydrophobicContact CE1-CE2 4.42Å; Y75-F99 AromaticContact CE1-CG 3.69Å; Y75-F99 HydrophobicContact CE1-CG 3.69Å; Y75-F99 HydrophobicContact CG-CB 4.39Å; Y75-I138 HydrophobicContact CD1-CG2 3.54Å; Y75-I138 HydrophobicContact CE1-CG1 4.43Å; Y75-I138 HydrophobicContact CE1-CG2 3.74Å; Y75-P140 HydrophobicContact CD2-CB 4.23Å; Y75-P140 HydrophobicContact CD2-CG 4.43Å; Y75-L161 CarbonylContact O-C 3.47Å; Y75-L161 WeakPolarHBondContact O-CA 3.48Å; Y75-C162 PolarHBondContact N-O 2.96Å; Y75-C162 PolarHBondContact O-N 3Å; Y75-Q164 HydrophobicContact CE2-CB 4.49Å; Y75-Q164 HydrophobicContact CE2-CG 4.27Å
76	L	98.3	Very high	94.6	Very high	6 Å²	6	39.4 Å²	39.4	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	133.2	166.1	-61.3	-175.7	0	0	0	110.3	H86 H88 L90 I118 V159 L161	L76-H86 HydrophobicContact CB-CB 3.77Å; L76-H86 PolarHBondContact O-N 3.11Å; L76-H88 HydrophobicContact CD1-CB 4.01Å; L76-L90 HydrophobicContact CD1-CB 4.4Å; L76-L90 HydrophobicContact CD2-CD1 4.12Å; L76-L90 HydrophobicContact CG-CB 4.19Å; L76-I118 HydrophobicContact CD1-CG1 4.34Å; L76-I118 HydrophobicContact CD1-CG2 4.09Å; L76-V159 HydrophobicContact CD1-CG1 4.49Å; L76-V159 HydrophobicContact CD2-CB 4.34Å; L76-V159 HydrophobicContact CD2-CG2 3.98Å; L76-L161 HydrophobicContact CD2-CD2 3.47Å; L76-L161 VanDerWaalsContact CD2-CD2 3.47Å
77	V	98	Very high	95	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	166.8	175.4	-60.7	0	0	0	0	112.3	Y83 R84 P140 F141 R160 C162 V182	V77-Y83 HydrophobicContact CG2-CD1 4.31Å; V77-Y83 HydrophobicContact CG2-CG 4.49Å; V77-R84 CarbonylContact C-O 3.57Å; V77-R84 WeakPolarHBondContact CA-O 3.34Å; V77-R84 WeakPolarHBondContact CB-O 3.49Å; V77-P140 HydrophobicContact CG1-CG 3.89Å; V77-F141 HydrophobicContact CG1-CE2 4.49Å; V77-R160 HydrophobicContact CG2-CB 3.98Å; V77-R160 PolarHBondContact N-O 3.19Å; V77-R160 PolarHBondContact O-N 3.14Å; V77-C162 HydrophobicContact CB-CB 4.45Å; V77-C162 HydrophobicContact CG1-CB 3.67Å; V77-C162 HydrophobicContact CG2-CB 3.89Å; V77-V182 HydrophobicContact CG2-CG1 4Å
78	T	97.8	Very high	95.6	Very high	11 Å²	11	32.6 Å²	32.6	7%	0.067	16%	0.158	C	C	.	.			trans	-62.2	157.4	176.9	50.4	0	0	0	0	113.5	N80 Y83 R84 Y154	T78-N80 PolarHBondContact OG1-O 2.94Å; T78-N80 VanDerWaalsContact OG1-O 3.12Å; T78-Y83 WeakPolarHBondContact O-CD1 3.34Å; T78-R84 HydrophobicContact CG2-CB 3.97Å; T78-R84 PolarHBondContact N-O 3.43Å; T78-R84 PolarHBondContact OG1-N 3.22Å; T78-Y154 HydrophobicContact CG2-CD1 3.82Å; T78-Y154 HydrophobicContact CG2-CE1 3.94Å
79	K	96.1	Very high	96	Very high	71 Å²	71	33.6 Å²	33.6	31%	0.309	16%	0.159	S	C	.	.	S	Bend	trans	-64	-36.9	176.1	178.3	-176.1	168.7	168.2	0	113.3	V158 R160 P185 Y187	K79-V158 HydrophobicContact CB-CG1 3.73Å; K79-V158 HydrophobicContact CB-CG2 4.04Å; K79-V158 HydrophobicContact CD-CG1 4.08Å; K79-V158 HydrophobicContact CD-CG2 4.1Å; K79-V158 HydrophobicContact CG-CG1 4.45Å; K79-V158 HydrophobicContact CG-CG2 4.26Å; K79-R160 PolarHBondContact O-NE 3.17Å; K79-R160 PolarHBondContact O-NH2 2.77Å; K79-P185 HydrophobicContact CG-CB 4.35Å; K79-Y187 HydrophobicContact CD-CE1 4.45Å; K79-Y187 WeakPolarHBondContact CE-OH 3.42Å; K79-Y187 PolarHBondContact NZ-OH 3.01Å
80	N	93.6	Very high	96.2	Very high	109 Å²	109	28.5 Å²	28.5	58%	0.583	14%	0.137	S	C	*	.	S	Bend	trans	-107.3	159.2	-172.2	-60	-3.8	0	0	0	111.1	T78 P82	T78-N80 PolarHBondContact OG1-O 2.94Å; T78-N80 VanDerWaalsContact OG1-O 3.12Å; N80-P82 CarbonylContact O-C 3.36Å
81	E	90.8	Very high	96.3	Very high	142 Å²	142	30.2 Å²	30.2	66%	0.664	15%	0.148	S	C	*	.	S	Bend	trans	-80.4	146.8	171.4	-72.9	178.2	-159.3	0	0	111.6	Y83	E81-Y83 HydrophobicContact CG-CD1 4.26Å; E81-Y83 HydrophobicContact CG-CD2 3.8Å; E81-Y83 HydrophobicContact CG-CE1 3.82Å; E81-Y83 HydrophobicContact CG-CE2 3.28Å; E81-Y83 HydrophobicContact CG-CG 4.23Å; E81-Y83 WeakPolarHBondContact CG-OH 3.4Å; E81-Y83 WeakPolarHBondContact OE1-CE2 3.43Å; E81-Y83 PolarHBondContact OE1-OH 2.84Å
82	P	91.4	Very high	96.3	Very high	55 Å²	55	30.7 Å²	30.7	36%	0.357	16%	0.162	S	C	.	.	S	Bend	cis	-69.8	137	-6.2	29.6	-34.2	0	0	0	111.7	N80 R84 V143	N80-P82 CarbonylContact O-C 3.36Å; P82-R84 PolarHBondContact O-N 3.14Å; P82-V143 HydrophobicContact CB-CG2 4.22Å; P82-V143 HydrophobicContact CG-CG1 4.42Å
83	Y	95.9	Very high	96.2	Very high	36 Å²	36	36.5 Å²	36.5	14%	0.141	19%	0.187	C	C	.	.			trans	-68.5	96.4	-175.1	-63.4	-62.1	0	0	0	111.7	V77 T78 E81 F141 V182	V77-Y83 HydrophobicContact CG2-CD1 4.31Å; V77-Y83 HydrophobicContact CG2-CG 4.49Å; T78-Y83 WeakPolarHBondContact O-CD1 3.34Å; E81-Y83 HydrophobicContact CG-CD1 4.26Å; E81-Y83 HydrophobicContact CG-CD2 3.8Å; E81-Y83 HydrophobicContact CG-CE1 3.82Å; E81-Y83 HydrophobicContact CG-CE2 3.28Å; E81-Y83 HydrophobicContact CG-CG 4.23Å; E81-Y83 WeakPolarHBondContact CG-OH 3.4Å; E81-Y83 WeakPolarHBondContact OE1-CE2 3.43Å; E81-Y83 PolarHBondContact OE1-OH 2.84Å; Y83-F141 VanDerWaalsContact CB-CD2 3.45Å; Y83-F141 HydrophobicContact CD2-CD2 4.41Å; Y83-F141 HydrophobicContact CD2-CE1 4.16Å; Y83-F141 AromaticContact CD2-CE2 3.98Å; Y83-F141 HydrophobicContact CD2-CE2 3.98Å; Y83-F141 AromaticContact CD2-CZ 3.86Å; Y83-F141 HydrophobicContact CD2-CZ 3.86Å; Y83-F141 HydrophobicContact CG-CD2 4.38Å; Y83-F141 HydrophobicContact CG-CE2 4.07Å; Y83-F141 HydrophobicContact CG-CZ 4.41Å; Y83-F141 WeakPolarHBondContact O-CD2 3.5Å; Y83-V182 HydrophobicContact CD1-CG1 4.43Å; Y83-V182 HydrophobicContact CD2-CG2 3.98Å; Y83-V182 HydrophobicContact CE1-CG1 4.25Å; Y83-V182 HydrophobicContact CE2-CG2 3.99Å; Y83-V182 HydrophobicContact CG-CG2 4.39Å
84	R	96.3	Very high	96.2	Very high	11 Å²	11	36.8 Å²	36.8	4%	0.042	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-83.2	146.6	177.8	-71	176.5	-79.1	-162.2	-9.9	111.1	V77 T78 P82 H86 V143 Q147 L148 E153 Y154	V77-R84 CarbonylContact C-O 3.57Å; V77-R84 WeakPolarHBondContact CA-O 3.34Å; V77-R84 WeakPolarHBondContact CB-O 3.49Å; T78-R84 HydrophobicContact CG2-CB 3.97Å; T78-R84 PolarHBondContact N-O 3.43Å; T78-R84 PolarHBondContact OG1-N 3.22Å; P82-R84 PolarHBondContact O-N 3.14Å; R84-H86 PolarHBondContact O-N 2.81Å; R84-V143 HydrophobicContact CG-CB 4.29Å; R84-V143 HydrophobicContact CG-CG1 3.87Å; R84-V143 HydrophobicContact CG-CG2 4.24Å; R84-Q147 WeakPolarHBondContact CD-O 3.19Å; R84-Q147 PolarHBondContact NH1-O 2.78Å; R84-L148 HydrophobicContact CB-CD2 3.84Å; R84-L148 HydrophobicContact CG-CD2 3.61Å; R84-E153 IonicContact CZ-OE1 2.81Å; R84-E153 IonicContact CZ-OE2 3.14Å; R84-E153 VanDerWaalsContact CZ-OE2 3.24Å; R84-E153 IonicContact NH1-OE2 2.7Å; R84-E153 PolarHBondContact NH1-OE2 3.02Å; R84-E153 IonicContact NH2-OE1 3.25Å; R84-E153 PolarHBondContact NH2-OE1 3.49Å; R84-E153 IonicContact NH2-OE2 2.78Å; R84-E153 PolarHBondContact NH2-OE2 2.8Å; R84-Y154 HydrophobicContact CB-CE1 4.08Å
85	P	97.1	Very high	96.1	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.013	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-51	129.5	167.4	-24.1	33.1	0	0	0	111.4	I130 R133 I138 N139 Y154	P85-I130 VanDerWaalsContact O-CD1 3.27Å; P85-I130 WeakPolarHBondContact O-CD1 3.47Å; P85-R133 HydrophobicContact CB-CB 4.13Å; P85-R133 HydrophobicContact CB-CG 4.08Å; P85-I138 WeakPolarHBondContact CG-O 3.48Å; P85-N139 HydrophobicContact CG-CB 4.44Å; P85-Y154 WeakPolarHBondContact O-CE1 3.32Å
86	H	98.1	Very high	95.9	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.009	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-81	145.4	-179.9	-157.2	-89.6	0	0	0	111.3	L76 R84 H88 R133 D155 L156 V158 V159	L76-H86 HydrophobicContact CB-CB 3.77Å; L76-H86 PolarHBondContact O-N 3.11Å; R84-H86 PolarHBondContact O-N 2.81Å; H86-H88 VanDerWaalsContact C-N 3.31Å; H86-H88 AromaticContact CE1-CD2 2.67Å; H86-H88 PolarHBondContact CE1-CD2 2.88Å; H86-H88 AromaticContact CE1-CE1 3.04Å; H86-H88 PolarHBondContact CE1-CE1 3.06Å; H86-H88 AromaticContact CE1-CG 2.97Å; H86-H88 AromaticContact CE1-ND1 3.22Å; H86-H88 PolarHBondContact CE1-ND1 2.99Å; H86-H88 AromaticContact CE1-NE2 2.71Å; H86-H88 PolarHBondContact CE1-NE2 3.05Å; H86-H88 WeakPolarHBondContact ND1-CB 3.45Å; H86-H88 AromaticContact ND1-CD2 3.65Å; H86-H88 AromaticContact ND1-CG 3.42Å; H86-H88 PolarHBondContact ND1-N 2.88Å; H86-H88 VanDerWaalsContact ND1-N 3.14Å; H86-H88 PolarHBondContact O-N 2.8Å; H86-R133 PolarHBondContact O-NE 2.95Å; H86-R133 VanDerWaalsContact O-NE 3.11Å; H86-D155 PolarHBondContact NE2-O 2.87Å; H86-L156 VanDerWaalsContact CE1-CA 3.49Å; H86-L156 WeakPolarHBondContact CE1-CA 3.19Å; H86-V158 PolarHBondContact NE2-O 3.03Å; H86-V159 HydrophobicContact CB-CG1 4.49Å
87	P	97.8	Very high	95.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.239	C	C	.	.	S	Bend	trans	-71.3	-19.1	177.1	30.2	-38.8	0	0	0	114.1	V121 V126 A129 I130 Y154 L156	P87-V121 HydrophobicContact CB-CG2 3.91Å; P87-V121 HydrophobicContact CG-CG2 4.42Å; P87-V121 WeakPolarHBondContact O-CG1 3.21Å; P87-V126 HydrophobicContact CB-CB 4.43Å; P87-V126 HydrophobicContact CB-CG1 4.06Å; P87-V126 HydrophobicContact CB-CG2 4.38Å; P87-V126 HydrophobicContact CG-CG1 4.06Å; P87-V126 HydrophobicContact CG-CG2 4.3Å; P87-A129 HydrophobicContact CB-CB 3.85Å; P87-A129 WeakPolarHBondContact O-CB 3.42Å; P87-I130 HydrophobicContact CB-CD1 4Å; P87-I130 HydrophobicContact CB-CG1 4.26Å; P87-Y154 HydrophobicContact CG-CD1 4.39Å; P87-L156 HydrophobicContact CG-CD2 3.66Å
88	H	98.1	Very high	95.4	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.243	C	C	.	.	S	Bend	trans	-71.3	151.5	172.4	-65.1	-12.9	0	0	0	111.4	F34 L76 H86 I118 Q119 C120 V121 R133 L156	F34-H88 AromaticContact CD2-CD2 3.72Å; F34-H88 AromaticContact CD2-NE2 3.84Å; F34-H88 AromaticContact CE2-CD2 3.99Å; L76-H88 HydrophobicContact CD1-CB 4.01Å; H86-H88 VanDerWaalsContact C-N 3.31Å; H86-H88 AromaticContact CE1-CD2 2.67Å; H86-H88 PolarHBondContact CE1-CD2 2.88Å; H86-H88 AromaticContact CE1-CE1 3.04Å; H86-H88 PolarHBondContact CE1-CE1 3.06Å; H86-H88 AromaticContact CE1-CG 2.97Å; H86-H88 AromaticContact CE1-ND1 3.22Å; H86-H88 PolarHBondContact CE1-ND1 2.99Å; H86-H88 AromaticContact CE1-NE2 2.71Å; H86-H88 PolarHBondContact CE1-NE2 3.05Å; H86-H88 WeakPolarHBondContact ND1-CB 3.45Å; H86-H88 AromaticContact ND1-CD2 3.65Å; H86-H88 AromaticContact ND1-CG 3.42Å; H86-H88 PolarHBondContact ND1-N 2.88Å; H86-H88 VanDerWaalsContact ND1-N 3.14Å; H86-H88 PolarHBondContact O-N 2.8Å; H88-I118 HydrophobicContact CB-CG2 4.21Å; H88-Q119 WeakPolarHBondContact CB-O 3.41Å; H88-C120 VanDerWaalsContact CE1-CB 3.43Å; H88-C120 WeakPolarHBondContact CE1-CB 3.4Å; H88-C120 WeakPolarHBondContact ND1-CA 3.43Å; H88-V121 PolarHBondContact ND1-N 3.47Å; H88-V121 VanDerWaalsContact ND1-N 3.16Å; H88-R133 VanDerWaalsContact C-NH2 3.35Å; H88-R133 PolarHBondContact O-NH2 2.83Å; H88-L156 PolarHBondContact NE2-O 3.29Å
89	D	97.4	Very high	95.3	Very high	38 Å²	38	46.6 Å²	46.6	20%	0.203	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	136.6	177.5	-75.7	-42.4	0	0	0	111.8	V91 G98 Q119 R133	D89-V91 HydrophobicContact CB-CG1 4.02Å; D89-G98 WeakPolarHBondContact OD1-CA 3.5Å; D89-Q119 HydrophobicContact CB-CB 4.27Å; D89-Q119 PolarHBondContact N-O 3.38Å; D89-Q119 PolarHBondContact O-N 3.07Å; D89-R133 IonicContact OD1-CZ 2.75Å; D89-R133 IonicContact OD1-NH1 2.65Å; D89-R133 PolarHBondContact OD1-NH1 2.71Å; D89-R133 IonicContact OD1-NH2 2.79Å; D89-R133 PolarHBondContact OD1-NH2 2.7Å
90	L	97.4	Very high	95.4	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	124.3	161.1	-164.7	65.5	0	0	0	108.8	I46 V74 L76 G98 L116 I118	I46-L90 HydrophobicContact CD1-CD1 4.17Å; V74-L90 HydrophobicContact CB-CD2 4.16Å; V74-L90 HydrophobicContact CG1-CD2 4.18Å; V74-L90 WeakPolarHBondContact O-CD2 3.44Å; L76-L90 HydrophobicContact CD1-CB 4.4Å; L76-L90 HydrophobicContact CD2-CD1 4.12Å; L76-L90 HydrophobicContact CG-CB 4.19Å; L90-G98 VanDerWaalsContact CB-O 3.31Å; L90-G98 WeakPolarHBondContact CB-O 3.13Å; L90-G98 PolarHBondContact N-O 2.81Å; L90-G98 CarbonylContact O-C 3.6Å; L90-L116 HydrophobicContact CD1-CB 4.17Å; L90-L116 HydrophobicContact CD1-CD1 4.24Å; L90-L116 HydrophobicContact CD1-CD2 4.47Å; L90-L116 HydrophobicContact CD2-CD1 4.04Å; L90-L116 HydrophobicContact CD2-CD2 4.15Å; L90-L116 HydrophobicContact CG-CD1 4.49Å; L90-L116 HydrophobicContact CG-CD2 4.17Å; L90-I118 HydrophobicContact CD1-CG1 4.47Å
91	V	96.4	Very high	95.5	Very high	37 Å²	37	40.3 Å²	40.3	22%	0.224	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	144.1	-176.7	-60	0	0	0	0	110.7	A43 D89 G117 Q119	A43-V91 HydrophobicContact CB-CG2 3.49Å; A43-V91 VanDerWaalsContact CB-CG2 3.49Å; D89-V91 HydrophobicContact CB-CG1 4.02Å; V91-G117 PolarHBondContact N-O 3.27Å; V91-G117 WeakPolarHBondContact O-CA 3.41Å; V91-G117 PolarHBondContact O-N 3.07Å; V91-G117 VanDerWaalsContact O-O 3.08Å; V91-Q119 HydrophobicContact CG1-CB 3.78Å; V91-Q119 HydrophobicContact CG2-CB 3.84Å
92	G	94.4	Very high	95.7	Very high	42 Å²	42	34.4 Å²	34.4	43%	0.433	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	157.3	-163.5	-172	0	0	0	0	0	112.7	N115	G92-N115 WeakPolarHBondContact CA-O 3.07Å
93	K	94.3	Very high	95.8	Very high	124 Å²	124	37.8 Å²	37.8	54%	0.539	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	137.9	168.7	-165.6	-163.2	172.9	-66.2	0	109	C95 Y100 N115	K93-C95 PolarHBondContact O-N 2.9Å; K93-C95 VanDerWaalsContact O-N 3.15Å; K93-Y100 WeakPolarHBondContact O-CD2 3.17Å; K93-Y100 WeakPolarHBondContact O-CE2 3.14Å; K93-N115 HydrophobicContact CB-CB 4.26Å
94	D	95.5	Very high	95.7	Very high	69 Å²	69	36.8 Å²	36.8	37%	0.369	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	21	179.6	-36.2	-48.1	0	0	0	114.4	Y100 E101 A102	D94-Y100 HydrophobicContact CB-CD2 3.99Å; D94-Y100 HydrophobicContact CB-CE2 3.66Å; D94-E101 PolarHBondContact O-N 2.78Å; D94-A102 HydrophobicContact CB-CB 4.42Å
95	C	95.6	Very high	95.4	Very high	31 Å²	31	37.4 Å²	37.4	21%	0.209	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	138.8	171.2	-64.5	0	0	0	0	112	K93 F99 L116	K93-C95 PolarHBondContact O-N 2.9Å; K93-C95 VanDerWaalsContact O-N 3.15Å; C95-F99 CarbonylContact C-O 3.24Å; C95-F99 VanDerWaalsContact CA-O 3.25Å; C95-F99 WeakPolarHBondContact CA-O 3.21Å; C95-L116 WeakPolarHBondContact SG-CD2 3.48Å
96	K	93.3	Very high	94.9	Very high	100 Å²	100	39.7 Å²	39.7	44%	0.435	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	147.9	171.7	60.9	-173.6	174.4	-170	0	110	G98 F99 E101	K96-G98 PolarHBondContact O-N 2.84Å; K96-F99 HydrophobicContact CG-CE1 4.37Å; K96-F99 HydrophobicContact CG-CZ 4.25Å; K96-F99 PolarHBondContact N-O 2.97Å; K96-F99 WeakPolarHBondContact O-CD1 3.48Å; K96-F99 PolarHBondContact O-N 2.89Å; K96-E101 WeakPolarHBondContact CE-OE1 3.24Å; K96-E101 IonicContact NZ-OE1 2.77Å; K96-E101 PolarHBondContact NZ-OE1 2.95Å
97	D	92	Very high	94.2	Very high	77 Å²	77	46.7 Å²	46.7	41%	0.412	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	24	174.5	-64.3	-68	0	0	0	115.8	F99 R133 R136	D97-F99 HydrophobicContact CB-CD1 4.15Å; D97-F99 HydrophobicContact CB-CE1 3.93Å; D97-R133 PolarHBondContact O-NH1 3.23Å; D97-R136 IonicContact OD1-CZ 2.7Å; D97-R136 IonicContact OD1-NE 3.19Å; D97-R136 PolarHBondContact OD1-NE 3.27Å; D97-R136 IonicContact OD1-NH2 3.89Å; D97-R136 PolarHBondContact OD1-NH2 2.88Å
98	G	93.6	Very high	93.4	Very high	9 Å²	9	55.1 Å²	55.1	9%	0.093	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	9.2	-178.6	0	0	0	0	0	116.4	D89 L90 K96	D89-G98 WeakPolarHBondContact OD1-CA 3.5Å; L90-G98 VanDerWaalsContact CB-O 3.31Å; L90-G98 WeakPolarHBondContact CB-O 3.13Å; L90-G98 PolarHBondContact N-O 2.81Å; L90-G98 CarbonylContact O-C 3.6Å; K96-G98 PolarHBondContact O-N 2.84Å
99	F	96.6	Very high	92.7	Very high	21 Å²	21	62.8 Å²	62.8	9%	0.092	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	159.4	174.6	72.5	-83.3	0	0	0	111.6	V74 Y75 C95 K96 D97 E101 I138	V74-F99 WeakPolarHBondContact O-CA 3.25Å; V74-F99 WeakPolarHBondContact O-CB 3.4Å; Y75-F99 HydrophobicContact CD1-CB 3.48Å; Y75-F99 VanDerWaalsContact CD1-CB 3.48Å; Y75-F99 HydrophobicContact CD1-CD2 4.36Å; Y75-F99 AromaticContact CD1-CG 3.97Å; Y75-F99 HydrophobicContact CD1-CG 3.97Å; Y75-F99 HydrophobicContact CE1-CB 3.76Å; Y75-F99 HydrophobicContact CE1-CD1 4.26Å; Y75-F99 AromaticContact CE1-CD2 3.78Å; Y75-F99 HydrophobicContact CE1-CD2 3.78Å; Y75-F99 HydrophobicContact CE1-CE2 4.42Å; Y75-F99 AromaticContact CE1-CG 3.69Å; Y75-F99 HydrophobicContact CE1-CG 3.69Å; Y75-F99 HydrophobicContact CG-CB 4.39Å; C95-F99 CarbonylContact C-O 3.24Å; C95-F99 VanDerWaalsContact CA-O 3.25Å; C95-F99 WeakPolarHBondContact CA-O 3.21Å; K96-F99 HydrophobicContact CG-CE1 4.37Å; K96-F99 HydrophobicContact CG-CZ 4.25Å; K96-F99 PolarHBondContact N-O 2.97Å; K96-F99 WeakPolarHBondContact O-CD1 3.48Å; K96-F99 PolarHBondContact O-N 2.89Å; D97-F99 HydrophobicContact CB-CD1 4.15Å; D97-F99 HydrophobicContact CB-CE1 3.93Å; F99-E101 HydrophobicContact CD2-CB 4.39Å; F99-E101 HydrophobicContact CE2-CB 3.97Å; F99-I138 HydrophobicContact CD1-CD1 3.76Å; F99-I138 HydrophobicContact CD1-CG1 4.44Å; F99-I138 HydrophobicContact CE1-CD1 4.07Å
100	Y	97.6	Very high	92.5	Very high	17 Å²	17	63.7 Å²	63.7	7%	0.067	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	138.1	173.8	173.5	-95.2	0	0	0	109.8	V72 R73 V74 K93 D94 A102 F113 L116	V72-Y100 HydrophobicContact CG1-CE1 4.11Å; R73-Y100 CarbonylContact C-O 3.37Å; R73-Y100 WeakPolarHBondContact CA-O 3.31Å; V74-Y100 HydrophobicContact CB-CD1 4.39Å; V74-Y100 HydrophobicContact CG2-CD1 3.97Å; V74-Y100 PolarHBondContact N-O 2.94Å; V74-Y100 PolarHBondContact O-N 3.38Å; K93-Y100 WeakPolarHBondContact O-CD2 3.17Å; K93-Y100 WeakPolarHBondContact O-CE2 3.14Å; D94-Y100 HydrophobicContact CB-CD2 3.99Å; D94-Y100 HydrophobicContact CB-CE2 3.66Å; Y100-A102 HydrophobicContact CE1-CB 3.68Å; Y100-A102 HydrophobicContact CE2-CB 4.33Å; Y100-A102 VanDerWaalsContact OH-CB 3.31Å; Y100-A102 WeakPolarHBondContact OH-CB 3.46Å; Y100-F113 HydrophobicContact CD1-CD1 4.14Å; Y100-F113 HydrophobicContact CD1-CE1 4.37Å; Y100-F113 AromaticContact CE1-CD1 3.62Å; Y100-F113 HydrophobicContact CE1-CD1 3.62Å; Y100-F113 AromaticContact CE1-CE1 3.88Å; Y100-F113 HydrophobicContact CE1-CE1 3.88Å; Y100-L116 HydrophobicContact CD2-CD2 3.6Å; Y100-L116 HydrophobicContact CE2-CD2 4.26Å; Y100-L116 HydrophobicContact CG-CD2 4.09Å
101	E	96	Very high	92.4	Very high	32 Å²	32	64.5 Å²	64.5	15%	0.15	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	121.2	170.1	-177.1	176.6	54.2	0	0	110	K71 V72 R73 D94 K96 F99	K71-E101 HydrophobicContact CD-CG 3.78Å; K71-E101 WeakPolarHBondContact CD-OE2 3.3Å; K71-E101 WeakPolarHBondContact CE-OE2 3.28Å; K71-E101 HydrophobicContact CG-CG 3.91Å; K71-E101 IonicContact NZ-OE2 3.71Å; K71-E101 PolarHBondContact NZ-OE2 2.77Å; V72-E101 WeakPolarHBondContact O-CA 3.42Å; R73-E101 HydrophobicContact CG-CB 4.25Å; R73-E101 HydrophobicContact CG-CG 4.02Å; R73-E101 IonicContact CZ-OE2 2.78Å; R73-E101 IonicContact NE-OE2 2.71Å; R73-E101 PolarHBondContact NE-OE2 2.85Å; R73-E101 IonicContact NH2-OE2 3.16Å; R73-E101 PolarHBondContact NH2-OE2 2.92Å; D94-E101 PolarHBondContact O-N 2.78Å; K96-E101 WeakPolarHBondContact CE-OE1 3.24Å; K96-E101 IonicContact NZ-OE1 2.77Å; K96-E101 PolarHBondContact NZ-OE1 2.95Å; F99-E101 HydrophobicContact CD2-CB 4.39Å; F99-E101 HydrophobicContact CE2-CB 3.97Å
102	A	95.3	Very high	92.3	Very high	18 Å²	18	64.6 Å²	64.6	15%	0.149	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	151.2	177.3	0	0	0	0	0	111.9	K71 V72 D94 Y100	K71-A102 WeakPolarHBondContact CA-O 3.41Å; V72-A102 WeakPolarHBondContact CG1-O 3.19Å; V72-A102 PolarHBondContact N-O 3.47Å; V72-A102 PolarHBondContact O-N 3.03Å; D94-A102 HydrophobicContact CB-CB 4.42Å; Y100-A102 HydrophobicContact CE1-CB 3.68Å; Y100-A102 HydrophobicContact CE2-CB 4.33Å; Y100-A102 VanDerWaalsContact OH-CB 3.31Å; Y100-A102 WeakPolarHBondContact OH-CB 3.46Å
103	E	94.5	Very high	92.3	Very high	125 Å²	125	62.7 Å²	62.7	58%	0.584	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	148.2	175.5	-65.5	-177.2	-159.9	0	0	111.2	G70 K71 Y174	G70-E103 CarbonylContact O-C 3.6Å; G70-E103 VanDerWaalsContact O-CA 3.28Å; G70-E103 WeakPolarHBondContact O-CA 3.34Å; K71-E103 HydrophobicContact CB-CG 4.11Å; K71-E103 HydrophobicContact CD-CG 4Å; K71-E103 HydrophobicContact CG-CG 3.9Å; E103-Y174 HydrophobicContact CG-CE2 4.06Å; E103-Y174 WeakPolarHBondContact OE1-CE2 3.35Å; E103-Y174 WeakPolarHBondContact OE2-CE2 3.39Å; E103-Y174 PolarHBondContact OE2-OH 3.01Å
104	F	92.9	Very high	92.3	Very high	15 Å²	15	61.5 Å²	61.5	7%	0.066	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	147.3	179.6	61.3	-96.4	0	0	0	111.2	I63 Y66 K69 G70 I111 V165 L167	I63-F104 HydrophobicContact CD1-CD1 4.35Å; I63-F104 HydrophobicContact CD1-CD2 4.2Å; I63-F104 HydrophobicContact CD1-CE1 3.65Å; I63-F104 HydrophobicContact CD1-CE2 3.49Å; I63-F104 VanDerWaalsContact CD1-CE2 3.49Å; I63-F104 HydrophobicContact CD1-CZ 3.16Å; Y66-F104 HydrophobicContact CE1-CE2 4.5Å; K69-F104 VanDerWaalsContact CA-O 3.29Å; K69-F104 WeakPolarHBondContact CA-O 3.41Å; G70-F104 VanDerWaalsContact C-CD1 3.46Å; G70-F104 PolarHBondContact N-O 2.95Å; G70-F104 VanDerWaalsContact N-O 3.1Å; G70-F104 VanDerWaalsContact O-CD1 3.28Å; G70-F104 WeakPolarHBondContact O-CD1 3.27Å; G70-F104 PolarHBondContact O-N 2.9Å; F104-I111 HydrophobicContact CB-CD1 3.87Å; F104-I111 HydrophobicContact CB-CG1 4.41Å; F104-I111 HydrophobicContact CD1-CD1 3.39Å; F104-I111 HydrophobicContact CD2-CD1 4.36Å; F104-I111 HydrophobicContact CE1-CD1 3.95Å; F104-I111 HydrophobicContact CG-CD1 3.63Å; F104-V165 HydrophobicContact CE1-CG1 4.14Å; F104-V165 HydrophobicContact CZ-CG1 4.06Å; F104-L167 HydrophobicContact CZ-CD2 4.19Å
105	G	90.6	Very high	92.2	Very high	25 Å²	25	62 Å²	62	26%	0.258	31%	0.313	S	S	.	.			trans	-93.1	168.5	176.1	0	0	0	0	0	113.1	D107 R108	G105-D107 PolarHBondContact O-N 2.87Å; G105-D107 VanDerWaalsContact O-N 3.16Å; G105-R108 PolarHBondContact O-N 2.69Å; G105-R108 VanDerWaalsContact O-N 3.08Å
106	P	85.2	Confident	92.3	Very high	50 Å²	50	60.5 Å²	60.5	33%	0.325	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-31.5	-171.9	24.2	-34.9	0	0	0	114.4	G68 R108	G68-P106 WeakPolarHBondContact O-CA 3.35Å; P106-R108 VanDerWaalsContact C-N 3.29Å; P106-R108 PolarHBondContact O-N 3.02Å
107	D	83.6	Confident	92.4	Very high	148 Å²	148	55.8 Å²	55.8	79%	0.791	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-19.8	-177.6	-39.6	-81.1	0	0	0	112.9	G105 R109	G105-D107 PolarHBondContact O-N 2.87Å; G105-D107 VanDerWaalsContact O-N 3.16Å; D107-R109 PolarHBondContact O-N 3.39Å; D107-R109 VanDerWaalsContact O-N 3.16Å
108	R	81.5	Confident	92.7	Very high	177 Å²	177	52.1 Å²	52.1	67%	0.668	26%	0.263	S	S	*	.			trans	-91.1	76.9	-171.6	-68.7	-167.7	176.7	-161.3	-1.4	112.5	G105 P106 V110	G105-R108 PolarHBondContact O-N 2.69Å; G105-R108 VanDerWaalsContact O-N 3.08Å; P106-R108 VanDerWaalsContact C-N 3.29Å; P106-R108 PolarHBondContact O-N 3.02Å; R108-V110 VanDerWaalsContact C-N 3.27Å; R108-V110 PolarHBondContact O-N 2.95Å
109	R	82.9	Confident	92.9	Very high	162 Å²	162	53.7 Å²	53.7	61%	0.611	27%	0.268	S	S	*	.	S	Bend	trans	-65.4	-26.5	172.5	-62.3	-174.9	-177	-173.6	0.2	114	Q62 I63 D107	Q62-R109 WeakPolarHBondContact CA-O 3.33Å; I63-R109 PolarHBondContact N-O 3.47Å; D107-R109 PolarHBondContact O-N 3.39Å; D107-R109 VanDerWaalsContact O-N 3.16Å
110	V	93.2	Very high	92.9	Very high	58 Å²	58	53 Å²	53	35%	0.352	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	133.3	176.6	-177.1	0	0	0	0	109.9	F24 L61 Q62 R108	F24-V110 HydrophobicContact CB-CG1 4.29Å; F24-V110 HydrophobicContact CD1-CG1 3.95Å; F24-V110 HydrophobicContact CD2-CG2 4.22Å; F24-V110 HydrophobicContact CE1-CG1 4.44Å; F24-V110 HydrophobicContact CE2-CG2 4.42Å; F24-V110 HydrophobicContact CG-CG1 4.01Å; F24-V110 HydrophobicContact CG-CG2 4.47Å; L61-V110 CarbonylContact O-C 3.51Å; L61-V110 VanDerWaalsContact O-CA 3.28Å; L61-V110 WeakPolarHBondContact O-CA 3.42Å; Q62-V110 HydrophobicContact CB-CG2 4.23Å; Q62-V110 HydrophobicContact CG-CG2 4.16Å; R108-V110 VanDerWaalsContact C-N 3.27Å; R108-V110 PolarHBondContact O-N 2.95Å
111	I	94.7	Very high	92.9	Very high	17 Å²	17	53.1 Å²	53.1	9%	0.087	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	110.9	-176.6	-53.2	172.3	0	0	0	108.3	S60 L61 I63 V72 F104 F113	S60-I111 CarbonylContact C-O 3.48Å; S60-I111 WeakPolarHBondContact CA-O 3.26Å; L61-I111 PolarHBondContact N-O 2.84Å; L61-I111 PolarHBondContact O-N 3.32Å; I63-I111 HydrophobicContact CD1-CD1 3.9Å; V72-I111 HydrophobicContact CG1-CD1 4.33Å; V72-I111 HydrophobicContact CG1-CG2 4.32Å; F104-I111 HydrophobicContact CB-CD1 3.87Å; F104-I111 HydrophobicContact CB-CG1 4.41Å; F104-I111 HydrophobicContact CD1-CD1 3.39Å; F104-I111 HydrophobicContact CD2-CD1 4.36Å; F104-I111 HydrophobicContact CE1-CD1 3.95Å; F104-I111 HydrophobicContact CG-CD1 3.63Å; I111-F113 HydrophobicContact CG2-CD1 4.42Å; I111-F113 HydrophobicContact CG2-CE1 3.97Å
112	A	95.5	Very high	92.9	Very high	40 Å²	40	56.4 Å²	56.4	33%	0.331	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	126	178.6	0	0	0	0	0	111.3	S60 Q114	S60-A112 WeakPolarHBondContact OG-CA 2.79Å; S60-A112 WeakPolarHBondContact OG-CB 3.32Å; A112-Q114 HydrophobicContact CB-CG 4.46Å; A112-Q114 PolarHBondContact O-N 2.93Å; A112-Q114 VanDerWaalsContact O-N 3.08Å
113	F	95.2	Very high	92.9	Very high	1 Å²	1	61.9 Å²	61.9	0%	0.004	30%	0.296	C	S	.	.			trans	-88.2	71.9	-174.8	-53.8	-65	0	0	0	111.9	P59 L61 V72 V74 Y100 I111 L116 I163	P59-F113 HydrophobicContact CB-CD2 4.33Å; P59-F113 WeakPolarHBondContact O-CD2 3.25Å; P59-F113 PolarHBondContact O-N 2.98Å; L61-F113 HydrophobicContact CB-CE2 3.88Å; L61-F113 HydrophobicContact CB-CZ 3.8Å; L61-F113 HydrophobicContact CD2-CZ 4.49Å; V72-F113 HydrophobicContact CG1-CE1 4.08Å; V72-F113 HydrophobicContact CG2-CE1 3.84Å; V72-F113 HydrophobicContact CG2-CZ 3.88Å; V74-F113 HydrophobicContact CG2-CD1 4Å; V74-F113 HydrophobicContact CG2-CE1 3.67Å; V74-F113 HydrophobicContact CG2-CE2 4.25Å; V74-F113 HydrophobicContact CG2-CG 4.42Å; V74-F113 HydrophobicContact CG2-CZ 3.82Å; Y100-F113 HydrophobicContact CD1-CD1 4.14Å; Y100-F113 HydrophobicContact CD1-CE1 4.37Å; Y100-F113 AromaticContact CE1-CD1 3.62Å; Y100-F113 HydrophobicContact CE1-CD1 3.62Å; Y100-F113 AromaticContact CE1-CE1 3.88Å; Y100-F113 HydrophobicContact CE1-CE1 3.88Å; I111-F113 HydrophobicContact CG2-CD1 4.42Å; I111-F113 HydrophobicContact CG2-CE1 3.97Å; F113-L116 HydrophobicContact CB-CD1 3.55Å; F113-L116 HydrophobicContact CB-CG 4.17Å; F113-L116 HydrophobicContact CG-CD1 4.38Å; F113-I163 HydrophobicContact CE2-CD1 3.9Å; F113-I163 HydrophobicContact CE2-CG1 4.48Å; F113-I163 HydrophobicContact CZ-CD1 4.47Å; F113-I163 HydrophobicContact CZ-CG2 4.16Å
114	Q	94	Very high	92.9	Very high	100 Å²	100	64.6 Å²	64.6	47%	0.467	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	154.9	-179.3	-53.3	-174	3.4	0	0	112.5	Y58 A112 L116	Y58-Q114 HydrophobicContact CD1-CB 4.37Å; Y58-Q114 HydrophobicContact CD1-CG 4.36Å; Y58-Q114 HydrophobicContact CD2-CG 3.74Å; Y58-Q114 HydrophobicContact CE1-CB 4.48Å; Y58-Q114 HydrophobicContact CE2-CG 4.08Å; Y58-Q114 HydrophobicContact CG-CB 4.38Å; Y58-Q114 HydrophobicContact CG-CG 3.89Å; A112-Q114 HydrophobicContact CB-CG 4.46Å; A112-Q114 PolarHBondContact O-N 2.93Å; A112-Q114 VanDerWaalsContact O-N 3.08Å; Q114-L116 PolarHBondContact O-N 3.33Å
115	N	93.4	Very high	93.1	Very high	78 Å²	78	66.3 Å²	66.3	42%	0.417	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	21.4	173.8	-54.2	-71.3	0	0	0	115.7	G92 K93	G92-N115 WeakPolarHBondContact CA-O 3.07Å; K93-N115 HydrophobicContact CB-CB 4.26Å
116	L	95.9	Very high	93.4	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	115.1	172.4	-67.3	-169.8	0	0	0	111.7	S45 I46 L90 C95 Y100 F113 Q114	S45-L116 CarbonylContact C-O 3.58Å; S45-L116 WeakPolarHBondContact CA-O 3.28Å; I46-L116 HydrophobicContact CD1-CB 3.94Å; I46-L116 HydrophobicContact CD1-CD1 4.49Å; I46-L116 WeakPolarHBondContact CG1-O 3.42Å; I46-L116 PolarHBondContact N-O 3.41Å; L90-L116 HydrophobicContact CD1-CB 4.17Å; L90-L116 HydrophobicContact CD1-CD1 4.24Å; L90-L116 HydrophobicContact CD1-CD2 4.47Å; L90-L116 HydrophobicContact CD2-CD1 4.04Å; L90-L116 HydrophobicContact CD2-CD2 4.15Å; L90-L116 HydrophobicContact CG-CD1 4.49Å; L90-L116 HydrophobicContact CG-CD2 4.17Å; C95-L116 WeakPolarHBondContact SG-CD2 3.48Å; Y100-L116 HydrophobicContact CD2-CD2 3.6Å; Y100-L116 HydrophobicContact CE2-CD2 4.26Å; Y100-L116 HydrophobicContact CG-CD2 4.09Å; F113-L116 HydrophobicContact CB-CD1 3.55Å; F113-L116 HydrophobicContact CB-CG 4.17Å; F113-L116 HydrophobicContact CG-CD1 4.38Å; Q114-L116 PolarHBondContact O-N 3.33Å
117	G	96.9	Very high	94	Very high	1 Å²	1	68.7 Å²	68.7	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	163.5	167.9	0	0	0	0	0	112.5	V91	V91-G117 PolarHBondContact N-O 3.27Å; V91-G117 WeakPolarHBondContact O-CA 3.41Å; V91-G117 PolarHBondContact O-N 3.07Å; V91-G117 VanDerWaalsContact O-O 3.08Å
118	I	97.9	Very high	94.6	Very high	0 Å²	0	66 Å²	66	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	114.6	179.6	-65.2	164.2	0	0	0	108.6	M32 F34 R35 I46 L76 H88 L90 V159 I186	M32-I118 HydrophobicContact CE-CB 4.28Å; M32-I118 HydrophobicContact CE-CD1 4.18Å; M32-I118 HydrophobicContact CE-CG1 4.15Å; M32-I118 HydrophobicContact SD-CD1 3.96Å; F34-I118 HydrophobicContact CB-CG2 4.16Å; F34-I118 HydrophobicContact CD1-CB 3.76Å; F34-I118 HydrophobicContact CD1-CD1 3.88Å; F34-I118 HydrophobicContact CD1-CG1 4.43Å; F34-I118 HydrophobicContact CD1-CG2 3.68Å; F34-I118 HydrophobicContact CD2-CG2 3.98Å; F34-I118 HydrophobicContact CE1-CB 4.21Å; F34-I118 HydrophobicContact CE1-CD1 3.44Å; F34-I118 VanDerWaalsContact CE1-CD1 3.44Å; F34-I118 HydrophobicContact CE1-CG1 4.42Å; F34-I118 HydrophobicContact CE1-CG2 4.07Å; F34-I118 HydrophobicContact CE2-CG2 4.33Å; F34-I118 HydrophobicContact CG-CB 4.17Å; F34-I118 HydrophobicContact CG-CG2 3.66Å; F34-I118 HydrophobicContact CZ-CD1 4.08Å; F34-I118 HydrophobicContact CZ-CG2 4.38Å; R35-I118 PolarHBondContact N-O 3.49Å; I46-I118 HydrophobicContact CD1-CD1 4.21Å; I46-I118 HydrophobicContact CD1-CG1 4.3Å; I46-I118 HydrophobicContact CG1-CD1 4.22Å; I46-I118 HydrophobicContact CG1-CG1 4.47Å; L76-I118 HydrophobicContact CD1-CG1 4.34Å; L76-I118 HydrophobicContact CD1-CG2 4.09Å; H88-I118 HydrophobicContact CB-CG2 4.21Å; L90-I118 HydrophobicContact CD1-CG1 4.47Å; I118-V159 HydrophobicContact CD1-CG2 3.74Å; I118-I186 HydrophobicContact CD1-CD1 4.25Å; I118-I186 HydrophobicContact CD1-CG2 4.23Å
119	Q	97.5	Very high	95.3	Very high	43 Å²	43	58.1 Å²	58.1	20%	0.201	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	110.3	174.6	179.3	156.9	120.1	0	0	109.6	R35 K37 H88 D89 V91	R35-Q119 CarbonylContact O-C 3.58Å; R35-Q119 VanDerWaalsContact O-CA 3.23Å; R35-Q119 WeakPolarHBondContact O-CA 3.44Å; K37-Q119 HydrophobicContact CB-CG 4.37Å; H88-Q119 WeakPolarHBondContact CB-O 3.41Å; D89-Q119 HydrophobicContact CB-CB 4.27Å; D89-Q119 PolarHBondContact N-O 3.38Å; D89-Q119 PolarHBondContact O-N 3.07Å; V91-Q119 HydrophobicContact CG1-CB 3.78Å; V91-Q119 HydrophobicContact CG2-CB 3.84Å
120	C	97	Very high	96	Very high	6 Å²	6	50.5 Å²	50.5	4%	0.041	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	139.4	-179.4	54.9	0	0	0	0	112.3	F34 R35 Y36 H88	F34-C120 HydrophobicContact CB-CB 3.91Å; R35-C120 PolarHBondContact O-N 3.44Å; Y36-C120 VanDerWaalsContact CD1-O 3.29Å; Y36-C120 WeakPolarHBondContact CD1-O 3.44Å; Y36-C120 HydrophobicContact CE1-CB 4.46Å; H88-C120 VanDerWaalsContact CE1-CB 3.43Å; H88-C120 WeakPolarHBondContact CE1-CB 3.4Å; H88-C120 WeakPolarHBondContact ND1-CA 3.43Å
121	V	96.9	Very high	96.1	Very high	20 Å²	20	50.8 Å²	50.8	12%	0.121	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-91.5	156.1	172.2	-58.1	0	0	0	0	110.7	P87 H88 E125 V126 A129	P87-V121 HydrophobicContact CB-CG2 3.91Å; P87-V121 HydrophobicContact CG-CG2 4.42Å; P87-V121 WeakPolarHBondContact O-CG1 3.21Å; H88-V121 PolarHBondContact ND1-N 3.47Å; H88-V121 VanDerWaalsContact ND1-N 3.16Å; V121-E125 HydrophobicContact CB-CB 4.11Å; V121-V126 HydrophobicContact CG2-CG2 4.08Å; V121-A129 HydrophobicContact CG1-CB 4.45Å
122	R	95.9	Very high	96.2	Very high	100 Å²	100	54.5 Å²	54.5	38%	0.377	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-81	155.8	174.9	-61.4	172.6	-71.9	-150.8	1.3	109.8	Y36 R124 E125 V126	Y36-R122 HydrophobicContact CD1-CG 3.86Å; Y36-R122 HydrophobicContact CE1-CG 3.59Å; R122-R124 HydrophobicContact CB-CG 4.42Å; R122-R124 PolarHBondContact O-N 3.19Å; R122-E125 VanDerWaalsContact CB-OE2 3.26Å; R122-E125 WeakPolarHBondContact CB-OE2 3.49Å; R122-E125 IonicContact CZ-OE1 2.71Å; R122-E125 IonicContact CZ-OE2 2.74Å; R122-E125 PolarHBondContact N-OE2 3.3Å; R122-E125 IonicContact NE-OE1 2.89Å; R122-E125 PolarHBondContact NE-OE1 2.59Å; R122-E125 IonicContact NE-OE2 3.81Å; R122-E125 PolarHBondContact NE-OE2 2.97Å; R122-E125 VanDerWaalsContact NE-OE2 3.14Å; R122-E125 IonicContact NH2-OE1 3.75Å; R122-E125 PolarHBondContact NH2-OE1 2.9Å; R122-E125 IonicContact NH2-OE2 3.24Å; R122-E125 WeakPolarHBondContact O-CA 3.36Å; R122-E125 WeakPolarHBondContact O-CB 3.38Å; R122-E125 PolarHBondContact O-N 2.89Å; R122-V126 PolarHBondContact O-N 2.8Å
123	R	95.3	Very high	96.2	Very high	133 Å²	133	53 Å²	53	50%	0.502	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-49.8	-36.6	-175.7	-170.4	60.6	164.2	154.5	-7.3	114.2	V126 T151 E152 L156	R123-V126 WeakPolarHBondContact O-CB 3.44Å; R123-V126 WeakPolarHBondContact O-CG2 3.46Å; R123-T151 PolarHBondContact NH1-O 3.1Å; R123-E152 PolarHBondContact NH1-O 3.31Å; R123-E152 PolarHBondContact NH2-O 3.23Å; R123-L156 HydrophobicContact CB-CD1 4.45Å
124	R	95.8	Very high	96.2	Very high	182 Å²	182	55.2 Å²	55.2	69%	0.687	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-69.8	-26.1	176.2	68.6	-171	178.4	-156.1	11.6	115.1	R122	R122-R124 HydrophobicContact CB-CG 4.42Å; R122-R124 PolarHBondContact O-N 3.19Å
125	E	96.7	Very high	96.2	Very high	52 Å²	52	56.5 Å²	56.5	24%	0.243	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-87.9	-8.9	-178.5	-73.3	133.2	-151.6	0	0	112.3	V121 R122 K127 D128 A129	V121-E125 HydrophobicContact CB-CB 4.11Å; R122-E125 VanDerWaalsContact CB-OE2 3.26Å; R122-E125 WeakPolarHBondContact CB-OE2 3.49Å; R122-E125 IonicContact CZ-OE1 2.71Å; R122-E125 IonicContact CZ-OE2 2.74Å; R122-E125 PolarHBondContact N-OE2 3.3Å; R122-E125 IonicContact NE-OE1 2.89Å; R122-E125 PolarHBondContact NE-OE1 2.59Å; R122-E125 IonicContact NE-OE2 3.81Å; R122-E125 PolarHBondContact NE-OE2 2.97Å; R122-E125 VanDerWaalsContact NE-OE2 3.14Å; R122-E125 IonicContact NH2-OE1 3.75Å; R122-E125 PolarHBondContact NH2-OE1 2.9Å; R122-E125 IonicContact NH2-OE2 3.24Å; R122-E125 WeakPolarHBondContact O-CA 3.36Å; R122-E125 WeakPolarHBondContact O-CB 3.38Å; R122-E125 PolarHBondContact O-N 2.89Å; E125-K127 VanDerWaalsContact C-N 3.35Å; E125-K127 PolarHBondContact O-N 3.01Å; E125-D128 PolarHBondContact O-N 3.24Å; E125-A129 WeakPolarHBondContact O-CB 3.23Å; E125-A129 PolarHBondContact O-N 3.27Å
126	V	97.3	Very high	96.2	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-58.3	-42.5	-177.2	171.9	0	0	0	0	112.5	P87 V121 R122 R123 A129 I130 T151 L156	P87-V126 HydrophobicContact CB-CB 4.43Å; P87-V126 HydrophobicContact CB-CG1 4.06Å; P87-V126 HydrophobicContact CB-CG2 4.38Å; P87-V126 HydrophobicContact CG-CG1 4.06Å; P87-V126 HydrophobicContact CG-CG2 4.3Å; V121-V126 HydrophobicContact CG2-CG2 4.08Å; R122-V126 PolarHBondContact O-N 2.8Å; R123-V126 WeakPolarHBondContact O-CB 3.44Å; R123-V126 WeakPolarHBondContact O-CG2 3.46Å; V126-A129 PolarHBondContact O-N 2.86Å; V126-I130 WeakPolarHBondContact O-CG1 3.44Å; V126-I130 PolarHBondContact O-N 2.82Å; V126-T151 HydrophobicContact CG1-CG2 4.3Å; V126-L156 HydrophobicContact CG2-CD1 3.92Å; V126-L156 HydrophobicContact CG2-CD2 3.82Å; V126-L156 HydrophobicContact CG2-CG 4.47Å
127	K	96.3	Very high	96	Very high	123 Å²	123	60.6 Å²	60.6	54%	0.535	30%	0.295	S	S	.	.	H	α-helix	trans	-61.3	-47.8	-179.7	-174.1	178.3	178.5	-179.8	0	111.3	E125 I130 L131 T151	E125-K127 VanDerWaalsContact C-N 3.35Å; E125-K127 PolarHBondContact O-N 3.01Å; K127-I130 PolarHBondContact O-N 2.86Å; K127-L131 HydrophobicContact CG-CD1 4.25Å; K127-L131 WeakPolarHBondContact O-CG 3.03Å; K127-L131 PolarHBondContact O-N 3Å; K127-T151 HydrophobicContact CB-CG2 4.05Å; K127-T151 HydrophobicContact CG-CG2 4.3Å
128	D	96.6	Very high	95.8	Very high	91 Å²	91	61 Å²	61	49%	0.487	30%	0.296	S	S	.	.	H	α-helix	trans	-70.3	-36.1	-178	-54.5	-25.8	0	0	0	111.2	E125 L131 Q132	E125-D128 PolarHBondContact O-N 3.24Å; D128-L131 PolarHBondContact O-N 3.02Å; D128-Q132 WeakPolarHBondContact O-CG 3.31Å; D128-Q132 PolarHBondContact O-N 2.87Å
129	A	96.9	Very high	95.6	Very high	12 Å²	12	62.7 Å²	62.7	10%	0.099	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-46.4	173.8	0	0	0	0	0	112.2	P87 V121 E125 V126 Q132 R133	P87-A129 HydrophobicContact CB-CB 3.85Å; P87-A129 WeakPolarHBondContact O-CB 3.42Å; V121-A129 HydrophobicContact CG1-CB 4.45Å; E125-A129 WeakPolarHBondContact O-CB 3.23Å; E125-A129 PolarHBondContact O-N 3.27Å; V126-A129 PolarHBondContact O-N 2.86Å; A129-Q132 WeakPolarHBondContact O-CB 3.44Å; A129-Q132 PolarHBondContact O-N 3.32Å; A129-R133 WeakPolarHBondContact O-CG 3.36Å; A129-R133 PolarHBondContact O-N 2.84Å
130	I	96.9	Very high	95.2	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-67	-38.8	175.8	-61.6	-59.6	0	0	0	111.6	P85 P87 V126 K127 Q132 R133 I134 L148 M149 Y154	P85-I130 VanDerWaalsContact O-CD1 3.27Å; P85-I130 WeakPolarHBondContact O-CD1 3.47Å; P87-I130 HydrophobicContact CB-CD1 4Å; P87-I130 HydrophobicContact CB-CG1 4.26Å; V126-I130 WeakPolarHBondContact O-CG1 3.44Å; V126-I130 PolarHBondContact O-N 2.82Å; K127-I130 PolarHBondContact O-N 2.86Å; I130-Q132 VanDerWaalsContact C-N 3.29Å; I130-Q132 PolarHBondContact O-N 2.83Å; I130-R133 WeakPolarHBondContact O-CB 3.36Å; I130-R133 PolarHBondContact O-N 3.03Å; I130-R133 VanDerWaalsContact O-N 3.11Å; I130-I134 HydrophobicContact CG2-CD1 3.93Å; I130-I134 HydrophobicContact CG2-CG1 4.47Å; I130-I134 WeakPolarHBondContact O-CG1 3.47Å; I130-I134 PolarHBondContact O-N 2.96Å; I130-L148 HydrophobicContact CG2-CB 3.97Å; I130-M149 HydrophobicContact CB-CE 4.1Å; I130-M149 HydrophobicContact CG2-CE 3.54Å; I130-Y154 HydrophobicContact CD1-CE1 3.78Å; I130-Y154 HydrophobicContact CG1-CE1 4.46Å; I130-Y154 HydrophobicContact CG1-CE2 4.37Å
131	L	95.6	Very high	95	Very high	64 Å²	64	64.4 Å²	64.4	34%	0.335	31%	0.313	S	S	.	.	H	α-helix	trans	-58.8	-41.2	172.5	-74.8	169.9	0	0	0	111.6	K127 D128 I134 T135 M149	K127-L131 HydrophobicContact CG-CD1 4.25Å; K127-L131 WeakPolarHBondContact O-CG 3.03Å; K127-L131 PolarHBondContact O-N 3Å; D128-L131 PolarHBondContact O-N 3.02Å; L131-I134 PolarHBondContact O-N 3.11Å; L131-T135 PolarHBondContact O-N 3.11Å; L131-T135 PolarHBondContact O-OG1 2.97Å; L131-T135 VanDerWaalsContact O-OG1 3.09Å; L131-M149 HydrophobicContact CD2-CE 3.95Å; L131-M149 HydrophobicContact CD2-SD 3.76Å; L131-M149 HydrophobicContact CG-CE 4.09Å; L131-M149 HydrophobicContact CG-SD 4.32Å
132	Q	95.6	Very high	94.8	Very high	96 Å²	96	69.6 Å²	69.6	45%	0.449	34%	0.34	S	S	.	.	H	α-helix	trans	-64.5	-37.7	172.9	-73.7	-178.6	31.7	0	0	113.2	D128 A129 I130 R136	D128-Q132 WeakPolarHBondContact O-CG 3.31Å; D128-Q132 PolarHBondContact O-N 2.87Å; A129-Q132 WeakPolarHBondContact O-CB 3.44Å; A129-Q132 PolarHBondContact O-N 3.32Å; I130-Q132 VanDerWaalsContact C-N 3.29Å; I130-Q132 PolarHBondContact O-N 2.83Å; Q132-R136 VanDerWaalsContact O-CB 3.3Å; Q132-R136 WeakPolarHBondContact O-CB 3.42Å; Q132-R136 WeakPolarHBondContact O-CD 3.36Å; Q132-R136 VanDerWaalsContact O-CG 3.24Å; Q132-R136 WeakPolarHBondContact O-CG 3.29Å; Q132-R136 PolarHBondContact O-N 2.98Å
133	R	95.9	Very high	94.7	Very high	8 Å²	8	65.2 Å²	65.2	3%	0.03	32%	0.324	C	S	.	.	H	α-helix	trans	-60	-45.7	173.3	-65.6	-72.3	-179.5	-104.3	-15.5	111	P85 H86 H88 D89 D97 A129 I130 R136 G137 I138	P85-R133 HydrophobicContact CB-CB 4.13Å; P85-R133 HydrophobicContact CB-CG 4.08Å; H86-R133 PolarHBondContact O-NE 2.95Å; H86-R133 VanDerWaalsContact O-NE 3.11Å; H88-R133 VanDerWaalsContact C-NH2 3.35Å; H88-R133 PolarHBondContact O-NH2 2.83Å; D89-R133 IonicContact OD1-CZ 2.75Å; D89-R133 IonicContact OD1-NH1 2.65Å; D89-R133 PolarHBondContact OD1-NH1 2.71Å; D89-R133 IonicContact OD1-NH2 2.79Å; D89-R133 PolarHBondContact OD1-NH2 2.7Å; D97-R133 PolarHBondContact O-NH1 3.23Å; A129-R133 WeakPolarHBondContact O-CG 3.36Å; A129-R133 PolarHBondContact O-N 2.84Å; I130-R133 WeakPolarHBondContact O-CB 3.36Å; I130-R133 PolarHBondContact O-N 3.03Å; I130-R133 VanDerWaalsContact O-N 3.11Å; R133-R136 PolarHBondContact O-N 3.05Å; R133-G137 PolarHBondContact O-N 3.25Å; R133-I138 HydrophobicContact CB-CB 4.36Å; R133-I138 PolarHBondContact O-N 2.95Å
134	I	94.7	Very high	94.6	Very high	48 Å²	48	62.5 Å²	62.5	25%	0.246	32%	0.324	C	S	.	.	H	α-helix	trans	-62.3	-52.3	178.5	-66.6	159.2	0	0	0	110.9	I130 L131 R136 G137 K145 L148 M149	I130-I134 HydrophobicContact CG2-CD1 3.93Å; I130-I134 HydrophobicContact CG2-CG1 4.47Å; I130-I134 WeakPolarHBondContact O-CG1 3.47Å; I130-I134 PolarHBondContact O-N 2.96Å; L131-I134 PolarHBondContact O-N 3.11Å; I134-R136 PolarHBondContact O-N 2.97Å; I134-G137 PolarHBondContact O-N 3.43Å; I134-K145 HydrophobicContact CD1-CG 4.16Å; I134-L148 HydrophobicContact CD1-CB 4.15Å; I134-L148 HydrophobicContact CD1-CD1 4.14Å; I134-L148 HydrophobicContact CG1-CD1 3.74Å; I134-M149 HydrophobicContact CD1-CE 3.6Å
135	T	94.8	Very high	94.4	Very high	126 Å²	126	59.3 Å²	59.3	77%	0.773	32%	0.315	S	S	*	.	H	α-helix	trans	-62.1	-29.6	-179.2	-59.2	0	0	0	0	112.9	L131 G137	L131-T135 PolarHBondContact O-N 3.11Å; L131-T135 PolarHBondContact O-OG1 2.97Å; L131-T135 VanDerWaalsContact O-OG1 3.09Å; T135-G137 VanDerWaalsContact C-N 3.34Å
136	R	93.1	Very high	94.3	Very high	102 Å²	102	63.3 Å²	63.3	39%	0.385	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	0.2	174.7	-70.1	169.1	164.5	135.6	-2.1	114.2	D97 Q132 R133 I134 I138	D97-R136 IonicContact OD1-CZ 2.7Å; D97-R136 IonicContact OD1-NE 3.19Å; D97-R136 PolarHBondContact OD1-NE 3.27Å; D97-R136 IonicContact OD1-NH2 3.89Å; D97-R136 PolarHBondContact OD1-NH2 2.88Å; Q132-R136 VanDerWaalsContact O-CB 3.3Å; Q132-R136 WeakPolarHBondContact O-CB 3.42Å; Q132-R136 WeakPolarHBondContact O-CD 3.36Å; Q132-R136 VanDerWaalsContact O-CG 3.24Å; Q132-R136 WeakPolarHBondContact O-CG 3.29Å; Q132-R136 PolarHBondContact O-N 2.98Å; R133-R136 PolarHBondContact O-N 3.05Å; I134-R136 PolarHBondContact O-N 2.97Å; R136-I138 HydrophobicContact CB-CD1 3.77Å; R136-I138 HydrophobicContact CB-CG1 3.85Å; R136-I138 PolarHBondContact O-N 3.33Å
137	G	92.4	Very high	94	Very high	63 Å²	63	65.9 Å²	65.9	65%	0.649	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	19.4	-175.8	0	0	0	0	0	114.4	R133 I134 T135 N139	R133-G137 PolarHBondContact O-N 3.25Å; I134-G137 PolarHBondContact O-N 3.43Å; T135-G137 VanDerWaalsContact C-N 3.34Å; G137-N139 PolarHBondContact O-N 2.98Å
138	I	93.1	Very high	93.8	Very high	8 Å²	8	60.2 Å²	60.2	4%	0.041	32%	0.321	C	S	.	.			trans	-81.7	83.9	-178.9	-59.4	170.2	0	0	0	108.6	Y75 P85 F99 R133 R136	Y75-I138 HydrophobicContact CD1-CG2 3.54Å; Y75-I138 HydrophobicContact CE1-CG1 4.43Å; Y75-I138 HydrophobicContact CE1-CG2 3.74Å; P85-I138 WeakPolarHBondContact CG-O 3.48Å; F99-I138 HydrophobicContact CD1-CD1 3.76Å; F99-I138 HydrophobicContact CD1-CG1 4.44Å; F99-I138 HydrophobicContact CE1-CD1 4.07Å; R133-I138 HydrophobicContact CB-CB 4.36Å; R133-I138 PolarHBondContact O-N 2.95Å; R136-I138 HydrophobicContact CB-CD1 3.77Å; R136-I138 HydrophobicContact CB-CG1 3.85Å; R136-I138 PolarHBondContact O-N 3.33Å
139	N	92.4	Very high	93.6	Very high	37 Å²	37	58.7 Å²	58.7	20%	0.198	31%	0.312	C	S	.	.			trans	-142.6	79	177.5	-167.7	-3.3	0	0	0	111.2	P85 G137 F141 N142 V143	P85-N139 HydrophobicContact CG-CB 4.44Å; G137-N139 PolarHBondContact O-N 2.98Å; N139-F141 PolarHBondContact O-N 2.73Å; N139-N142 PolarHBondContact O-N 3.02Å; N139-N142 VanDerWaalsContact O-N 3.14Å; N139-N142 PolarHBondContact OD1-N 2.93Å; N139-V143 PolarHBondContact ND2-N 3.03Å; N139-V143 VanDerWaalsContact ND2-N 3.19Å; N139-V143 PolarHBondContact ND2-O 2.78Å; N139-V143 PolarHBondContact OD1-N 2.92Å
140	P	90.5	Very high	93.3	Very high	15 Å²	15	62.7 Å²	62.7	10%	0.097	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-12.4	-169	25.2	-33.1	0	0	0	114.9	Y75 V77 C162 Q164	Y75-P140 HydrophobicContact CD2-CB 4.23Å; Y75-P140 HydrophobicContact CD2-CG 4.43Å; V77-P140 HydrophobicContact CG1-CG 3.89Å; P140-C162 HydrophobicContact CG-CB 4.49Å; P140-Q164 PolarHBondContact O-NE2 2.94Å
141	F	92	Very high	93	Very high	69 Å²	69	64.3 Å²	64.3	30%	0.303	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	11.1	178.5	-65.5	-80.4	0	0	0	113.6	V77 Y83 N139 V143 C162 P180 V182	V77-F141 HydrophobicContact CG1-CE2 4.49Å; Y83-F141 VanDerWaalsContact CB-CD2 3.45Å; Y83-F141 HydrophobicContact CD2-CD2 4.41Å; Y83-F141 HydrophobicContact CD2-CE1 4.16Å; Y83-F141 AromaticContact CD2-CE2 3.98Å; Y83-F141 HydrophobicContact CD2-CE2 3.98Å; Y83-F141 AromaticContact CD2-CZ 3.86Å; Y83-F141 HydrophobicContact CD2-CZ 3.86Å; Y83-F141 HydrophobicContact CG-CD2 4.38Å; Y83-F141 HydrophobicContact CG-CE2 4.07Å; Y83-F141 HydrophobicContact CG-CZ 4.41Å; Y83-F141 WeakPolarHBondContact O-CD2 3.5Å; N139-F141 PolarHBondContact O-N 2.73Å; F141-V143 HydrophobicContact CB-CG2 4.11Å; F141-V143 PolarHBondContact O-N 2.72Å; F141-C162 HydrophobicContact CE2-CB 4.17Å; F141-C162 WeakPolarHBondContact CE2-SG 3.42Å; F141-P180 HydrophobicContact CE1-CB 4.12Å; F141-P180 HydrophobicContact CE1-CG 4.49Å; F141-P180 HydrophobicContact CZ-CB 3.98Å; F141-V182 HydrophobicContact CE2-CG2 4.02Å; F141-V182 HydrophobicContact CZ-CG2 3.51Å
142	N	92.5	Very high	92.7	Very high	129 Å²	129	69.2 Å²	69.2	69%	0.69	36%	0.36	S	S	*	.			trans	52.9	32.7	178.9	-58.2	-37.4	0	0	0	115	N139	N139-N142 PolarHBondContact O-N 3.02Å; N139-N142 VanDerWaalsContact O-N 3.14Å; N139-N142 PolarHBondContact OD1-N 2.93Å
143	V	93.4	Very high	92.5	Very high	8 Å²	8	70 Å²	70	5%	0.048	36%	0.364	C	S	.	.			trans	-63.3	135.5	-178.7	-172.7	0	0	0	0	110.5	P82 R84 N139 F141 Q147 L148	P82-V143 HydrophobicContact CB-CG2 4.22Å; P82-V143 HydrophobicContact CG-CG1 4.42Å; R84-V143 HydrophobicContact CG-CB 4.29Å; R84-V143 HydrophobicContact CG-CG1 3.87Å; R84-V143 HydrophobicContact CG-CG2 4.24Å; N139-V143 PolarHBondContact ND2-N 3.03Å; N139-V143 VanDerWaalsContact ND2-N 3.19Å; N139-V143 PolarHBondContact ND2-O 2.78Å; N139-V143 PolarHBondContact OD1-N 2.92Å; F141-V143 HydrophobicContact CB-CG2 4.11Å; F141-V143 PolarHBondContact O-N 2.72Å; V143-Q147 HydrophobicContact CG1-CB 4.16Å; V143-Q147 HydrophobicContact CG1-CG 4.44Å; V143-Q147 VanDerWaalsContact CG1-OE1 3.29Å; V143-L148 HydrophobicContact CB-CD2 4.11Å; V143-L148 HydrophobicContact CG1-CD2 4.25Å
144	P	93.9	Very high	92.5	Very high	76 Å²	76	69.9 Å²	69.9	49%	0.494	36%	0.363	S	S	.	.			trans	-55.9	142.8	-178.2	-28.2	36.1	0	0	0	114	E146 Q147 L148	P144-E146 PolarHBondContact O-N 3.25Å; P144-E146 VanDerWaalsContact O-N 3.16Å; P144-Q147 PolarHBondContact O-N 2.89Å; P144-L148 PolarHBondContact O-N 3.09Å; P144-L148 VanDerWaalsContact O-N 3.11Å
145	K	92.6	Very high	92.6	Very high	116 Å²	116	70.9 Å²	70.9	50%	0.504	37%	0.369	S	S	.	.	H	α-helix	trans	-57.8	-34	-175.2	-179.7	-178.2	176.8	-174.3	0	112.1	I134 Q147 L148 M149	I134-K145 HydrophobicContact CD1-CG 4.16Å; K145-Q147 VanDerWaalsContact C-N 3.33Å; K145-Q147 PolarHBondContact O-N 3.3Å; K145-L148 WeakPolarHBondContact O-CB 3.47Å; K145-L148 PolarHBondContact O-N 3.03Å; K145-L148 VanDerWaalsContact O-N 3.17Å; K145-M149 VanDerWaalsContact O-CG 3.29Å; K145-M149 WeakPolarHBondContact O-CG 3.48Å; K145-M149 PolarHBondContact O-N 3.16Å
146	E	92.6	Very high	92.7	Very high	136 Å²	136	66.3 Å²	66.3	64%	0.636	34%	0.34	S	S	*	.	H	α-helix	trans	-64.1	-40.4	-178.9	-61.7	59.8	-126.9	0	0	110.3	P144 M149	P144-E146 PolarHBondContact O-N 3.25Å; P144-E146 VanDerWaalsContact O-N 3.16Å; E146-M149 PolarHBondContact O-N 3.45Å
147	Q	91.4	Very high	92.9	Very high	55 Å²	55	63.6 Å²	63.6	26%	0.257	33%	0.333	S	S	.	.	H	α-helix	trans	-78.4	-25	175.5	-161.9	-177.1	10.5	0	0	112.5	R84 V143 P144 K145	R84-Q147 WeakPolarHBondContact CD-O 3.19Å; R84-Q147 PolarHBondContact NH1-O 2.78Å; V143-Q147 HydrophobicContact CG1-CB 4.16Å; V143-Q147 HydrophobicContact CG1-CG 4.44Å; V143-Q147 VanDerWaalsContact CG1-OE1 3.29Å; P144-Q147 PolarHBondContact O-N 2.89Å; K145-Q147 VanDerWaalsContact C-N 3.33Å; K145-Q147 PolarHBondContact O-N 3.3Å
148	L	91.8	Very high	93.1	Very high	4 Å²	4	60.7 Å²	60.7	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-68.7	-35.5	170.2	-61.8	-174.4	0	0	0	112.1	R84 I130 I134 V143 P144 K145 Q150 Y154	R84-L148 HydrophobicContact CB-CD2 3.84Å; R84-L148 HydrophobicContact CG-CD2 3.61Å; I130-L148 HydrophobicContact CG2-CB 3.97Å; I134-L148 HydrophobicContact CD1-CB 4.15Å; I134-L148 HydrophobicContact CD1-CD1 4.14Å; I134-L148 HydrophobicContact CG1-CD1 3.74Å; V143-L148 HydrophobicContact CB-CD2 4.11Å; V143-L148 HydrophobicContact CG1-CD2 4.25Å; P144-L148 PolarHBondContact O-N 3.09Å; P144-L148 VanDerWaalsContact O-N 3.11Å; K145-L148 WeakPolarHBondContact O-CB 3.47Å; K145-L148 PolarHBondContact O-N 3.03Å; K145-L148 VanDerWaalsContact O-N 3.17Å; L148-Q150 PolarHBondContact O-N 3.42Å; L148-Y154 WeakPolarHBondContact CA-OH 3.37Å; L148-Y154 WeakPolarHBondContact O-CE2 3.44Å; L148-Y154 PolarHBondContact O-OH 2.67Å
149	M	93.1	Very high	93.4	Very high	59 Å²	59	60.3 Å²	60.3	29%	0.291	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-1.3	179.6	-65	-72.9	82.4	0	0	114.6	I130 L131 I134 K145 E146 T151	I130-M149 HydrophobicContact CB-CE 4.1Å; I130-M149 HydrophobicContact CG2-CE 3.54Å; L131-M149 HydrophobicContact CD2-CE 3.95Å; L131-M149 HydrophobicContact CD2-SD 3.76Å; L131-M149 HydrophobicContact CG-CE 4.09Å; L131-M149 HydrophobicContact CG-SD 4.32Å; I134-M149 HydrophobicContact CD1-CE 3.6Å; K145-M149 VanDerWaalsContact O-CG 3.29Å; K145-M149 WeakPolarHBondContact O-CG 3.48Å; K145-M149 PolarHBondContact O-N 3.16Å; E146-M149 PolarHBondContact O-N 3.45Å; M149-T151 PolarHBondContact O-N 2.67Å
150	Q	91.4	Very high	93.7	Very high	96 Å²	96	60.9 Å²	60.9	45%	0.449	30%	0.3	S	S	.	.			trans	-76.3	61	172.4	-65	170.2	1.5	0	0	110.8	L148 E152 E153 Y154	L148-Q150 PolarHBondContact O-N 3.42Å; Q150-E152 PolarHBondContact O-N 3.3Å; Q150-E152 VanDerWaalsContact O-N 3.08Å; Q150-E153 PolarHBondContact O-N 3.25Å; Q150-Y154 WeakPolarHBondContact O-CD2 3.45Å; Q150-Y154 WeakPolarHBondContact O-CE2 3.49Å
151	T	89.4	Confident	94.1	Very high	36 Å²	36	60.2 Å²	60.2	22%	0.221	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-60.3	-22.4	-170.6	53.3	0	0	0	0	114.2	R123 V126 K127 M149	R123-T151 PolarHBondContact NH1-O 3.1Å; V126-T151 HydrophobicContact CG1-CG2 4.3Å; K127-T151 HydrophobicContact CB-CG2 4.05Å; K127-T151 HydrophobicContact CG-CG2 4.3Å; M149-T151 PolarHBondContact O-N 2.67Å
152	E	89.6	Confident	94.3	Very high	166 Å²	166	56.9 Å²	56.9	78%	0.776	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-69.9	-30.6	179.9	-62.2	-169	174.6	0	0	112.9	R123 Q150 Y154	R123-E152 PolarHBondContact NH1-O 3.31Å; R123-E152 PolarHBondContact NH2-O 3.23Å; Q150-E152 PolarHBondContact O-N 3.3Å; Q150-E152 VanDerWaalsContact O-N 3.08Å; E152-Y154 VanDerWaalsContact C-N 3.32Å; E152-Y154 PolarHBondContact O-N 2.91Å
153	E	92.3	Very high	94.6	Very high	113 Å²	113	51 Å²	51	53%	0.528	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-77.8	-12.9	-173.7	-149.8	-156.7	133.8	0	0	114.1	R84 Q150 D155	R84-E153 IonicContact CZ-OE1 2.81Å; R84-E153 IonicContact CZ-OE2 3.14Å; R84-E153 VanDerWaalsContact CZ-OE2 3.24Å; R84-E153 IonicContact NH1-OE2 2.7Å; R84-E153 PolarHBondContact NH1-OE2 3.02Å; R84-E153 IonicContact NH2-OE1 3.25Å; R84-E153 PolarHBondContact NH2-OE1 3.49Å; R84-E153 IonicContact NH2-OE2 2.78Å; R84-E153 PolarHBondContact NH2-OE2 2.8Å; Q150-E153 PolarHBondContact O-N 3.25Å; E153-D155 PolarHBondContact O-N 3.16Å
154	Y	95.5	Very high	94.7	Very high	6 Å²	6	52 Å²	52	2%	0.024	25%	0.254	C	S	.	.			trans	-74.6	107.7	-176.8	-70.5	-98.1	0	0	0	112.2	T78 R84 P85 P87 I130 L148 Q150 E152 L156	T78-Y154 HydrophobicContact CG2-CD1 3.82Å; T78-Y154 HydrophobicContact CG2-CE1 3.94Å; R84-Y154 HydrophobicContact CB-CE1 4.08Å; P85-Y154 WeakPolarHBondContact O-CE1 3.32Å; P87-Y154 HydrophobicContact CG-CD1 4.39Å; I130-Y154 HydrophobicContact CD1-CE1 3.78Å; I130-Y154 HydrophobicContact CG1-CE1 4.46Å; I130-Y154 HydrophobicContact CG1-CE2 4.37Å; L148-Y154 WeakPolarHBondContact CA-OH 3.37Å; L148-Y154 WeakPolarHBondContact O-CE2 3.44Å; L148-Y154 PolarHBondContact O-OH 2.67Å; Q150-Y154 WeakPolarHBondContact O-CD2 3.45Å; Q150-Y154 WeakPolarHBondContact O-CE2 3.49Å; E152-Y154 VanDerWaalsContact C-N 3.32Å; E152-Y154 PolarHBondContact O-N 2.91Å; Y154-L156 PolarHBondContact O-N 2.79Å
155	D	96.4	Very high	94.8	Very high	69 Å²	69	48.4 Å²	48.4	37%	0.369	23%	0.23	S	C	.	.			trans	-67.3	114.9	166	-173.8	2.5	0	0	0	110.3	H86 E153 N157 V158	H86-D155 PolarHBondContact NE2-O 2.87Å; E153-D155 PolarHBondContact O-N 3.16Å; D155-N157 VanDerWaalsContact C-N 3.29Å; D155-N157 WeakPolarHBondContact OD1-CB 3.36Å; D155-N157 PolarHBondContact OD1-N 2.93Å; D155-N157 PolarHBondContact OD1-ND2 2.89Å; D155-V158 HydrophobicContact CB-CG1 4.05Å; D155-V158 WeakPolarHBondContact OD2-CG1 3.46Å
156	L	97.2	Very high	94.9	Very high	29 Å²	29	44.4 Å²	44.4	15%	0.152	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-5.7	-179.8	-57.6	-176.1	0	0	0	112.9	H86 P87 H88 R123 V126 Y154	H86-L156 VanDerWaalsContact CE1-CA 3.49Å; H86-L156 WeakPolarHBondContact CE1-CA 3.19Å; P87-L156 HydrophobicContact CG-CD2 3.66Å; H88-L156 PolarHBondContact NE2-O 3.29Å; R123-L156 HydrophobicContact CB-CD1 4.45Å; V126-L156 HydrophobicContact CG2-CD1 3.92Å; V126-L156 HydrophobicContact CG2-CD2 3.82Å; V126-L156 HydrophobicContact CG2-CG 4.47Å; Y154-L156 PolarHBondContact O-N 2.79Å
157	N	97.1	Very high	94.9	Very high	46 Å²	46	37.9 Å²	37.9	25%	0.246	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-1.2	-177.4	-46.7	-75.2	0	0	0	112.8	D155 Y187 D188 A191 T194	D155-N157 VanDerWaalsContact C-N 3.29Å; D155-N157 WeakPolarHBondContact OD1-CB 3.36Å; D155-N157 PolarHBondContact OD1-N 2.93Å; D155-N157 PolarHBondContact OD1-ND2 2.89Å; N157-Y187 CarbonylContact O-C 3.59Å; N157-Y187 WeakPolarHBondContact O-CA 3.4Å; N157-D188 PolarHBondContact O-N 2.81Å; N157-A191 HydrophobicContact CB-CB 4.2Å; N157-A191 WeakPolarHBondContact OD1-CB 3.35Å; N157-T194 HydrophobicContact CB-CG2 3.83Å
158	V	97.8	Very high	95	Very high	2 Å²	2	38 Å²	38	1%	0.012	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	141.7	180	65.5	0	0	0	0	112.4	K79 H86 D155 P185 I186 Y187	K79-V158 HydrophobicContact CB-CG1 3.73Å; K79-V158 HydrophobicContact CB-CG2 4.04Å; K79-V158 HydrophobicContact CD-CG1 4.08Å; K79-V158 HydrophobicContact CD-CG2 4.1Å; K79-V158 HydrophobicContact CG-CG1 4.45Å; K79-V158 HydrophobicContact CG-CG2 4.26Å; H86-V158 PolarHBondContact NE2-O 3.03Å; D155-V158 HydrophobicContact CB-CG1 4.05Å; D155-V158 WeakPolarHBondContact OD2-CG1 3.46Å; V158-P185 HydrophobicContact CG2-CB 3.69Å; V158-I186 WeakPolarHBondContact CA-O 3.36Å; V158-I186 WeakPolarHBondContact CG2-O 3.43Å; V158-Y187 HydrophobicContact CB-CD1 3.73Å; V158-Y187 HydrophobicContact CB-CE1 3.92Å; V158-Y187 HydrophobicContact CG2-CD1 3.54Å; V158-Y187 HydrophobicContact CG2-CE1 3.49Å; V158-Y187 VanDerWaalsContact CG2-CE1 3.49Å; V158-Y187 HydrophobicContact CG2-CG 4.19Å
159	V	98.2	Very high	94.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	164.1	171.9	-55	0	0	0	0	110.4	F34 L76 H86 I118 P185 I186	F34-V159 HydrophobicContact CE2-CG1 4.17Å; F34-V159 HydrophobicContact CZ-CG1 4.31Å; F34-V159 HydrophobicContact CZ-CG2 4.02Å; L76-V159 HydrophobicContact CD1-CG1 4.49Å; L76-V159 HydrophobicContact CD2-CB 4.34Å; L76-V159 HydrophobicContact CD2-CG2 3.98Å; H86-V159 HydrophobicContact CB-CG1 4.49Å; I118-V159 HydrophobicContact CD1-CG2 3.74Å; V159-P185 CarbonylContact O-C 3.52Å; V159-P185 WeakPolarHBondContact O-CA 3.46Å; V159-I186 HydrophobicContact CG2-CB 4.06Å; V159-I186 PolarHBondContact N-O 2.71Å; V159-I186 PolarHBondContact O-N 2.78Å
160	R	98.5	Very high	94.6	Very high	49 Å²	49	46.7 Å²	46.7	19%	0.185	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	154.2	158.7	-67.2	176	-178.9	-104.2	16.1	109.6	V77 K79 V182 T183 P185	V77-R160 HydrophobicContact CG2-CB 3.98Å; V77-R160 PolarHBondContact N-O 3.19Å; V77-R160 PolarHBondContact O-N 3.14Å; K79-R160 PolarHBondContact O-NE 3.17Å; K79-R160 PolarHBondContact O-NH2 2.77Å; R160-V182 HydrophobicContact CB-CG1 3.55Å; R160-V182 VanDerWaalsContact CD-CG1 3.48Å; R160-V182 HydrophobicContact CG-CG1 4.14Å; R160-T183 WeakPolarHBondContact CD-O 3.49Å; R160-T183 WeakPolarHBondContact CG-O 3.15Å; R160-T183 PolarHBondContact NH1-O 2.95Å; R160-P185 HydrophobicContact CG-CB 4.13Å
161	L	98.4	Very high	94.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	124.2	168.2	-49	-177.2	0	0	0	108.3	I46 P59 V74 Y75 L76 V182 T183 I186	I46-L161 HydrophobicContact CD1-CD1 4.21Å; I46-L161 HydrophobicContact CD1-CD2 4.01Å; P59-L161 HydrophobicContact CB-CD1 4.27Å; P59-L161 HydrophobicContact CG-CD1 4.46Å; V74-L161 HydrophobicContact CG1-CB 3.82Å; V74-L161 HydrophobicContact CG1-CD1 4.39Å; V74-L161 HydrophobicContact CG1-CD2 4.36Å; V74-L161 HydrophobicContact CG1-CG 4.41Å; Y75-L161 CarbonylContact O-C 3.47Å; Y75-L161 WeakPolarHBondContact O-CA 3.48Å; L76-L161 HydrophobicContact CD2-CD2 3.47Å; L76-L161 VanDerWaalsContact CD2-CD2 3.47Å; L161-V182 WeakPolarHBondContact O-CA 3.43Å; L161-T183 HydrophobicContact CB-CG2 3.76Å; L161-T183 WeakPolarHBondContact CB-OG1 3.34Å; L161-T183 HydrophobicContact CD1-CG2 4.35Å; L161-T183 HydrophobicContact CG-CG2 4.34Å; L161-T183 PolarHBondContact N-OG1 3.14Å; L161-T183 PolarHBondContact O-N 3.42Å; L161-T183 PolarHBondContact O-OG1 2.96Å; L161-I186 HydrophobicContact CD1-CD1 4.26Å; L161-I186 HydrophobicContact CD2-CD1 3.91Å; L161-I186 HydrophobicContact CG-CD1 3.91Å
162	C	97.8	Very high	94.2	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120.7	166.9	174.8	0	0	0	0	108.6	V74 Y75 V77 P140 F141	V74-C162 WeakPolarHBondContact CA-O 3.4Å; Y75-C162 PolarHBondContact N-O 2.96Å; Y75-C162 PolarHBondContact O-N 3Å; V77-C162 HydrophobicContact CB-CB 4.45Å; V77-C162 HydrophobicContact CG1-CB 3.67Å; V77-C162 HydrophobicContact CG2-CB 3.89Å; P140-C162 HydrophobicContact CG-CB 4.49Å; F141-C162 HydrophobicContact CE2-CB 4.17Å; F141-C162 WeakPolarHBondContact CE2-SG 3.42Å
163	I	97.5	Very high	94.3	Very high	5 Å²	5	44.9 Å²	44.9	3%	0.026	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.9	-174.5	-52	167.3	0	0	0	108.5	L61 V72 R73 V74 F113 P180 I181 T183	L61-I163 HydrophobicContact CD1-CD1 4.18Å; L61-I163 HydrophobicContact CD1-CG2 4.03Å; L61-I163 HydrophobicContact CD2-CG2 3.89Å; L61-I163 HydrophobicContact CG-CG2 4.5Å; V72-I163 HydrophobicContact CG2-CG2 3.78Å; R73-I163 WeakPolarHBondContact O-CA 3.32Å; V74-I163 HydrophobicContact CG1-CG1 4.21Å; V74-I163 HydrophobicContact CG2-CG1 4.18Å; V74-I163 HydrophobicContact CG2-CG2 4.29Å; F113-I163 HydrophobicContact CE2-CD1 3.9Å; F113-I163 HydrophobicContact CE2-CG1 4.48Å; F113-I163 HydrophobicContact CZ-CD1 4.47Å; F113-I163 HydrophobicContact CZ-CG2 4.16Å; I163-P180 WeakPolarHBondContact O-CA 3.35Å; I163-I181 HydrophobicContact CB-CG1 4.09Å; I163-I181 PolarHBondContact N-O 2.98Å; I163-I181 PolarHBondContact O-N 3.39Å; I163-T183 HydrophobicContact CD1-CG2 3.97Å
164	Q	95.6	Very high	94.2	Very high	29 Å²	29	41.8 Å²	41.8	14%	0.136	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.7	174.2	-68.6	-171.9	-17.9	0	0	110	V72 R73 Y75 P140 F166 P180	V72-Q164 WeakPolarHBondContact CA-O 3.07Å; R73-Q164 PolarHBondContact N-O 2.87Å; R73-Q164 PolarHBondContact O-N 3.3Å; Y75-Q164 HydrophobicContact CE2-CB 4.49Å; Y75-Q164 HydrophobicContact CE2-CG 4.27Å; P140-Q164 PolarHBondContact O-NE2 2.94Å; Q164-F166 HydrophobicContact CB-CE2 3.85Å; Q164-F166 HydrophobicContact CB-CZ 4.28Å; Q164-P180 HydrophobicContact CG-CB 3.86Å; Q164-P180 HydrophobicContact CG-CG 3.98Å
165	V	95.6	Very high	93.9	Very high	1 Å²	1	46 Å²	46	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	138.5	176.3	170.5	0	0	0	0	110	V21 L61 I63 V72 F104 L167 R177 L178	V21-V165 HydrophobicContact CG1-CB 4.11Å; V21-V165 HydrophobicContact CG1-CG2 3.83Å; L61-V165 HydrophobicContact CD2-CG2 3.5Å; I63-V165 HydrophobicContact CD1-CG1 4.22Å; V72-V165 HydrophobicContact CB-CG2 4.25Å; V72-V165 HydrophobicContact CG2-CG2 4.03Å; F104-V165 HydrophobicContact CE1-CG1 4.14Å; F104-V165 HydrophobicContact CZ-CG1 4.06Å; V165-L167 HydrophobicContact CG1-CD2 3.56Å; V165-L167 HydrophobicContact CG1-CG 4.39Å; V165-R177 CarbonylContact O-C 3.52Å; V165-R177 WeakPolarHBondContact O-CA 3.34Å; V165-L178 HydrophobicContact CB-CB 4.44Å; V165-L178 HydrophobicContact CB-CD1 4.2Å; V165-L178 HydrophobicContact CB-CG 4.46Å; V165-L178 HydrophobicContact CG1-CD1 3.97Å; V165-L178 HydrophobicContact CG1-CG 4.4Å; V165-L178 PolarHBondContact O-N 3.48Å
166	F	95	Very high	93.7	Very high	31 Å²	31	48.1 Å²	48.1	14%	0.136	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	113	176.9	-57.3	-97.2	0	0	0	107.5	G70 K71 R73 Q164 R177	G70-F166 CarbonylContact C-O 3.54Å; G70-F166 VanDerWaalsContact CA-O 3.29Å; G70-F166 WeakPolarHBondContact CA-O 3.5Å; K71-F166 PolarHBondContact N-O 2.88Å; K71-F166 PolarHBondContact O-N 3.36Å; R73-F166 HydrophobicContact CB-CE2 4.43Å; R73-F166 HydrophobicContact CG-CD2 4.49Å; R73-F166 HydrophobicContact CG-CE2 4.06Å; Q164-F166 HydrophobicContact CB-CE2 3.85Å; Q164-F166 HydrophobicContact CB-CZ 4.28Å; F166-R177 HydrophobicContact CD1-CB 3.94Å; F166-R177 HydrophobicContact CE1-CB 3.93Å
167	L	93.9	Very high	93.4	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	151.9	-179.8	-52.9	-178.2	0	0	0	110.3	P19 Y66 F104 V165 R176 L178	P19-L167 HydrophobicContact CB-CD1 3.53Å; P19-L167 HydrophobicContact CG-CD1 4.02Å; Y66-L167 HydrophobicContact CD1-CD1 4.43Å; Y66-L167 HydrophobicContact CD1-CD2 3.75Å; Y66-L167 HydrophobicContact CD2-CD1 3.77Å; Y66-L167 HydrophobicContact CE1-CB 4.25Å; Y66-L167 HydrophobicContact CE1-CD2 3.76Å; Y66-L167 HydrophobicContact CE1-CG 4.4Å; Y66-L167 HydrophobicContact CE2-CB 4.09Å; Y66-L167 HydrophobicContact CE2-CD1 3.93Å; Y66-L167 HydrophobicContact CE2-CG 4.42Å; Y66-L167 HydrophobicContact CG-CD1 4.02Å; Y66-L167 HydrophobicContact CG-CD2 4.14Å; F104-L167 HydrophobicContact CZ-CD2 4.19Å; V165-L167 HydrophobicContact CG1-CD2 3.56Å; V165-L167 HydrophobicContact CG1-CG 4.39Å; L167-R176 HydrophobicContact CB-CB 4.2Å; L167-R176 HydrophobicContact CB-CG 4.49Å; L167-R176 PolarHBondContact N-O 2.93Å; L167-L178 HydrophobicContact CD1-CD1 4.1Å; L167-L178 HydrophobicContact CD1-CD2 3.89Å; L167-L178 HydrophobicContact CD1-CG 4.18Å; L167-L178 HydrophobicContact CD2-CD1 4.16Å; L167-L178 HydrophobicContact CG-CD1 4.19Å; L167-L178 HydrophobicContact CG-CD2 4.33Å; L167-L178 HydrophobicContact CG-CG 4.16Å
168	Q	93.3	Very high	93.2	Very high	58 Å²	58	54.5 Å²	54.5	27%	0.271	26%	0.263	S	S	.	.			trans	-70.8	133.4	173	-175.4	160.6	64.1	0	0	110.4	Y66 K69 G172 H173 Y174	Y66-Q168 PolarHBondContact OH-N 2.89Å; Y66-Q168 PolarHBondContact OH-O 3.4Å; K69-Q168 HydrophobicContact CB-CB 4.26Å; K69-Q168 WeakPolarHBondContact O-CB 3.47Å; K69-Q168 PolarHBondContact O-N 2.85Å; Q168-G172 PolarHBondContact NE2-O 2.89Å; Q168-H173 CarbonylContact C-O 3.57Å; Q168-H173 WeakPolarHBondContact CA-O 3.49Å; Q168-Y174 HydrophobicContact CB-CD1 4.05Å; Q168-Y174 HydrophobicContact CB-CE1 3.91Å
169	D	88.7	Confident	92.9	Very high	39 Å²	39	61 Å²	61	21%	0.209	30%	0.297	C	S	.	.			trans	-90.9	174.4	170.7	64.5	50.1	0	0	0	112.4	T171 G172 H173 T175	D169-T171 PolarHBondContact O-N 2.77Å; D169-T171 WeakPolarHBondContact OD1-CA 3.37Å; D169-T171 WeakPolarHBondContact OD1-CB 3.23Å; D169-T171 PolarHBondContact OD1-N 3.04Å; D169-T171 PolarHBondContact OD1-OG1 3.22Å; D169-G172 PolarHBondContact O-N 2.67Å; D169-G172 PolarHBondContact OD1-N 3.14Å; D169-H173 PolarHBondContact N-O 3.47Å; D169-H173 PolarHBondContact OD1-N 2.95Å; D169-H173 WeakPolarHBondContact OD2-CB 3.38Å; D169-T175 WeakPolarHBondContact OD2-CB 3.1Å; D169-T175 WeakPolarHBondContact OD2-CG2 3.38Å; D169-T175 PolarHBondContact OD2-OG1 2.71Å
170	E	87.4	Confident	92.7	Very high	206 Å²	206	63 Å²	63	96%	0.963	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-24	-178.6	-64.7	170.6	-164.3	0	0	113.7	G172	E170-G172 VanDerWaalsContact C-N 3.28Å
171	T	87.8	Confident	92.6	Very high	104 Å²	104	62.4 Å²	62.4	64%	0.638	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-1.1	175.9	75.6	0	0	0	0	112.9	D169 H173	D169-T171 PolarHBondContact O-N 2.77Å; D169-T171 WeakPolarHBondContact OD1-CA 3.37Å; D169-T171 WeakPolarHBondContact OD1-CB 3.23Å; D169-T171 PolarHBondContact OD1-N 3.04Å; D169-T171 PolarHBondContact OD1-OG1 3.22Å; T171-H173 PolarHBondContact OG1-ND1 3.16Å
172	G	85.8	Confident	92.5	Very high	35 Å²	35	63.9 Å²	63.9	36%	0.361	32%	0.32	S	S	.	.	S	Bend	trans	86.4	1	-177.7	0	0	0	0	0	114.7	Q168 D169 E170	Q168-G172 PolarHBondContact NE2-O 2.89Å; D169-G172 PolarHBondContact O-N 2.67Å; D169-G172 PolarHBondContact OD1-N 3.14Å; E170-G172 VanDerWaalsContact C-N 3.28Å
173	H	89.7	Confident	92.6	Very high	120 Å²	120	64 Å²	64	56%	0.556	32%	0.32	S	S	*	.			trans	-89.4	157.7	-179	-63.9	94.7	0	0	0	111.9	Q168 D169 T171 T175	Q168-H173 CarbonylContact C-O 3.57Å; Q168-H173 WeakPolarHBondContact CA-O 3.49Å; D169-H173 PolarHBondContact N-O 3.47Å; D169-H173 PolarHBondContact OD1-N 2.95Å; D169-H173 WeakPolarHBondContact OD2-CB 3.38Å; T171-H173 PolarHBondContact OG1-ND1 3.16Å; H173-T175 HydrophobicContact CB-CG2 4Å; H173-T175 PolarHBondContact O-N 3.4Å
174	Y	91.7	Very high	92.6	Very high	49 Å²	49	65.8 Å²	65.8	19%	0.192	33%	0.33	C	S	.	.			trans	-93.9	60.8	179.9	-61.6	-60.6	0	0	0	111.5	K69 G70 K71 E103 Q168	K69-Y174 HydrophobicContact CB-CE1 4.37Å; G70-Y174 VanDerWaalsContact CA-CE1 3.47Å; K71-Y174 HydrophobicContact CB-CD1 4.25Å; K71-Y174 HydrophobicContact CB-CD2 4.14Å; K71-Y174 HydrophobicContact CB-CE2 4.42Å; K71-Y174 HydrophobicContact CB-CG 4.04Å; K71-Y174 HydrophobicContact CD-CD2 4.19Å; E103-Y174 HydrophobicContact CG-CE2 4.06Å; E103-Y174 WeakPolarHBondContact OE1-CE2 3.35Å; E103-Y174 WeakPolarHBondContact OE2-CE2 3.39Å; E103-Y174 PolarHBondContact OE2-OH 3.01Å; Q168-Y174 HydrophobicContact CB-CD1 4.05Å; Q168-Y174 HydrophobicContact CB-CE1 3.91Å
175	T	89.3	Confident	92.7	Very high	95 Å²	95	64.8 Å²	64.8	58%	0.583	33%	0.326	S	S	*	.			trans	-91.5	-33.6	-174.6	62.4	0	0	0	0	114.2	D169 H173 R177	D169-T175 WeakPolarHBondContact OD2-CB 3.1Å; D169-T175 WeakPolarHBondContact OD2-CG2 3.38Å; D169-T175 PolarHBondContact OD2-OG1 2.71Å; H173-T175 HydrophobicContact CB-CG2 4Å; H173-T175 PolarHBondContact O-N 3.4Å; T175-R177 PolarHBondContact O-N 3.42Å
176	R	91.3	Very high	92.8	Very high	113 Å²	113	64.8 Å²	64.8	43%	0.426	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	85.1	-175.3	-175.7	178.3	-175.4	174.2	6.7	111.1	L167	L167-R176 HydrophobicContact CB-CB 4.2Å; L167-R176 HydrophobicContact CB-CG 4.49Å; L167-R176 PolarHBondContact N-O 2.93Å
177	R	91.9	Very high	93	Very high	188 Å²	188	64.1 Å²	64.1	71%	0.709	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.5	141.7	172.2	67.9	179.9	-177.8	169	0.5	111.5	V165 F166 T175	V165-R177 CarbonylContact O-C 3.52Å; V165-R177 WeakPolarHBondContact O-CA 3.34Å; F166-R177 HydrophobicContact CD1-CB 3.94Å; F166-R177 HydrophobicContact CE1-CB 3.93Å; T175-R177 PolarHBondContact O-N 3.42Å
178	L	92.9	Very high	93.1	Very high	21 Å²	21	64.8 Å²	64.8	11%	0.11	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-99.8	164.8	166.1	-57.9	-174.4	0	0	0	110.5	P19 V21 V165 L167	P19-L178 HydrophobicContact CB-CD1 4.49Å; P19-L178 HydrophobicContact CB-CD2 4.19Å; P19-L178 WeakPolarHBondContact O-CD2 3.27Å; V21-L178 HydrophobicContact CG1-CD1 3.75Å; V21-L178 HydrophobicContact CG2-CB 4.46Å; V165-L178 HydrophobicContact CB-CB 4.44Å; V165-L178 HydrophobicContact CB-CD1 4.2Å; V165-L178 HydrophobicContact CB-CG 4.46Å; V165-L178 HydrophobicContact CG1-CD1 3.97Å; V165-L178 HydrophobicContact CG1-CG 4.4Å; V165-L178 PolarHBondContact O-N 3.48Å; L167-L178 HydrophobicContact CD1-CD1 4.1Å; L167-L178 HydrophobicContact CD1-CD2 3.89Å; L167-L178 HydrophobicContact CD1-CG 4.18Å; L167-L178 HydrophobicContact CD2-CD1 4.16Å; L167-L178 HydrophobicContact CG-CD1 4.19Å; L167-L178 HydrophobicContact CG-CD2 4.33Å; L167-L178 HydrophobicContact CG-CG 4.16Å
179	N	90.9	Very high	93.3	Very high	137 Å²	137	64.4 Å²	64.4	73%	0.733	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-59.9	133.1	178.3	-72.4	-21	0	0	0	111
180	P	93.6	Very high	93.5	Very high	44 Å²	44	70.3 Å²	70.3	29%	0.286	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-63.7	135.7	175.6	-17.6	30.3	0	0	0	110.8	F141 I163 Q164	F141-P180 HydrophobicContact CE1-CB 4.12Å; F141-P180 HydrophobicContact CE1-CG 4.49Å; F141-P180 HydrophobicContact CZ-CB 3.98Å; I163-P180 WeakPolarHBondContact O-CA 3.35Å; Q164-P180 HydrophobicContact CG-CB 3.86Å; Q164-P180 HydrophobicContact CG-CG 3.98Å
181	I	96	Very high	93.8	Very high	36 Å²	36	61 Å²	61	19%	0.185	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	146.9	173.7	69.6	177.1	0	0	0	110.6	V21 I23 L61 I163	V21-I181 HydrophobicContact CB-CD1 4.2Å; V21-I181 HydrophobicContact CG2-CD1 4.21Å; V21-I181 HydrophobicContact CG2-CG2 3.89Å; I23-I181 HydrophobicContact CG1-CD1 3.72Å; I23-I181 HydrophobicContact CG1-CG1 4.42Å; L61-I181 HydrophobicContact CD1-CD1 3.49Å; L61-I181 VanDerWaalsContact CD1-CD1 3.49Å; L61-I181 HydrophobicContact CD1-CG1 4.35Å; I163-I181 HydrophobicContact CB-CG1 4.09Å; I163-I181 PolarHBondContact N-O 2.98Å; I163-I181 PolarHBondContact O-N 3.39Å
182	V	97.8	Very high	93.9	Very high	31 Å²	31	57.6 Å²	57.6	19%	0.188	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	132.9	-173.7	-166.2	0	0	0	0	110.3	V77 Y83 F141 R160 L161	V77-V182 HydrophobicContact CG2-CG1 4Å; Y83-V182 HydrophobicContact CD1-CG1 4.43Å; Y83-V182 HydrophobicContact CD2-CG2 3.98Å; Y83-V182 HydrophobicContact CE1-CG1 4.25Å; Y83-V182 HydrophobicContact CE2-CG2 3.99Å; Y83-V182 HydrophobicContact CG-CG2 4.39Å; F141-V182 HydrophobicContact CE2-CG2 4.02Å; F141-V182 HydrophobicContact CZ-CG2 3.51Å; R160-V182 HydrophobicContact CB-CG1 3.55Å; R160-V182 VanDerWaalsContact CD-CG1 3.48Å; R160-V182 HydrophobicContact CG-CG1 4.14Å; L161-V182 WeakPolarHBondContact O-CA 3.43Å
183	T	98.3	Very high	94.3	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.012	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-77.2	171.2	-179.5	66.4	0	0	0	0	113.3	I23 P27 R160 L161 I163	I23-T183 HydrophobicContact CD1-CG2 3.96Å; P27-T183 HydrophobicContact CG-CG2 4.42Å; R160-T183 WeakPolarHBondContact CD-O 3.49Å; R160-T183 WeakPolarHBondContact CG-O 3.15Å; R160-T183 PolarHBondContact NH1-O 2.95Å; L161-T183 HydrophobicContact CB-CG2 3.76Å; L161-T183 WeakPolarHBondContact CB-OG1 3.34Å; L161-T183 HydrophobicContact CD1-CG2 4.35Å; L161-T183 HydrophobicContact CG-CG2 4.34Å; L161-T183 PolarHBondContact N-OG1 3.14Å; L161-T183 PolarHBondContact O-N 3.42Å; L161-T183 PolarHBondContact O-OG1 2.96Å; I163-T183 HydrophobicContact CD1-CG2 3.97Å
184	N	98.2	Very high	94.5	Very high	42 Å²	42	53.1 Å²	53.1	23%	0.225	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-51	149.7	159.1	-73.8	-9.8	0	0	0	111.1	Q26 Q29 E49	Q26-N184 HydrophobicContact CB-CB 4.45Å; Q26-N184 VanDerWaalsContact CD-CG 3.49Å; Q26-N184 HydrophobicContact CG-CB 4.49Å; Q26-N184 WeakPolarHBondContact CG-ND2 3.29Å; Q29-N184 HydrophobicContact CG-CB 3.98Å; E49-N184 PolarHBondContact OE1-ND2 2.81Å
185	P	98	Very high	94.7	Very high	9 Å²	9	51.3 Å²	51.3	6%	0.058	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-70.4	139.9	-179.6	29.2	-33.7	0	0	0	111.9	Q29 K79 V158 V159 R160 Y187	Q29-P185 VanDerWaalsContact CA-O 3.32Å; Q29-P185 WeakPolarHBondContact CA-O 3.36Å; Q29-P185 VanDerWaalsContact CB-O 3.23Å; Q29-P185 WeakPolarHBondContact CB-O 3.15Å; Q29-P185 VanDerWaalsContact CG-O 3.28Å; Q29-P185 WeakPolarHBondContact CG-O 3.28Å; K79-P185 HydrophobicContact CG-CB 4.35Å; V158-P185 HydrophobicContact CG2-CB 3.69Å; V159-P185 CarbonylContact O-C 3.52Å; V159-P185 WeakPolarHBondContact O-CA 3.46Å; R160-P185 HydrophobicContact CG-CB 4.13Å; P185-Y187 HydrophobicContact CB-CE2 3.99Å; P185-Y187 HydrophobicContact CG-CE2 3.7Å
186	I	98.4	Very high	95	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	125.9	173.1	-48.8	173.7	0	0	0	107.2	P27 M32 F34 I46 I118 V158 V159 L161	P27-I186 HydrophobicContact CB-CD1 3.67Å; P27-I186 HydrophobicContact CB-CG1 3.76Å; P27-I186 HydrophobicContact CG-CD1 3.9Å; P27-I186 HydrophobicContact CG-CG1 3.71Å; M32-I186 HydrophobicContact CB-CG2 4.44Å; M32-I186 HydrophobicContact SD-CG2 4.11Å; F34-I186 HydrophobicContact CE1-CG2 4.03Å; F34-I186 HydrophobicContact CZ-CG2 4.48Å; I46-I186 HydrophobicContact CD1-CD1 3.98Å; I46-I186 HydrophobicContact CG1-CD1 4.18Å; I46-I186 HydrophobicContact CG2-CD1 3.74Å; I118-I186 HydrophobicContact CD1-CD1 4.25Å; I118-I186 HydrophobicContact CD1-CG2 4.23Å; V158-I186 WeakPolarHBondContact CA-O 3.36Å; V158-I186 WeakPolarHBondContact CG2-O 3.43Å; V159-I186 HydrophobicContact CG2-CB 4.06Å; V159-I186 PolarHBondContact N-O 2.71Å; V159-I186 PolarHBondContact O-N 2.78Å; L161-I186 HydrophobicContact CD1-CD1 4.26Å; L161-I186 HydrophobicContact CD2-CD1 3.91Å; L161-I186 HydrophobicContact CG-CD1 3.91Å
187	Y	97.8	Very high	95.3	Very high	18 Å²	18	44.9 Å²	44.9	7%	0.071	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	140.5	-174.3	-68.7	-79.3	0	0	0	111.5	Q29 M32 K79 N157 V158 P185 N189 T194	Q29-Y187 HydrophobicContact CB-CD2 4.23Å; Q29-Y187 HydrophobicContact CB-CE2 4.49Å; Q29-Y187 WeakPolarHBondContact O-CB 3.35Å; Q29-Y187 WeakPolarHBondContact O-CD2 3.43Å; Q29-Y187 PolarHBondContact O-N 3.1Å; M32-Y187 VanDerWaalsContact O-O 3.12Å; K79-Y187 HydrophobicContact CD-CE1 4.45Å; K79-Y187 WeakPolarHBondContact CE-OH 3.42Å; K79-Y187 PolarHBondContact NZ-OH 3.01Å; N157-Y187 CarbonylContact O-C 3.59Å; N157-Y187 WeakPolarHBondContact O-CA 3.4Å; V158-Y187 HydrophobicContact CB-CD1 3.73Å; V158-Y187 HydrophobicContact CB-CE1 3.92Å; V158-Y187 HydrophobicContact CG2-CD1 3.54Å; V158-Y187 HydrophobicContact CG2-CE1 3.49Å; V158-Y187 VanDerWaalsContact CG2-CE1 3.49Å; V158-Y187 HydrophobicContact CG2-CG 4.19Å; P185-Y187 HydrophobicContact CB-CE2 3.99Å; P185-Y187 HydrophobicContact CG-CE2 3.7Å; Y187-N189 PolarHBondContact O-N 3.27Å; Y187-T194 HydrophobicContact CD1-CG2 3.85Å
188	D	97.3	Very high	95.6	Very high	13 Å²	13	42.3 Å²	42.3	7%	0.07	21%	0.209	C	C	.	.			trans	-74.2	115.3	177.8	-169.6	3.5	0	0	0	111.3	R33 F34 N157 R190 A191 T194	R33-D188 WeakPolarHBondContact CA-OD1 3.49Å; F34-D188 HydrophobicContact CB-CB 4.43Å; F34-D188 HydrophobicContact CD1-CB 4.32Å; F34-D188 HydrophobicContact CD2-CB 3.62Å; F34-D188 HydrophobicContact CE1-CB 4.47Å; F34-D188 HydrophobicContact CE2-CB 3.82Å; F34-D188 HydrophobicContact CG-CB 3.88Å; F34-D188 HydrophobicContact CZ-CB 4.24Å; F34-D188 PolarHBondContact N-OD1 3.31Å; N157-D188 PolarHBondContact O-N 2.81Å; D188-R190 PolarHBondContact O-N 3.35Å; D188-R190 VanDerWaalsContact O-N 3.11Å; D188-R190 WeakPolarHBondContact OD1-CB 3.39Å; D188-R190 PolarHBondContact OD1-N 2.75Å; D188-R190 WeakPolarHBondContact OD2-CB 3.4Å; D188-A191 PolarHBondContact O-N 2.68Å; D188-T194 PolarHBondContact O-OG1 3.12Å
189	N	96.2	Very high	95.8	Very high	51 Å²	51	42.6 Å²	42.6	27%	0.273	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	2.6	174.1	-157.1	25.2	0	0	0	113.9	G31 M32 R33 Y187 A195 E196	G31-N189 WeakPolarHBondContact CA-ND2 3.42Å; G31-N189 WeakPolarHBondContact O-CB 3.44Å; G31-N189 PolarHBondContact O-ND2 3.24Å; M32-N189 VanDerWaalsContact O-CB 3.23Å; M32-N189 WeakPolarHBondContact O-CB 3.42Å; M32-N189 PolarHBondContact O-N 3.14Å; R33-N189 HydrophobicContact CB-CB 4.43Å; Y187-N189 PolarHBondContact O-N 3.27Å; N189-A195 WeakPolarHBondContact OD1-CA 3.44Å; N189-A195 WeakPolarHBondContact OD1-CB 3.49Å; N189-E196 PolarHBondContact OD1-N 3.19Å
190	R	94.2	Very high	96.2	Very high	163 Å²	163	38.8 Å²	38.8	62%	0.615	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-23.5	170.5	-169.1	53.1	170.2	-175.5	-0.9	113.8	R33 D188	R33-R190 HydrophobicContact CG-CB 4.16Å; D188-R190 PolarHBondContact O-N 3.35Å; D188-R190 VanDerWaalsContact O-N 3.11Å; D188-R190 WeakPolarHBondContact OD1-CB 3.39Å; D188-R190 PolarHBondContact OD1-N 2.75Å; D188-R190 WeakPolarHBondContact OD2-CB 3.4Å
191	A	92.6	Very high	96.4	Very high	11 Å²	11	45.4 Å²	45.4	9%	0.091	21%	0.213	C	C	.	.	S	Bend	trans	-99.5	123.1	-173.1	0	0	0	0	0	111.8	N157 D188 N193 T194 A195	N157-A191 HydrophobicContact CB-CB 4.2Å; N157-A191 WeakPolarHBondContact OD1-CB 3.35Å; D188-A191 PolarHBondContact O-N 2.68Å; A191-N193 PolarHBondContact O-N 2.77Å; A191-T194 WeakPolarHBondContact CB-OG1 3.26Å; A191-T194 PolarHBondContact O-N 2.79Å; A191-T194 PolarHBondContact O-OG1 2.95Å; A191-A195 WeakPolarHBondContact O-CB 3.28Å; A191-A195 PolarHBondContact O-N 3.03Å
192	P	90.1	Very high	96.5	Very high	31 Å²	31	45.4 Å²	45.4	20%	0.201	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-18.8	-169.8	-27.4	36.1	0	0	0	116.8	K221 Q223 R278	P192-K221 HydrophobicContact CB-CB 4.42Å; P192-K221 HydrophobicContact CG-CB 4.3Å; P192-K221 HydrophobicContact CG-CD 4.49Å; P192-Q223 HydrophobicContact CB-CG 3.97Å; P192-R278 PolarHBondContact O-NH1 2.86Å; P192-R278 PolarHBondContact O-NH2 2.87Å; P192-R278 VanDerWaalsContact O-NH2 3.08Å
193	N	93.9	Very high	96.5	Very high	54 Å²	54	48 Å²	48	29%	0.289	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-21.5	174.2	56	-51.9	0	0	0	113.3	A191 R278	A191-N193 PolarHBondContact O-N 2.77Å; N193-R278 VanDerWaalsContact O-CZ 3.23Å; N193-R278 PolarHBondContact O-NE 3.48Å
194	T	95.2	Very high	96.3	Very high	8 Å²	8	52.1 Å²	52.1	5%	0.049	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-10.2	-176.3	53.4	0	0	0	0	113.9	R30 N157 Y187 D188 A191	R30-T194 PolarHBondContact NH1-O 3.29Å; N157-T194 HydrophobicContact CB-CG2 3.83Å; Y187-T194 HydrophobicContact CD1-CG2 3.85Å; D188-T194 PolarHBondContact O-OG1 3.12Å; A191-T194 WeakPolarHBondContact CB-OG1 3.26Å; A191-T194 PolarHBondContact O-N 2.79Å; A191-T194 PolarHBondContact O-OG1 2.95Å
195	A	95.5	Very high	96.2	Very high	10 Å²	10	54.9 Å²	54.9	8%	0.083	26%	0.258	C	S	.	.	S	Bend	trans	-62.2	153.1	179.3	0	0	0	0	0	114.2	N189 A191 R278	N189-A195 WeakPolarHBondContact OD1-CA 3.44Å; N189-A195 WeakPolarHBondContact OD1-CB 3.49Å; A191-A195 WeakPolarHBondContact O-CB 3.28Å; A191-A195 PolarHBondContact O-N 3.03Å; A195-R278 PolarHBondContact O-NH2 3.46Å
196	E	95.8	Very high	96.1	Very high	65 Å²	65	56.3 Å²	56.3	30%	0.304	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-64	126.7	173.5	-166.6	167	-133.9	0	0	109.3	K28 R30 G31 N189	K28-E196 WeakPolarHBondContact CE-OE1 3.45Å; K28-E196 IonicContact NZ-OE1 3.97Å; K28-E196 PolarHBondContact NZ-OE1 3.21Å; R30-E196 HydrophobicContact CB-CB 4.09Å; R30-E196 HydrophobicContact CB-CG 4.15Å; G31-E196 WeakPolarHBondContact CA-OE2 3.14Å; N189-E196 PolarHBondContact OD1-N 3.19Å
197	L	97.4	Very high	96	Very high	9 Å²	9	56.3 Å²	56.3	5%	0.047	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-79.2	131.8	178.7	-64.6	-179	0	0	0	109.8	V222 I227 L276 R278 E283 S285	L197-V222 HydrophobicContact CD2-CG1 4.14Å; L197-I227 HydrophobicContact CD1-CD1 4.36Å; L197-I227 HydrophobicContact CD2-CD1 3.95Å; L197-L276 HydrophobicContact CB-CB 4.25Å; L197-L276 HydrophobicContact CD1-CB 4.04Å; L197-R278 HydrophobicContact CD1-CB 4.05Å; L197-E283 WeakPolarHBondContact CD1-O 3.43Å; L197-S285 VanDerWaalsContact O-CA 3.24Å; L197-S285 WeakPolarHBondContact O-CA 3.13Å; L197-S285 WeakPolarHBondContact O-CB 3.24Å
198	R	97.1	Very high	95.8	Very high	134 Å²	134	57.3 Å²	57.3	51%	0.506	28%	0.278	S	S	.	.			trans	-143.5	125.7	178.8	-170.2	168.7	60.5	137.8	3.9	112.1	C219 D220	R198-C219 VanDerWaalsContact O-CA 3.27Å; R198-C219 WeakPolarHBondContact O-CA 3.23Å; R198-C219 VanDerWaalsContact O-CB 3.23Å; R198-C219 WeakPolarHBondContact O-CB 3.49Å; R198-D220 IonicContact CZ-OD1 3.93Å; R198-D220 IonicContact CZ-OD2 2.69Å; R198-D220 IonicContact NE-OD2 3.75Å; R198-D220 PolarHBondContact NE-OD2 2.7Å; R198-D220 VanDerWaalsContact NH2-CG 3.28Å; R198-D220 IonicContact NH2-OD1 2.7Å; R198-D220 PolarHBondContact NH2-OD1 2.91Å; R198-D220 IonicContact NH2-OD2 3.32Å; R198-D220 PolarHBondContact NH2-OD2 2.9Å; R198-D220 PolarHBondContact O-N 2.8Å
199	I	98.3	Very high	95.7	Very high	26 Å²	26	56.7 Å²	56.7	13%	0.133	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	121.3	162.9	-59.7	176.9	0	0	0	106.9	V202 L217 L276 M288	I199-V202 HydrophobicContact CG2-CG1 4.31Å; I199-L217 HydrophobicContact CD1-CD1 4.05Å; I199-L217 HydrophobicContact CG1-CD1 4.16Å; I199-L217 HydrophobicContact CG1-CD2 4.38Å; I199-L217 HydrophobicContact CG2-CD1 4.36Å; I199-L217 HydrophobicContact CG2-CD2 4.42Å; I199-L217 HydrophobicContact CG2-CG 4.13Å; I199-L276 HydrophobicContact CD1-CG 4.42Å; I199-L276 HydrophobicContact CG1-CD1 4.04Å; I199-L276 HydrophobicContact CG1-CG 3.83Å; I199-M288 HydrophobicContact CG2-CE 3.93Å; I199-M288 HydrophobicContact CG2-SD 4.26Å
200	C	97.6	Very high	95.7	Very high	57 Å²	57	59.2 Å²	59.2	39%	0.385	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-44.9	-179.4	-65	0	0	0	0	111.3	L218	C200-L218 WeakPolarHBondContact CA-O 3.46Å; C200-L218 WeakPolarHBondContact CB-O 3.48Å; C200-L218 PolarHBondContact N-O 3.28Å
201	R	97.8	Very high	95.8	Very high	183 Å²	183	52 Å²	52	69%	0.691	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.3	158.8	176.6	-56.8	-174.5	73.9	172.1	1.9	110.8	L218	R201-L218 HydrophobicContact CB-CB 4.35Å; R201-L218 HydrophobicContact CB-CD1 4.32Å; R201-L218 PolarHBondContact N-O 2.9Å; R201-L218 PolarHBondContact O-N 2.83Å
202	V	98.2	Very high	95.9	Very high	37 Å²	37	54 Å²	54	22%	0.224	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	155.6	164.4	-72.4	0	0	0	0	111.2	I199 I215 F216 L217 M274 M288	I199-V202 HydrophobicContact CG2-CG1 4.31Å; V202-I215 HydrophobicContact CB-CG2 4.33Å; V202-I215 HydrophobicContact CG1-CG2 4.15Å; V202-F216 WeakPolarHBondContact CA-O 3.44Å; V202-L217 HydrophobicContact CG1-CB 3.92Å; V202-L217 HydrophobicContact CG1-CD1 4.13Å; V202-L217 HydrophobicContact CG1-CG 3.83Å; V202-M274 HydrophobicContact CG1-CE 4Å; V202-M288 HydrophobicContact CB-CE 4.2Å; V202-M288 HydrophobicContact CG1-CE 3.68Å; V202-M288 HydrophobicContact CG2-CE 3.45Å; V202-M288 VanDerWaalsContact CG2-CE 3.45Å; V202-M288 HydrophobicContact CG2-SD 4.24Å
203	N	97.7	Very high	96.3	Very high	85 Å²	85	54.2 Å²	54.2	46%	0.455	28%	0.28	S	S	.	.	S	Bend	trans	-73	-30.9	170.9	69.6	-29.9	0	0	0	113.1	I215 F216	N203-I215 WeakPolarHBondContact OD1-CA 3.38Å; N203-F216 HydrophobicContact CB-CB 4.2Å; N203-F216 PolarHBondContact N-O 2.81Å; N203-F216 PolarHBondContact OD1-N 3.48Å; N203-F216 PolarHBondContact OD1-O 2.99Å
204	R	94.8	Very high	96.5	Very high	89 Å²	89	55.7 Å²	55.7	34%	0.336	29%	0.285	S	S	.	.			trans	-143.5	132.8	-174.8	-68.5	178.5	60.9	-174.2	-5.4	110.6	S206 D213	R204-S206 PolarHBondContact NE-O 3.06Å; R204-S206 PolarHBondContact NH2-O 3.11Å; R204-D213 IonicContact CZ-OD1 2.68Å; R204-D213 IonicContact NH1-OD1 2.72Å; R204-D213 PolarHBondContact NH1-OD1 3.28Å; R204-D213 IonicContact NH2-OD1 3.61Å; R204-D213 PolarHBondContact NH2-OD1 2.98Å; R204-D213 IonicContact NH2-OD2 2.83Å; R204-D213 PolarHBondContact NH2-OD2 3.47Å
205	N	95.8	Very high	96.6	Very high	100 Å²	100	55.3 Å²	55.3	54%	0.535	28%	0.283	S	S	.	.	S	Bend	trans	-111.6	15.3	172.5	62.4	-8.1	0	0	0	112.3	F290 R291	N205-F290 VanDerWaalsContact C-CD2 3.46Å; N205-F290 CarbonylContact O-C 3.47Å; N205-F290 WeakPolarHBondContact O-CA 3.38Å; N205-R291 PolarHBondContact O-N 2.82Å
206	S	96.6	Very high	96.8	Very high	38 Å²	38	59.8 Å²	59.8	27%	0.266	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	149.8	175.7	60.5	0	0	0	0	113.2	R204 F290 R291	R204-S206 PolarHBondContact NE-O 3.06Å; R204-S206 PolarHBondContact NH2-O 3.11Å; S206-F290 VanDerWaalsContact C-CZ 3.49Å; S206-R291 WeakPolarHBondContact CA-O 3.48Å; S206-R291 VanDerWaalsContact CB-O 3.24Å; S206-R291 WeakPolarHBondContact CB-O 3.33Å
207	G	95.6	Very high	96.9	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.01	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	176.1	-177.1	0	0	0	0	0	113.7	D213 F290 R291 Y292 L293	G207-D213 WeakPolarHBondContact CA-OD2 3.5Å; G207-F290 VanDerWaalsContact N-CZ 3.31Å; G207-R291 PolarHBondContact N-O 2.98Å; G207-R291 VanDerWaalsContact N-O 3.12Å; G207-Y292 CarbonylContact O-C 3.56Å; G207-Y292 WeakPolarHBondContact O-CA 3.36Å; G207-L293 PolarHBondContact O-N 3.22Å
208	S	95	Very high	97	Very high	39 Å²	39	60.2 Å²	60.2	27%	0.273	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	137.4	179.3	-179	0	0	0	0	111.6	K210 G211 D213 Y292	S208-K210 PolarHBondContact O-N 3.11Å; S208-K210 PolarHBondContact OG-N 3.27Å; S208-G211 PolarHBondContact O-N 2.9Å; S208-D213 PolarHBondContact N-OD2 3.16Å; S208-Y292 WeakPolarHBondContact O-CD1 3.34Å
209	V	95.5	Very high	97	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-23.3	171.1	70.5	0	0	0	0	113.6	G211 Y261 H263 T264 I266 L293	V209-G211 VanDerWaalsContact C-N 3.26Å; V209-G211 PolarHBondContact O-N 3.27Å; V209-Y261 HydrophobicContact CG2-CD1 3.87Å; V209-Y261 HydrophobicContact CG2-CG 4.27Å; V209-Y261 PolarHBondContact O-N 2.82Å; V209-H263 VanDerWaalsContact CG2-O 3.24Å; V209-H263 WeakPolarHBondContact CG2-O 3.34Å; V209-T264 WeakPolarHBondContact CG1-O 3.39Å; V209-I266 HydrophobicContact CB-CD1 3.82Å; V209-I266 HydrophobicContact CB-CG1 4.14Å; V209-I266 HydrophobicContact CG1-CG1 4.43Å; V209-I266 HydrophobicContact CG2-CD1 3.58Å; V209-I266 HydrophobicContact CG2-CG1 3.88Å; V209-I266 HydrophobicContact CG2-CG2 4.42Å; V209-L293 WeakPolarHBondContact CB-O 3.49Å; V209-L293 PolarHBondContact N-O 3.25Å
210	K	94.8	Very high	96.9	Very high	104 Å²	104	56 Å²	56	45%	0.452	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-6	173.9	-70.7	-175	172.3	173.5	0	114.5	S208 T264 E295	S208-K210 PolarHBondContact O-N 3.11Å; S208-K210 PolarHBondContact OG-N 3.27Å; K210-T264 HydrophobicContact CG-CG2 4.39Å; K210-E295 VanDerWaalsContact CE-CD 3.46Å; K210-E295 WeakPolarHBondContact CE-OE1 3.44Å; K210-E295 WeakPolarHBondContact CE-OE2 3.45Å; K210-E295 IonicContact NZ-OE1 2.64Å; K210-E295 PolarHBondContact NZ-OE1 2.99Å; K210-E295 IonicContact NZ-OE2 2.75Å; K210-E295 PolarHBondContact NZ-OE2 2.81Å
211	G	95.8	Very high	96.9	Very high	12 Å²	12	59 Å²	59	12%	0.124	30%	0.299	C	S	.	.			trans	68.8	-158.9	-174	0	0	0	0	0	112.8	S208 V209 D213 T258 P259	S208-G211 PolarHBondContact O-N 2.9Å; V209-G211 VanDerWaalsContact C-N 3.26Å; V209-G211 PolarHBondContact O-N 3.27Å; G211-D213 PolarHBondContact O-N 2.96Å; G211-T258 CarbonylContact C-O 3.59Å; G211-T258 WeakPolarHBondContact CA-O 3.38Å; G211-T258 WeakPolarHBondContact CA-OG1 3.46Å; G211-P259 WeakPolarHBondContact CA-O 3.42Å
212	G	96.5	Very high	96.9	Very high	51 Å²	51	50.3 Å²	50.3	53%	0.526	27%	0.267	S	S	.	.			trans	79.1	-10.2	-179.8	0	0	0	0	0	115.9	T258	G212-T258 PolarHBondContact N-O 2.04Å; G212-T258 PolarHBondContact N-OG1 2.91Å
213	D	96.6	Very high	96.9	Very high	36 Å²	36	51.7 Å²	51.7	19%	0.193	27%	0.271	C	S	.	.			trans	-64.6	132.1	175.2	-86.1	-60.3	0	0	0	111.7	R204 G207 S208 G211 K257 T258	R204-D213 IonicContact CZ-OD1 2.68Å; R204-D213 IonicContact NH1-OD1 2.72Å; R204-D213 PolarHBondContact NH1-OD1 3.28Å; R204-D213 IonicContact NH2-OD1 3.61Å; R204-D213 PolarHBondContact NH2-OD1 2.98Å; R204-D213 IonicContact NH2-OD2 2.83Å; R204-D213 PolarHBondContact NH2-OD2 3.47Å; G207-D213 WeakPolarHBondContact CA-OD2 3.5Å; S208-D213 PolarHBondContact N-OD2 3.16Å; G211-D213 PolarHBondContact O-N 2.96Å; D213-K257 CarbonylContact O-C 3.59Å; D213-K257 VanDerWaalsContact O-CA 3.31Å; D213-K257 WeakPolarHBondContact O-CA 3.38Å; D213-T258 HydrophobicContact CB-CG2 4.17Å; D213-T258 PolarHBondContact N-OG1 2.82Å; D213-T258 VanDerWaalsContact N-OG1 3.14Å; D213-T258 PolarHBondContact O-N 3.04Å
214	E	98.3	Very high	96.8	Very high	86 Å²	86	51.7 Å²	51.7	40%	0.402	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	124.7	-179.3	-163.3	167.2	-79.6	0	0	111.7	F216 V255 F256 K257	E214-F216 HydrophobicContact CG-CE2 4.21Å; E214-V255 HydrophobicContact CG-CG1 3.78Å; E214-F256 WeakPolarHBondContact CA-O 3.17Å; E214-K257 HydrophobicContact CB-CG 4.46Å; E214-K257 WeakPolarHBondContact OE1-CE 3.24Å; E214-K257 IonicContact OE1-NZ 3.8Å
215	I	98.4	Very high	97	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	134.5	-177.5	-63.2	-176.7	0	0	0	109.4	V202 N203 V255 F256 T258 F290	V202-I215 HydrophobicContact CB-CG2 4.33Å; V202-I215 HydrophobicContact CG1-CG2 4.15Å; N203-I215 WeakPolarHBondContact OD1-CA 3.38Å; I215-V255 WeakPolarHBondContact O-CA 3.36Å; I215-F256 HydrophobicContact CB-CD1 4.29Å; I215-F256 HydrophobicContact CB-CE1 3.72Å; I215-F256 HydrophobicContact CB-CE2 4.1Å; I215-F256 HydrophobicContact CB-CZ 3.6Å; I215-F256 HydrophobicContact CD1-CE2 4.08Å; I215-F256 HydrophobicContact CD1-CZ 3.82Å; I215-F256 HydrophobicContact CG1-CE2 4.46Å; I215-F256 HydrophobicContact CG1-CZ 4.21Å; I215-F256 HydrophobicContact CG2-CD1 4.44Å; I215-F256 HydrophobicContact CG2-CE1 3.56Å; I215-F256 HydrophobicContact CG2-CZ 3.63Å; I215-F256 PolarHBondContact N-O 3.17Å; I215-F256 PolarHBondContact O-N 3.44Å; I215-T258 HydrophobicContact CD1-CG2 3.35Å; I215-T258 HydrophobicContact CG1-CG2 4.02Å; I215-F290 HydrophobicContact CD1-CD2 4.13Å; I215-F290 HydrophobicContact CD1-CE2 3.51Å; I215-F290 HydrophobicContact CD1-CZ 4.23Å
216	F	98.5	Very high	97	Very high	103 Å²	103	48.4 Å²	48.4	45%	0.452	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	109.8	171.5	-73.2	-113.2	0	0	0	107.2	V202 N203 E214 V255	V202-F216 WeakPolarHBondContact CA-O 3.44Å; N203-F216 HydrophobicContact CB-CB 4.2Å; N203-F216 PolarHBondContact N-O 2.81Å; N203-F216 PolarHBondContact OD1-N 3.48Å; N203-F216 PolarHBondContact OD1-O 2.99Å; E214-F216 HydrophobicContact CG-CE2 4.21Å; F216-V255 HydrophobicContact CD1-CG2 3.68Å; F216-V255 HydrophobicContact CD2-CG1 4.31Å; F216-V255 HydrophobicContact CE1-CG1 4.39Å; F216-V255 HydrophobicContact CE1-CG2 3.6Å; F216-V255 HydrophobicContact CE2-CG1 3.98Å; F216-V255 HydrophobicContact CG-CG2 4.21Å; F216-V255 HydrophobicContact CZ-CG1 4.03Å; F216-V255 HydrophobicContact CZ-CG2 4.07Å
217	L	98.6	Very high	97.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123	-178.2	-176.4	158.8	0	0	0	109.2	I199 V202 C219 V229 A253 I254 F256 M274 L276	I199-L217 HydrophobicContact CD1-CD1 4.05Å; I199-L217 HydrophobicContact CG1-CD1 4.16Å; I199-L217 HydrophobicContact CG1-CD2 4.38Å; I199-L217 HydrophobicContact CG2-CD1 4.36Å; I199-L217 HydrophobicContact CG2-CD2 4.42Å; I199-L217 HydrophobicContact CG2-CG 4.13Å; V202-L217 HydrophobicContact CG1-CB 3.92Å; V202-L217 HydrophobicContact CG1-CD1 4.13Å; V202-L217 HydrophobicContact CG1-CG 3.83Å; L217-C219 HydrophobicContact CD2-CB 3.77Å; L217-V229 HydrophobicContact CD1-CG2 4.49Å; L217-A253 CarbonylContact O-C 3.53Å; L217-A253 WeakPolarHBondContact O-CA 3.43Å; L217-A253 WeakPolarHBondContact O-CB 3.5Å; L217-I254 PolarHBondContact N-O 3.36Å; L217-I254 PolarHBondContact O-N 2.81Å; L217-F256 HydrophobicContact CB-CE1 4Å; L217-F256 HydrophobicContact CD1-CE1 3.95Å; L217-M274 HydrophobicContact CD1-CE 4.46Å; L217-L276 HydrophobicContact CD1-CD2 4.42Å; L217-L276 HydrophobicContact CD2-CD2 4.2Å
218	L	98.8	Very high	97.3	Very high	84 Å²	84	48.1 Å²	48.1	44%	0.44	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	134.8	172.5	-54.9	-175.4	0	0	0	109	C200 R201 A253	C200-L218 WeakPolarHBondContact CA-O 3.46Å; C200-L218 WeakPolarHBondContact CB-O 3.48Å; C200-L218 PolarHBondContact N-O 3.28Å; R201-L218 HydrophobicContact CB-CB 4.35Å; R201-L218 HydrophobicContact CB-CD1 4.32Å; R201-L218 PolarHBondContact N-O 2.9Å; R201-L218 PolarHBondContact O-N 2.83Å; L218-A253 HydrophobicContact CD2-CB 3.7Å
219	C	98.1	Very high	97.4	Very high	9 Å²	9	46.3 Å²	46.3	6%	0.061	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	169.5	-173.9	52.6	0	0	0	0	112.1	R198 L217 V252 L276	R198-C219 VanDerWaalsContact O-CA 3.27Å; R198-C219 WeakPolarHBondContact O-CA 3.23Å; R198-C219 VanDerWaalsContact O-CB 3.23Å; R198-C219 WeakPolarHBondContact O-CB 3.49Å; L217-C219 HydrophobicContact CD2-CB 3.77Å; C219-V252 PolarHBondContact N-O 3.09Å; C219-L276 HydrophobicContact CB-CD1 3.88Å
220	D	97.1	Very high	97.6	Very high	63 Å²	63	48.8 Å²	48.8	34%	0.337	25%	0.247	S	C	.	.	S	Bend	trans	-70.5	177.1	162.5	-74.2	-29.9	0	0	0	111.2	R198 V222	R198-D220 IonicContact CZ-OD1 3.93Å; R198-D220 IonicContact CZ-OD2 2.69Å; R198-D220 IonicContact NE-OD2 3.75Å; R198-D220 PolarHBondContact NE-OD2 2.7Å; R198-D220 VanDerWaalsContact NH2-CG 3.28Å; R198-D220 IonicContact NH2-OD1 2.7Å; R198-D220 PolarHBondContact NH2-OD1 2.91Å; R198-D220 IonicContact NH2-OD2 3.32Å; R198-D220 PolarHBondContact NH2-OD2 2.9Å; R198-D220 PolarHBondContact O-N 2.8Å; D220-V222 PolarHBondContact O-N 3.46Å; D220-V222 VanDerWaalsContact O-N 3.15Å
221	K	97	Very high	97.7	Very high	118 Å²	118	43.9 Å²	43.9	51%	0.513	23%	0.226	S	C	.	.			trans	-66.4	113.2	-168.2	-77.4	-162.2	170.2	-155.9	0	114.2	P192 Q251 V252	P192-K221 HydrophobicContact CB-CB 4.42Å; P192-K221 HydrophobicContact CG-CB 4.3Å; P192-K221 HydrophobicContact CG-CD 4.49Å; K221-Q251 WeakPolarHBondContact CA-O 3.22Å; K221-V252 HydrophobicContact CG-CG1 4.04Å
222	V	97.6	Very high	97.8	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.012	23%	0.228	C	C	.	.			trans	-104.9	165.4	174.9	-63.3	0	0	0	0	113.1	L197 D220 I227 V248 Q251 L276	L197-V222 HydrophobicContact CD2-CG1 4.14Å; D220-V222 PolarHBondContact O-N 3.46Å; D220-V222 VanDerWaalsContact O-N 3.15Å; V222-I227 HydrophobicContact CB-CB 4.21Å; V222-I227 HydrophobicContact CB-CD1 4Å; V222-I227 HydrophobicContact CB-CG1 3.89Å; V222-I227 HydrophobicContact CG1-CD1 3.56Å; V222-I227 HydrophobicContact CG1-CG1 3.85Å; V222-I227 HydrophobicContact CG2-CG1 4.27Å; V222-I227 HydrophobicContact CG2-CG2 4.39Å; V222-V248 HydrophobicContact CG2-CG1 3.95Å; V222-Q251 PolarHBondContact N-O 3.46Å; V222-Q251 VanDerWaalsContact O-CB 3.31Å; V222-Q251 WeakPolarHBondContact O-CB 3.46Å; V222-Q251 WeakPolarHBondContact O-CG 3.49Å; V222-Q251 PolarHBondContact O-NE2 2.88Å; V222-L276 HydrophobicContact CG1-CD1 4.47Å
223	Q	97.6	Very high	97.8	Very high	66 Å²	66	43.4 Å²	43.4	31%	0.308	21%	0.208	S	C	.	.			trans	-100.6	125.5	167.9	-68.4	-169.3	-23.3	0	0	109.2	P192 D225 D226 I227	P192-Q223 HydrophobicContact CB-CG 3.97Å; Q223-D225 PolarHBondContact O-N 2.97Å; Q223-D225 VanDerWaalsContact O-N 3.1Å; Q223-D226 HydrophobicContact CB-CB 4.27Å; Q223-D226 CarbonylContact O-C 3.57Å; Q223-D226 VanDerWaalsContact O-C 3.31Å; Q223-D226 PolarHBondContact O-N 2.68Å; Q223-I227 WeakPolarHBondContact O-CB 3.41Å; Q223-I227 WeakPolarHBondContact O-CG2 3.29Å; Q223-I227 PolarHBondContact O-N 2.7Å
224	K	96.8	Very high	97.5	Very high	85 Å²	85	47.6 Å²	47.6	37%	0.37	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-22.1	-174.1	78.7	-169.6	-159.8	-34.1	0	114.1	Q245 V248	K224-Q245 HydrophobicContact CD-CB 4.25Å; K224-Q245 HydrophobicContact CG-CB 4.15Å; K224-Q245 HydrophobicContact CG-CG 4.49Å; K224-V248 HydrophobicContact CB-CB 3.71Å; K224-V248 HydrophobicContact CB-CG1 3.85Å; K224-V248 HydrophobicContact CB-CG2 3.96Å
225	D	97.2	Very high	97	Very high	100 Å²	100	47.3 Å²	47.3	54%	0.535	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-12.2	-177	-51.8	-71.5	0	0	0	112.5	Q223 Q245	Q223-D225 PolarHBondContact O-N 2.97Å; Q223-D225 VanDerWaalsContact O-N 3.1Å; D225-Q245 PolarHBondContact OD1-NE2 2.96Å; D225-Q245 PolarHBondContact OD1-OE1 2.95Å; D225-Q245 VanDerWaalsContact OD1-OE1 3.09Å
226	D	97.7	Very high	96.7	Very high	20 Å²	20	50.6 Å²	50.6	11%	0.107	28%	0.275	C	S	.	.	S	Bend	trans	-143.6	55.8	-170.6	-178.3	37.4	0	0	0	109.7	Q223 R278 P279 S280	Q223-D226 HydrophobicContact CB-CB 4.27Å; Q223-D226 CarbonylContact O-C 3.57Å; Q223-D226 VanDerWaalsContact O-C 3.31Å; Q223-D226 PolarHBondContact O-N 2.68Å; D226-R278 VanDerWaalsContact CG-CG 3.45Å; D226-R278 WeakPolarHBondContact OD1-CG 3.25Å; D226-R278 VanDerWaalsContact OD2-CD 3.27Å; D226-R278 WeakPolarHBondContact OD2-CD 3.38Å; D226-R278 WeakPolarHBondContact OD2-CG 3.45Å; D226-R278 IonicContact OD2-NH1 2.78Å; D226-P279 VanDerWaalsContact OD1-CD 3.29Å; D226-P279 WeakPolarHBondContact OD1-CD 3.31Å; D226-S280 VanDerWaalsContact CG-OG 3.25Å; D226-S280 VanDerWaalsContact OD1-CB 3.25Å; D226-S280 WeakPolarHBondContact OD1-CB 3.45Å; D226-S280 PolarHBondContact OD1-N 2.92Å; D226-S280 PolarHBondContact OD1-OG 2.62Å; D226-S280 WeakPolarHBondContact OD2-CB 3.1Å; D226-S280 PolarHBondContact OD2-OG 3.22Å
227	I	98.5	Very high	96.6	Very high	13 Å²	13	47.2 Å²	47.2	7%	0.067	26%	0.26	C	S	.	.			trans	-153.9	141.3	176.3	-165.5	66.3	0	0	0	110.2	L197 V222 Q223 F243 V248 I254 L276	L197-I227 HydrophobicContact CD1-CD1 4.36Å; L197-I227 HydrophobicContact CD2-CD1 3.95Å; V222-I227 HydrophobicContact CB-CB 4.21Å; V222-I227 HydrophobicContact CB-CD1 4Å; V222-I227 HydrophobicContact CB-CG1 3.89Å; V222-I227 HydrophobicContact CG1-CD1 3.56Å; V222-I227 HydrophobicContact CG1-CG1 3.85Å; V222-I227 HydrophobicContact CG2-CG1 4.27Å; V222-I227 HydrophobicContact CG2-CG2 4.39Å; Q223-I227 WeakPolarHBondContact O-CB 3.41Å; Q223-I227 WeakPolarHBondContact O-CG2 3.29Å; Q223-I227 PolarHBondContact O-N 2.7Å; I227-F243 HydrophobicContact CG2-CE2 4.31Å; I227-F243 HydrophobicContact CG2-CZ 4.27Å; I227-V248 HydrophobicContact CG2-CG2 4.36Å; I227-I254 HydrophobicContact CG1-CD1 3.95Å; I227-I254 HydrophobicContact CG2-CD1 4.32Å; I227-L276 HydrophobicContact CD1-CB 4.18Å; I227-L276 HydrophobicContact CD1-CD2 4.3Å; I227-L276 HydrophobicContact CG1-CD2 4.34Å
228	E	98.3	Very high	96.5	Very high	20 Å²	20	50.9 Å²	50.9	9%	0.093	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	155.1	169.3	60.5	-175.1	-172.5	0	0	111.6	R240 R277 P279	E228-R240 WeakPolarHBondContact OE2-CD 3.39Å; E228-R240 IonicContact OE2-CZ 3.7Å; E228-R240 IonicContact OE2-NE 3.52Å; E228-R240 IonicContact OE2-NH1 2.65Å; E228-R240 PolarHBondContact OE2-NH1 3.36Å; E228-R277 HydrophobicContact CG-CB 4.11Å; E228-R277 PolarHBondContact N-O 3.4Å; E228-R277 PolarHBondContact O-N 3.05Å; E228-R277 IonicContact OE1-CZ 3.14Å; E228-R277 IonicContact OE1-NE 3.14Å; E228-R277 PolarHBondContact OE1-NE 2.83Å; E228-R277 IonicContact OE1-NH2 2.77Å; E228-R277 PolarHBondContact OE1-NH2 2.89Å; E228-P279 HydrophobicContact CG-CG 4.09Å
229	V	98.5	Very high	96.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	114.2	174.5	-174.5	0	0	0	0	108.1	L217 F231 R240 G241 F243 I254 F256 M274 L276	L217-V229 HydrophobicContact CD1-CG2 4.49Å; V229-F231 HydrophobicContact CG1-CD2 4.34Å; V229-F231 HydrophobicContact CG1-CE2 3.77Å; V229-R240 CarbonylContact O-C 3.56Å; V229-R240 WeakPolarHBondContact O-CA 3.38Å; V229-G241 PolarHBondContact O-N 2.71Å; V229-F243 HydrophobicContact CG2-CE1 4.09Å; V229-I254 HydrophobicContact CG2-CD1 4.37Å; V229-F256 HydrophobicContact CG1-CE1 4.09Å; V229-F256 HydrophobicContact CG1-CE2 4.14Å; V229-F256 HydrophobicContact CG1-CZ 3.83Å; V229-F256 HydrophobicContact CG2-CD1 3.91Å; V229-F256 HydrophobicContact CG2-CE1 4.03Å; V229-F256 HydrophobicContact CG2-CG 4.26Å; V229-M274 HydrophobicContact CG1-CG 3.7Å; V229-M274 HydrophobicContact CG1-SD 3.89Å; V229-L276 HydrophobicContact CG2-CD2 4.18Å
230	R	98.3	Very high	96.4	Very high	53 Å²	53	54.9 Å²	54.9	20%	0.2	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.4	-176.5	-177.4	-172.5	-178	-123.3	-0.4	110	F232 E238 M274 Q275 R277	R230-F232 HydrophobicContact CG-CD1 4.45Å; R230-E238 HydrophobicContact CG-CG 4.09Å; R230-E238 IonicContact CZ-OE2 3.74Å; R230-E238 IonicContact NE-OE1 3.69Å; R230-E238 PolarHBondContact NE-OE1 2.9Å; R230-E238 IonicContact NE-OE2 3.17Å; R230-E238 PolarHBondContact NE-OE2 2.96Å; R230-E238 IonicContact NH2-OE2 2.72Å; R230-E238 PolarHBondContact NH2-OE2 2.89Å; R230-M274 WeakPolarHBondContact O-CA 3.44Å; R230-Q275 HydrophobicContact CB-CG 4.07Å; R230-Q275 PolarHBondContact N-O 3.26Å; R230-Q275 VanDerWaalsContact NH1-NE2 3.15Å; R230-Q275 PolarHBondContact O-N 3.32Å; R230-R277 HydrophobicContact CB-CB 4.47Å
231	F	98.3	Very high	96.5	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	134.4	168.2	-71	-103.6	0	0	0	108.5	V229 W237 E238 A239 F256 T258 P259 V272 H273 M274 F290	V229-F231 HydrophobicContact CG1-CD2 4.34Å; V229-F231 HydrophobicContact CG1-CE2 3.77Å; F231-W237 HydrophobicContact CB-CH2 3.83Å; F231-W237 HydrophobicContact CB-CZ3 3.95Å; F231-E238 CarbonylContact O-C 3.57Å; F231-E238 VanDerWaalsContact O-CA 3.32Å; F231-E238 WeakPolarHBondContact O-CA 3.41Å; F231-A239 PolarHBondContact N-O 2.89Å; F231-A239 PolarHBondContact O-N 2.74Å; F231-A239 VanDerWaalsContact O-O 3.13Å; F231-F256 HydrophobicContact CE2-CD2 4.47Å; F231-F256 AromaticContact CE2-CE2 3.58Å; F231-F256 HydrophobicContact CE2-CE2 3.58Å; F231-F256 HydrophobicContact CE2-CZ 4.14Å; F231-F256 AromaticContact CZ-CE2 3.62Å; F231-F256 HydrophobicContact CZ-CE2 3.62Å; F231-F256 AromaticContact CZ-CZ 3.96Å; F231-F256 HydrophobicContact CZ-CZ 3.96Å; F231-T258 HydrophobicContact CZ-CG2 4.16Å; F231-P259 HydrophobicContact CB-CG 4.04Å; F231-P259 VanDerWaalsContact CD2-CD 3.47Å; F231-P259 HydrophobicContact CD2-CG 3.63Å; F231-P259 HydrophobicContact CE2-CG 4.22Å; F231-P259 HydrophobicContact CG-CG 3.81Å; F231-V272 HydrophobicContact CD1-CG2 4.23Å; F231-H273 CarbonylContact C-O 3.4Å; F231-H273 WeakPolarHBondContact CA-O 3.27Å; F231-M274 HydrophobicContact CD1-CB 4.14Å; F231-M274 HydrophobicContact CD1-CG 4.36Å; F231-M274 HydrophobicContact CD2-CG 4.44Å; F231-M274 HydrophobicContact CE1-CB 4.03Å; F231-M274 HydrophobicContact CE1-CG 3.99Å; F231-M274 HydrophobicContact CE1-SD 3.73Å; F231-M274 HydrophobicContact CE2-CG 4.07Å; F231-M274 HydrophobicContact CE2-SD 3.92Å; F231-M274 HydrophobicContact CZ-CB 4.39Å; F231-M274 HydrophobicContact CZ-CG 3.83Å; F231-M274 HydrophobicContact CZ-SD 3.29Å; F231-M274 WeakPolarHBondContact CZ-SD 3.45Å; F231-F290 HydrophobicContact CD1-CB 4.45Å; F231-F290 HydrophobicContact CD1-CD1 4.24Å; F231-F290 HydrophobicContact CD1-CG 4.39Å; F231-F290 HydrophobicContact CE1-CB 4.04Å; F231-F290 AromaticContact CE1-CD1 3.75Å; F231-F290 HydrophobicContact CE1-CD1 3.75Å; F231-F290 HydrophobicContact CE1-CD2 4.18Å; F231-F290 HydrophobicContact CE1-CE1 4.27Å; F231-F290 AromaticContact CE1-CG 3.7Å; F231-F290 HydrophobicContact CE1-CG 3.7Å
232	F	97.5	Very high	96.6	Very high	38 Å²	38	50.8 Å²	50.8	17%	0.167	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	158.3	-179.7	69.4	-74.5	0	0	0	112.8	R230 W237 H273 Q275 P287	R230-F232 HydrophobicContact CG-CD1 4.45Å; F232-W237 CarbonylContact C-O 3.31Å; F232-W237 WeakPolarHBondContact CA-O 3.49Å; F232-H273 HydrophobicContact CD1-CB 3.95Å; F232-H273 HydrophobicContact CD2-CB 4.43Å; F232-H273 HydrophobicContact CE1-CB 3.42Å; F232-H273 VanDerWaalsContact CE1-CB 3.42Å; F232-H273 HydrophobicContact CE2-CB 3.99Å; F232-H273 AromaticContact CE2-ND1 3.97Å; F232-H273 HydrophobicContact CG-CB 4.42Å; F232-H273 HydrophobicContact CZ-CB 3.46Å; F232-H273 VanDerWaalsContact CZ-CB 3.46Å; F232-H273 PolarHBondContact N-O 3.05Å; F232-H273 PolarHBondContact O-N 2.91Å; F232-Q275 HydrophobicContact CD1-CG 4.34Å; F232-Q275 HydrophobicContact CE1-CB 4.37Å; F232-Q275 VanDerWaalsContact CE1-CD 3.43Å; F232-Q275 HydrophobicContact CE1-CG 3.82Å; F232-P287 HydrophobicContact CE1-CB 4.38Å; F232-P287 HydrophobicContact CZ-CB 4.11Å
233	S	95.3	Very high	96.6	Very high	16 Å²	16	53.2 Å²	53.2	11%	0.112	29%	0.292	C	S	.	.			trans	-132.2	157.2	178.7	179.8	0	0	0	0	111.4	N235 G236 W237	S233-N235 VanDerWaalsContact CB-OD1 3.26Å; S233-N235 WeakPolarHBondContact CB-OD1 3.27Å; S233-N235 PolarHBondContact O-N 2.8Å; S233-N235 VanDerWaalsContact O-N 3.14Å; S233-N235 PolarHBondContact OG-OD1 2.93Å; S233-G236 PolarHBondContact O-N 3.22Å; S233-W237 PolarHBondContact N-O 2.82Å
234	S	91.2	Very high	96.6	Very high	123 Å²	123	52.9 Å²	52.9	86%	0.86	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-15.9	178.2	51.3	0	0	0	0	113.7	G236	S234-G236 PolarHBondContact O-N 3.08Å
235	N	88.8	Confident	96.7	Very high	80 Å²	80	53.9 Å²	53.9	43%	0.428	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	4.3	172.8	66	15.8	0	0	0	114.3	S233 W237 Y262	S233-N235 VanDerWaalsContact CB-OD1 3.26Å; S233-N235 WeakPolarHBondContact CB-OD1 3.27Å; S233-N235 PolarHBondContact O-N 2.8Å; S233-N235 VanDerWaalsContact O-N 3.14Å; S233-N235 PolarHBondContact OG-OD1 2.93Å; N235-W237 WeakPolarHBondContact OD1-CB 3.34Å; N235-W237 PolarHBondContact OD1-N 3.23Å; N235-Y262 PolarHBondContact ND2-OH 2.86Å
236	G	91.5	Very high	96.7	Very high	70 Å²	70	53.3 Å²	53.3	72%	0.722	31%	0.312	S	S	*	.	S	Bend	trans	87.3	0.4	178.3	0	0	0	0	0	115.3	S233 S234	S233-G236 PolarHBondContact O-N 3.22Å; S234-G236 PolarHBondContact O-N 3.08Å
237	W	95.1	Very high	96.8	Very high	32 Å²	32	55.2 Å²	55.2	12%	0.121	32%	0.322	C	S	.	.			trans	-67.7	134.6	169.8	174.7	69	0	0	0	111.3	F231 F232 S233 N235 A239 P259 P260 Y261 Y262 V272 Y292	F231-W237 HydrophobicContact CB-CH2 3.83Å; F231-W237 HydrophobicContact CB-CZ3 3.95Å; F232-W237 CarbonylContact C-O 3.31Å; F232-W237 WeakPolarHBondContact CA-O 3.49Å; S233-W237 PolarHBondContact N-O 2.82Å; N235-W237 WeakPolarHBondContact OD1-CB 3.34Å; N235-W237 PolarHBondContact OD1-N 3.23Å; W237-A239 HydrophobicContact CH2-CB 3.97Å; W237-A239 HydrophobicContact CZ2-CB 3.32Å; W237-P259 HydrophobicContact CH2-CG 4.45Å; W237-P260 WeakPolarHBondContact CZ2-O 3.07Å; W237-Y261 HydrophobicContact CD2-CD2 4.07Å; W237-Y261 HydrophobicContact CD2-CE2 4.21Å; W237-Y261 AromaticContact CE3-CD2 3.87Å; W237-Y261 HydrophobicContact CE3-CD2 3.87Å; W237-Y261 AromaticContact CE3-CE2 3.9Å; W237-Y261 HydrophobicContact CE3-CE2 3.9Å; W237-Y261 AromaticContact CH2-CD2 3.96Å; W237-Y261 HydrophobicContact CH2-CD2 3.96Å; W237-Y261 HydrophobicContact CZ2-CD2 4.14Å; W237-Y261 AromaticContact CZ3-CD2 3.83Å; W237-Y261 HydrophobicContact CZ3-CD2 3.83Å; W237-Y261 HydrophobicContact CZ3-CE2 4.21Å; W237-Y262 HydrophobicContact CB-CD1 3.75Å; W237-Y262 HydrophobicContact CB-CE1 3.97Å; W237-Y262 HydrophobicContact CB-CG 4.45Å; W237-Y262 AromaticContact CD1-CD1 3.61Å; W237-Y262 AromaticContact CD1-CG 3.79Å; W237-Y262 HydrophobicContact CD2-CD1 4.04Å; W237-Y262 AromaticContact CG-CD1 3.48Å; W237-Y262 HydrophobicContact CG-CD1 3.48Å; W237-Y262 VanDerWaalsContact CG-CD1 3.48Å; W237-Y262 HydrophobicContact CG-CE1 4.17Å; W237-Y262 HydrophobicContact CG-CG 4.11Å; W237-V272 HydrophobicContact CE3-CG1 4.25Å; W237-V272 HydrophobicContact CZ3-CB 4.2Å; W237-V272 HydrophobicContact CZ3-CG1 3.95Å; W237-V272 HydrophobicContact CZ3-CG2 4.19Å; W237-Y292 AromaticContact CH2-CE2 3.69Å; W237-Y292 HydrophobicContact CH2-CE2 3.69Å; W237-Y292 HydrophobicContact CZ3-CE2 4Å
238	E	97.2	Very high	96.8	Very high	76 Å²	76	55.1 Å²	55.1	36%	0.355	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	142.1	169.2	175.5	170.4	158.6	0	0	110.1	R230 F231 R277	R230-E238 HydrophobicContact CG-CG 4.09Å; R230-E238 IonicContact CZ-OE2 3.74Å; R230-E238 IonicContact NE-OE1 3.69Å; R230-E238 PolarHBondContact NE-OE1 2.9Å; R230-E238 IonicContact NE-OE2 3.17Å; R230-E238 PolarHBondContact NE-OE2 2.96Å; R230-E238 IonicContact NH2-OE2 2.72Å; R230-E238 PolarHBondContact NH2-OE2 2.89Å; F231-E238 CarbonylContact O-C 3.57Å; F231-E238 VanDerWaalsContact O-CA 3.32Å; F231-E238 WeakPolarHBondContact O-CA 3.41Å; E238-R277 IonicContact OE1-CZ 2.67Å; E238-R277 VanDerWaalsContact OE1-CZ 3.25Å; E238-R277 IonicContact OE1-NH1 3Å; E238-R277 PolarHBondContact OE1-NH1 2.91Å; E238-R277 IonicContact OE1-NH2 3.96Å; E238-R277 PolarHBondContact OE1-NH2 2.84Å; E238-R277 IonicContact OE2-NH1 3.2Å
239	A	97.8	Very high	96.8	Very high	20 Å²	20	59.9 Å²	59.9	17%	0.165	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	169.6	168.1	0	0	0	0	0	111.2	F231 W237 P259	F231-A239 PolarHBondContact N-O 2.89Å; F231-A239 PolarHBondContact O-N 2.74Å; F231-A239 VanDerWaalsContact O-O 3.13Å; W237-A239 HydrophobicContact CH2-CB 3.97Å; W237-A239 HydrophobicContact CZ2-CB 3.32Å; A239-P259 HydrophobicContact CB-CB 3.54Å; A239-P259 HydrophobicContact CB-CG 3.64Å
240	R	98.1	Very high	96.7	Very high	157 Å²	157	69.6 Å²	69.6	59%	0.592	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.3	-176.7	-62.8	-169.4	-72.8	173.4	-1.3	112.2	E228 V229 P259	E228-R240 WeakPolarHBondContact OE2-CD 3.39Å; E228-R240 IonicContact OE2-CZ 3.7Å; E228-R240 IonicContact OE2-NE 3.52Å; E228-R240 IonicContact OE2-NH1 2.65Å; E228-R240 PolarHBondContact OE2-NH1 3.36Å; V229-R240 CarbonylContact O-C 3.56Å; V229-R240 WeakPolarHBondContact O-CA 3.38Å; R240-P259 WeakPolarHBondContact O-CB 3.14Å
241	G	98.1	Very high	96.7	Very high	8 Å²	8	70.5 Å²	70.5	8%	0.082	39%	0.387	C	S	.	.			trans	-62.1	134.1	167.4	0	0	0	0	0	110.6	V229 F243 K257	V229-G241 PolarHBondContact O-N 2.71Å; G241-F243 WeakPolarHBondContact O-CD1 3.27Å; G241-K257 WeakPolarHBondContact CA-O 3.23Å
242	S	98.4	Very high	96.7	Very high	88 Å²	88	73.3 Å²	73.3	62%	0.615	41%	0.405	S	S	*	.	B	Isolated β-bridge	trans	-91.5	116.8	-178.1	-174.6	0	0	0	0	110.6	F256 K257	S242-F256 WeakPolarHBondContact O-CA 3.18Å; S242-K257 PolarHBondContact N-O 3.14Å; S242-K257 PolarHBondContact O-N 3.33Å
243	F	98.6	Very high	96.7	Very high	53 Å²	53	72.2 Å²	72.2	23%	0.232	40%	0.403	C	S	.	.			trans	-156.4	168.4	174.8	65.8	-77.6	0	0	0	110.7	I227 V229 G241 D247 V248 I254 V255 F256	I227-F243 HydrophobicContact CG2-CE2 4.31Å; I227-F243 HydrophobicContact CG2-CZ 4.27Å; V229-F243 HydrophobicContact CG2-CE1 4.09Å; G241-F243 WeakPolarHBondContact O-CD1 3.27Å; F243-D247 HydrophobicContact CB-CB 4.16Å; F243-V248 HydrophobicContact CD2-CG2 3.94Å; F243-V248 HydrophobicContact CE2-CG2 3.6Å; F243-I254 HydrophobicContact CD1-CG2 4.19Å; F243-I254 HydrophobicContact CD2-CG2 3.7Å; F243-I254 HydrophobicContact CE1-CG2 4.27Å; F243-I254 HydrophobicContact CE2-CG2 3.8Å; F243-I254 HydrophobicContact CG-CG2 3.93Å; F243-I254 HydrophobicContact CZ-CG2 4.08Å; F243-V255 VanDerWaalsContact CB-O 3.22Å; F243-V255 WeakPolarHBondContact CB-O 3.33Å; F243-F256 HydrophobicContact CB-CB 3.67Å; F243-F256 HydrophobicContact CD1-CB 3.73Å; F243-F256 HydrophobicContact CG-CB 3.97Å
244	S	98.1	Very high	96.9	Very high	59 Å²	59	71.5 Å²	71.5	41%	0.413	40%	0.397	S	S	.	.			trans	-111.2	167.6	174.8	78.7	0	0	0	0	111.5	A246 D247	S244-A246 PolarHBondContact O-N 3.21Å; S244-A246 VanDerWaalsContact O-N 3.08Å; S244-A246 PolarHBondContact OG-N 3Å; S244-D247 WeakPolarHBondContact CA-OD2 3.26Å; S244-D247 VanDerWaalsContact CB-OD2 3.29Å; S244-D247 WeakPolarHBondContact CB-OD2 3.47Å; S244-D247 PolarHBondContact N-OD2 3.06Å; S244-D247 PolarHBondContact O-N 2.96Å; S244-D247 PolarHBondContact OG-OD2 2.74Å
245	Q	97.9	Very high	97.2	Very high	105 Å²	105	67 Å²	67	49%	0.491	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-58.1	-22.9	175	-60.7	-174.9	-5.7	0	0	113.8	K224 D225	K224-Q245 HydrophobicContact CD-CB 4.25Å; K224-Q245 HydrophobicContact CG-CB 4.15Å; K224-Q245 HydrophobicContact CG-CG 4.49Å; D225-Q245 PolarHBondContact OD1-NE2 2.96Å; D225-Q245 PolarHBondContact OD1-OE1 2.95Å; D225-Q245 VanDerWaalsContact OD1-OE1 3.09Å
246	A	98.1	Very high	97.7	Very high	88 Å²	88	63.3 Å²	63.3	73%	0.727	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-75.1	-25.6	178.2	0	0	0	0	0	112.7	S244 V248	S244-A246 PolarHBondContact O-N 3.21Å; S244-A246 VanDerWaalsContact O-N 3.08Å; S244-A246 PolarHBondContact OG-N 3Å; A246-V248 VanDerWaalsContact C-N 3.27Å; A246-V248 PolarHBondContact O-N 3.19Å
247	D	98.4	Very high	98	Very high	61 Å²	61	64.7 Å²	64.7	33%	0.326	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-81.6	-6.8	-178.1	-51.9	-64.6	0	0	0	112.8	F243 S244 H249 V255	F243-D247 HydrophobicContact CB-CB 4.16Å; S244-D247 WeakPolarHBondContact CA-OD2 3.26Å; S244-D247 VanDerWaalsContact CB-OD2 3.29Å; S244-D247 WeakPolarHBondContact CB-OD2 3.47Å; S244-D247 PolarHBondContact N-OD2 3.06Å; S244-D247 PolarHBondContact O-N 2.96Å; S244-D247 PolarHBondContact OG-OD2 2.74Å; D247-H249 VanDerWaalsContact C-N 3.35Å; D247-H249 PolarHBondContact O-N 3.15Å; D247-H249 VanDerWaalsContact O-N 3.1Å; D247-V255 HydrophobicContact CB-CB 4.33Å; D247-V255 VanDerWaalsContact CB-O 3.24Å; D247-V255 WeakPolarHBondContact CB-O 3.43Å; D247-V255 PolarHBondContact O-N 2.87Å
248	V	98.6	Very high	98.2	Very high	11 Å²	11	63.3 Å²	63.3	7%	0.067	33%	0.326	C	S	.	.	S	Bend	trans	-82.9	77.5	174	-173.9	0	0	0	0	109.9	V222 K224 I227 F243 A246 R250 A253 I254	V222-V248 HydrophobicContact CG2-CG1 3.95Å; K224-V248 HydrophobicContact CB-CB 3.71Å; K224-V248 HydrophobicContact CB-CG1 3.85Å; K224-V248 HydrophobicContact CB-CG2 3.96Å; I227-V248 HydrophobicContact CG2-CG2 4.36Å; F243-V248 HydrophobicContact CD2-CG2 3.94Å; F243-V248 HydrophobicContact CE2-CG2 3.6Å; A246-V248 VanDerWaalsContact C-N 3.27Å; A246-V248 PolarHBondContact O-N 3.19Å; V248-R250 PolarHBondContact O-N 3.18Å; V248-R250 VanDerWaalsContact O-N 3.1Å; V248-A253 CarbonylContact C-O 3.53Å; V248-A253 WeakPolarHBondContact CA-O 3.47Å; V248-I254 HydrophobicContact CG1-CG1 4.42Å; V248-I254 HydrophobicContact CG2-CG1 4.46Å
249	H	98.4	Very high	98.2	Very high	119 Å²	119	60.2 Å²	60.2	55%	0.551	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-62.1	113.1	-176.2	-171.7	91.2	0	0	0	112.5	D247 Q251 V252 A253	D247-H249 VanDerWaalsContact C-N 3.35Å; D247-H249 PolarHBondContact O-N 3.15Å; D247-H249 VanDerWaalsContact O-N 3.1Å; H249-Q251 PolarHBondContact O-N 3.38Å; H249-V252 PolarHBondContact O-N 2.76Å; H249-V252 VanDerWaalsContact O-N 3.09Å; H249-A253 HydrophobicContact CB-CB 4.33Å; H249-A253 PolarHBondContact N-O 2.89Å; H249-A253 PolarHBondContact O-N 3.24Å; H249-A253 VanDerWaalsContact O-N 3.16Å
250	R	97.4	Very high	98.2	Very high	205 Å²	205	63 Å²	63	77%	0.774	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	52.1	28.6	171.3	-60.9	-70	-172.5	180	1	114.8	V248 V252	V248-R250 PolarHBondContact O-N 3.18Å; V248-R250 VanDerWaalsContact O-N 3.1Å; R250-V252 HydrophobicContact CB-CG2 4.32Å; R250-V252 PolarHBondContact O-N 3.08Å
251	Q	97.4	Very high	98	Very high	71 Å²	71	56.1 Å²	56.1	33%	0.332	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	64.5	6.4	-176.2	-54.3	-173.7	-86.4	0	0	116.2	K221 V222 H249	K221-Q251 WeakPolarHBondContact CA-O 3.22Å; V222-Q251 PolarHBondContact N-O 3.46Å; V222-Q251 VanDerWaalsContact O-CB 3.31Å; V222-Q251 WeakPolarHBondContact O-CB 3.46Å; V222-Q251 WeakPolarHBondContact O-CG 3.49Å; V222-Q251 PolarHBondContact O-NE2 2.88Å; H249-Q251 PolarHBondContact O-N 3.38Å
252	V	98.2	Very high	97.6	Very high	60 Å²	60	61 Å²	61	36%	0.364	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.3	-2.4	-172.5	-63.9	0	0	0	0	113.8	C219 K221 H249 R250	C219-V252 PolarHBondContact N-O 3.09Å; K221-V252 HydrophobicContact CG-CG1 4.04Å; H249-V252 PolarHBondContact O-N 2.76Å; H249-V252 VanDerWaalsContact O-N 3.09Å; R250-V252 HydrophobicContact CB-CG2 4.32Å; R250-V252 PolarHBondContact O-N 3.08Å
253	A	98.5	Very high	97.1	Very high	15 Å²	15	62.2 Å²	62.2	12%	0.124	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	155.2	167.8	0	0	0	0	0	110.7	L217 L218 V248 H249	L217-A253 CarbonylContact O-C 3.53Å; L217-A253 WeakPolarHBondContact O-CA 3.43Å; L217-A253 WeakPolarHBondContact O-CB 3.5Å; L218-A253 HydrophobicContact CD2-CB 3.7Å; V248-A253 CarbonylContact C-O 3.53Å; V248-A253 WeakPolarHBondContact CA-O 3.47Å; H249-A253 HydrophobicContact CB-CB 4.33Å; H249-A253 PolarHBondContact N-O 2.89Å; H249-A253 PolarHBondContact O-N 3.24Å; H249-A253 VanDerWaalsContact O-N 3.16Å
254	I	98.7	Very high	96.4	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	126.3	173.6	-52.8	178.2	0	0	0	107.2	L217 I227 V229 F243 V248 F256 L276	L217-I254 PolarHBondContact N-O 3.36Å; L217-I254 PolarHBondContact O-N 2.81Å; I227-I254 HydrophobicContact CG1-CD1 3.95Å; I227-I254 HydrophobicContact CG2-CD1 4.32Å; V229-I254 HydrophobicContact CG2-CD1 4.37Å; F243-I254 HydrophobicContact CD1-CG2 4.19Å; F243-I254 HydrophobicContact CD2-CG2 3.7Å; F243-I254 HydrophobicContact CE1-CG2 4.27Å; F243-I254 HydrophobicContact CE2-CG2 3.8Å; F243-I254 HydrophobicContact CG-CG2 3.93Å; F243-I254 HydrophobicContact CZ-CG2 4.08Å; V248-I254 HydrophobicContact CG1-CG1 4.42Å; V248-I254 HydrophobicContact CG2-CG1 4.46Å; I254-F256 HydrophobicContact CG2-CB 4.32Å; I254-F256 HydrophobicContact CG2-CD1 4.27Å; I254-L276 HydrophobicContact CD1-CD2 3.87Å
255	V	98.7	Very high	95.8	Very high	29 Å²	29	66.5 Å²	66.5	18%	0.176	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.9	163.8	-172.9	0	0	0	0	107.6	E214 I215 F216 F243 D247	E214-V255 HydrophobicContact CG-CG1 3.78Å; I215-V255 WeakPolarHBondContact O-CA 3.36Å; F216-V255 HydrophobicContact CD1-CG2 3.68Å; F216-V255 HydrophobicContact CD2-CG1 4.31Å; F216-V255 HydrophobicContact CE1-CG1 4.39Å; F216-V255 HydrophobicContact CE1-CG2 3.6Å; F216-V255 HydrophobicContact CE2-CG1 3.98Å; F216-V255 HydrophobicContact CG-CG2 4.21Å; F216-V255 HydrophobicContact CZ-CG1 4.03Å; F216-V255 HydrophobicContact CZ-CG2 4.07Å; F243-V255 VanDerWaalsContact CB-O 3.22Å; F243-V255 WeakPolarHBondContact CB-O 3.33Å; D247-V255 HydrophobicContact CB-CB 4.33Å; D247-V255 VanDerWaalsContact CB-O 3.24Å; D247-V255 WeakPolarHBondContact CB-O 3.43Å; D247-V255 PolarHBondContact O-N 2.87Å
256	F	98.7	Very high	95.4	Very high	3 Å²	3	62.9 Å²	62.9	1%	0.013	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	164.1	-179.5	73.8	-88.4	0	0	0	112.2	E214 I215 L217 V229 F231 S242 F243 I254 M274	E214-F256 WeakPolarHBondContact CA-O 3.17Å; I215-F256 HydrophobicContact CB-CD1 4.29Å; I215-F256 HydrophobicContact CB-CE1 3.72Å; I215-F256 HydrophobicContact CB-CE2 4.1Å; I215-F256 HydrophobicContact CB-CZ 3.6Å; I215-F256 HydrophobicContact CD1-CE2 4.08Å; I215-F256 HydrophobicContact CD1-CZ 3.82Å; I215-F256 HydrophobicContact CG1-CE2 4.46Å; I215-F256 HydrophobicContact CG1-CZ 4.21Å; I215-F256 HydrophobicContact CG2-CD1 4.44Å; I215-F256 HydrophobicContact CG2-CE1 3.56Å; I215-F256 HydrophobicContact CG2-CZ 3.63Å; I215-F256 PolarHBondContact N-O 3.17Å; I215-F256 PolarHBondContact O-N 3.44Å; L217-F256 HydrophobicContact CB-CE1 4Å; L217-F256 HydrophobicContact CD1-CE1 3.95Å; V229-F256 HydrophobicContact CG1-CE1 4.09Å; V229-F256 HydrophobicContact CG1-CE2 4.14Å; V229-F256 HydrophobicContact CG1-CZ 3.83Å; V229-F256 HydrophobicContact CG2-CD1 3.91Å; V229-F256 HydrophobicContact CG2-CE1 4.03Å; V229-F256 HydrophobicContact CG2-CG 4.26Å; F231-F256 HydrophobicContact CE2-CD2 4.47Å; F231-F256 AromaticContact CE2-CE2 3.58Å; F231-F256 HydrophobicContact CE2-CE2 3.58Å; F231-F256 HydrophobicContact CE2-CZ 4.14Å; F231-F256 AromaticContact CZ-CE2 3.62Å; F231-F256 HydrophobicContact CZ-CE2 3.62Å; F231-F256 AromaticContact CZ-CZ 3.96Å; F231-F256 HydrophobicContact CZ-CZ 3.96Å; S242-F256 WeakPolarHBondContact O-CA 3.18Å; F243-F256 HydrophobicContact CB-CB 3.67Å; F243-F256 HydrophobicContact CD1-CB 3.73Å; F243-F256 HydrophobicContact CG-CB 3.97Å; I254-F256 HydrophobicContact CG2-CB 4.32Å; I254-F256 HydrophobicContact CG2-CD1 4.27Å; F256-M274 HydrophobicContact CE1-SD 4.5Å; F256-M274 HydrophobicContact CE2-SD 4.47Å; F256-M274 HydrophobicContact CZ-SD 3.67Å
257	K	98.6	Very high	94.9	Very high	98 Å²	98	64.9 Å²	64.9	43%	0.426	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130.9	175.5	-68.3	177.2	-177.9	174.2	0	111.3	D213 E214 G241 S242	D213-K257 CarbonylContact O-C 3.59Å; D213-K257 VanDerWaalsContact O-CA 3.31Å; D213-K257 WeakPolarHBondContact O-CA 3.38Å; E214-K257 HydrophobicContact CB-CG 4.46Å; E214-K257 WeakPolarHBondContact OE1-CE 3.24Å; E214-K257 IonicContact OE1-NZ 3.8Å; G241-K257 WeakPolarHBondContact CA-O 3.23Å; S242-K257 PolarHBondContact N-O 3.14Å; S242-K257 PolarHBondContact O-N 3.33Å
258	T	98.3	Very high	94.6	Very high	4 Å²	4	69.3 Å²	69.3	3%	0.025	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-58.4	139.6	179.7	53.5	0	0	0	0	111.5	G211 G212 D213 I215 F231 F290	G211-T258 CarbonylContact C-O 3.59Å; G211-T258 WeakPolarHBondContact CA-O 3.38Å; G211-T258 WeakPolarHBondContact CA-OG1 3.46Å; G212-T258 PolarHBondContact N-O 2.04Å; G212-T258 PolarHBondContact N-OG1 2.91Å; D213-T258 HydrophobicContact CB-CG2 4.17Å; D213-T258 PolarHBondContact N-OG1 2.82Å; D213-T258 VanDerWaalsContact N-OG1 3.14Å; D213-T258 PolarHBondContact O-N 3.04Å; I215-T258 HydrophobicContact CD1-CG2 3.35Å; I215-T258 HydrophobicContact CG1-CG2 4.02Å; F231-T258 HydrophobicContact CZ-CG2 4.16Å; T258-F290 HydrophobicContact CG2-CE1 4.24Å; T258-F290 HydrophobicContact CG2-CE2 4.12Å; T258-F290 HydrophobicContact CG2-CZ 3.65Å
259	P	97.8	Very high	94.4	Very high	10 Å²	10	71.8 Å²	71.8	7%	0.065	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-66.6	158.4	170.2	26.2	-28.4	0	0	0	111.4	G211 F231 W237 A239 R240 Y292	G211-P259 WeakPolarHBondContact CA-O 3.42Å; F231-P259 HydrophobicContact CB-CG 4.04Å; F231-P259 VanDerWaalsContact CD2-CD 3.47Å; F231-P259 HydrophobicContact CD2-CG 3.63Å; F231-P259 HydrophobicContact CE2-CG 4.22Å; F231-P259 HydrophobicContact CG-CG 3.81Å; W237-P259 HydrophobicContact CH2-CG 4.45Å; A239-P259 HydrophobicContact CB-CB 3.54Å; A239-P259 HydrophobicContact CB-CG 3.64Å; R240-P259 WeakPolarHBondContact O-CB 3.14Å; P259-Y292 WeakPolarHBondContact O-CE1 3.21Å; P259-Y292 PolarHBondContact O-OH 3.05Å
260	P	96.4	Very high	94.3	Very high	78 Å²	78	68.1 Å²	68.1	51%	0.506	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-67.4	142.6	164.9	29.9	-34.1	0	0	0	110.4	W237	W237-P260 WeakPolarHBondContact CZ2-O 3.07Å
261	Y	94.9	Very high	94.2	Very high	14 Å²	14	61.2 Å²	61.2	6%	0.055	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-78.2	145	171.7	-174.7	-118.2	0	0	0	110.3	V209 W237 H263 I266 V270 V272 Y292	V209-Y261 HydrophobicContact CG2-CD1 3.87Å; V209-Y261 HydrophobicContact CG2-CG 4.27Å; V209-Y261 PolarHBondContact O-N 2.82Å; W237-Y261 HydrophobicContact CD2-CD2 4.07Å; W237-Y261 HydrophobicContact CD2-CE2 4.21Å; W237-Y261 AromaticContact CE3-CD2 3.87Å; W237-Y261 HydrophobicContact CE3-CD2 3.87Å; W237-Y261 AromaticContact CE3-CE2 3.9Å; W237-Y261 HydrophobicContact CE3-CE2 3.9Å; W237-Y261 AromaticContact CH2-CD2 3.96Å; W237-Y261 HydrophobicContact CH2-CD2 3.96Å; W237-Y261 HydrophobicContact CZ2-CD2 4.14Å; W237-Y261 AromaticContact CZ3-CD2 3.83Å; W237-Y261 HydrophobicContact CZ3-CD2 3.83Å; W237-Y261 HydrophobicContact CZ3-CE2 4.21Å; Y261-H263 HydrophobicContact CD1-CB 4.49Å; Y261-H263 WeakPolarHBondContact CD1-O 3.41Å; Y261-H263 HydrophobicContact CE1-CB 4.41Å; Y261-H263 PolarHBondContact O-N 2.82Å; Y261-I266 HydrophobicContact CD1-CG2 4.28Å; Y261-I266 HydrophobicContact CE1-CG2 4.1Å; Y261-V270 HydrophobicContact CE1-CB 4.49Å; Y261-V270 HydrophobicContact CE1-CG1 4.43Å; Y261-V270 HydrophobicContact CE1-CG2 4.46Å; Y261-V272 HydrophobicContact CD2-CG1 4.17Å; Y261-V272 HydrophobicContact CE2-CG1 3.72Å; Y261-Y292 AromaticContact CD2-CD2 3.76Å; Y261-Y292 HydrophobicContact CD2-CD2 3.76Å; Y261-Y292 AromaticContact CD2-CE2 3.83Å; Y261-Y292 HydrophobicContact CD2-CE2 3.83Å; Y261-Y292 AromaticContact CG-CD2 3.91Å; Y261-Y292 HydrophobicContact CG-CD2 3.91Å; Y261-Y292 HydrophobicContact CG-CE2 4.18Å; Y261-Y292 HydrophobicContact CG-CG 4.34Å
262	Y	89.8	Confident	94.2	Very high	111 Å²	111	57.9 Å²	57.9	44%	0.435	31%	0.313	S	S	.	.	S	Bend	trans	-64.3	-15.4	-171.1	75.4	-72.4	0	0	0	115.3	N235 W237	N235-Y262 PolarHBondContact ND2-OH 2.86Å; W237-Y262 HydrophobicContact CB-CD1 3.75Å; W237-Y262 HydrophobicContact CB-CE1 3.97Å; W237-Y262 HydrophobicContact CB-CG 4.45Å; W237-Y262 AromaticContact CD1-CD1 3.61Å; W237-Y262 AromaticContact CD1-CG 3.79Å; W237-Y262 HydrophobicContact CD2-CD1 4.04Å; W237-Y262 AromaticContact CG-CD1 3.48Å; W237-Y262 HydrophobicContact CG-CD1 3.48Å; W237-Y262 VanDerWaalsContact CG-CD1 3.48Å; W237-Y262 HydrophobicContact CG-CE1 4.17Å; W237-Y262 HydrophobicContact CG-CG 4.11Å
263	H	87	Confident	94.2	Very high	113 Å²	113	58.3 Å²	58.3	52%	0.523	31%	0.311	S	S	.	.			trans	-121.6	101.4	167.7	-81.6	35.3	0	0	0	109.5	V209 Y261 N265 I266	V209-H263 VanDerWaalsContact CG2-O 3.24Å; V209-H263 WeakPolarHBondContact CG2-O 3.34Å; Y261-H263 HydrophobicContact CD1-CB 4.49Å; Y261-H263 WeakPolarHBondContact CD1-O 3.41Å; Y261-H263 HydrophobicContact CE1-CB 4.41Å; Y261-H263 PolarHBondContact O-N 2.82Å; H263-N265 PolarHBondContact O-N 2.94Å; H263-I266 WeakPolarHBondContact O-CG2 3.29Å
264	T	83.9	Confident	94.2	Very high	57 Å²	57	57.6 Å²	57.6	35%	0.35	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-11.4	179.4	48.2	0	0	0	0	114.3	V209 K210	V209-T264 WeakPolarHBondContact CG1-O 3.39Å; K210-T264 HydrophobicContact CG-CG2 4.39Å
265	N	86.3	Confident	94.2	Very high	144 Å²	144	58.1 Å²	58.1	77%	0.77	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	33.1	-176.4	-68.9	-37.4	0	0	0	113.8	H263	H263-N265 PolarHBondContact O-N 2.94Å
266	I	89.1	Confident	94.2	Very high	30 Å²	30	56.7 Å²	56.7	15%	0.154	30%	0.299	C	S	.	.			trans	-66	143	173.9	67.6	-173.9	0	0	0	111.2	V209 Y261 H263 E268 V270 P294	V209-I266 HydrophobicContact CB-CD1 3.82Å; V209-I266 HydrophobicContact CB-CG1 4.14Å; V209-I266 HydrophobicContact CG1-CG1 4.43Å; V209-I266 HydrophobicContact CG2-CD1 3.58Å; V209-I266 HydrophobicContact CG2-CG1 3.88Å; V209-I266 HydrophobicContact CG2-CG2 4.42Å; Y261-I266 HydrophobicContact CD1-CG2 4.28Å; Y261-I266 HydrophobicContact CE1-CG2 4.1Å; H263-I266 WeakPolarHBondContact O-CG2 3.29Å; I266-E268 WeakPolarHBondContact CD1-O 3.35Å; I266-E268 WeakPolarHBondContact CG1-O 3.49Å; I266-V270 HydrophobicContact CD1-CG2 4.15Å; I266-V270 HydrophobicContact CG2-CG2 4.05Å; I266-P294 HydrophobicContact CG1-CB 4.08Å; I266-P294 VanDerWaalsContact O-CB 3.27Å; I266-P294 WeakPolarHBondContact O-CB 3.19Å
267	T	88.8	Confident	94.2	Very high	130 Å²	130	58 Å²	58	80%	0.798	30%	0.303	S	S	*	.	S	Bend	trans	-95.2	-29.4	173	47.3	0	0	0	0	112.6
268	E	91.7	Very high	94.1	Very high	154 Å²	154	53.4 Å²	53.4	72%	0.72	28%	0.283	S	S	*	.	S	Bend	trans	-116.2	165.2	179.3	-60.9	-173.5	163	0	0	110.1	I266	I266-E268 WeakPolarHBondContact CD1-O 3.35Å; I266-E268 WeakPolarHBondContact CG1-O 3.49Å
269	S	94.3	Very high	94.1	Very high	62 Å²	62	55.6 Å²	55.6	43%	0.434	30%	0.298	S	S	.	.			trans	-78.5	131.3	179.1	62	0	0	0	0	111.8	Y292	S269-Y292 CarbonylContact C-O 3.56Å; S269-Y292 WeakPolarHBondContact CA-O 3.25Å; S269-Y292 WeakPolarHBondContact CB-O 3.38Å
270	V	95.2	Very high	94	Very high	42 Å²	42	59.2 Å²	59.2	26%	0.255	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.8	-179.7	-178.1	0	0	0	0	110.4	Y261 I266 V272 R291 Y292	Y261-V270 HydrophobicContact CE1-CB 4.49Å; Y261-V270 HydrophobicContact CE1-CG1 4.43Å; Y261-V270 HydrophobicContact CE1-CG2 4.46Å; I266-V270 HydrophobicContact CD1-CG2 4.15Å; I266-V270 HydrophobicContact CG2-CG2 4.05Å; V270-V272 HydrophobicContact CG1-CG1 4.48Å; V270-R291 CarbonylContact O-C 3.57Å; V270-R291 WeakPolarHBondContact O-CA 3.21Å; V270-Y292 PolarHBondContact N-O 2.87Å; V270-Y292 PolarHBondContact O-N 2.7Å
271	T	96.9	Very high	93.9	Very high	60 Å²	60	58.1 Å²	58.1	37%	0.368	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	134.7	169.6	-55.9	0	0	0	0	110.1	D289 F290	T271-D289 HydrophobicContact CG2-CB 3.91Å; T271-F290 WeakPolarHBondContact CA-O 3.39Å
272	V	97.2	Very high	94	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.006	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	168.8	168.6	-57.6	0	0	0	0	108.5	F231 W237 Y261 V270 F290 Y292	F231-V272 HydrophobicContact CD1-CG2 4.23Å; W237-V272 HydrophobicContact CE3-CG1 4.25Å; W237-V272 HydrophobicContact CZ3-CB 4.2Å; W237-V272 HydrophobicContact CZ3-CG1 3.95Å; W237-V272 HydrophobicContact CZ3-CG2 4.19Å; Y261-V272 HydrophobicContact CD2-CG1 4.17Å; Y261-V272 HydrophobicContact CE2-CG1 3.72Å; V270-V272 HydrophobicContact CG1-CG1 4.48Å; V272-F290 HydrophobicContact CG2-CB 4.2Å; V272-F290 HydrophobicContact CG2-CD1 4.26Å; V272-F290 WeakPolarHBondContact CG2-O 3.31Å; V272-F290 PolarHBondContact N-O 3.12Å; V272-F290 PolarHBondContact O-N 2.85Å; V272-F290 VanDerWaalsContact O-O 3.09Å; V272-Y292 HydrophobicContact CG1-CD2 4.05Å; V272-Y292 HydrophobicContact CG1-CE2 4.28Å; V272-Y292 HydrophobicContact CG2-CD2 3.9Å; V272-Y292 HydrophobicContact CG2-CE2 3.7Å
273	H	98.1	Very high	94.3	Very high	69 Å²	69	59.8 Å²	59.8	32%	0.319	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	146	173.4	-55.8	108.7	0	0	0	110.9	F231 F232 P287 D289	F231-H273 CarbonylContact C-O 3.4Å; F231-H273 WeakPolarHBondContact CA-O 3.27Å; F232-H273 HydrophobicContact CD1-CB 3.95Å; F232-H273 HydrophobicContact CD2-CB 4.43Å; F232-H273 HydrophobicContact CE1-CB 3.42Å; F232-H273 VanDerWaalsContact CE1-CB 3.42Å; F232-H273 HydrophobicContact CE2-CB 3.99Å; F232-H273 AromaticContact CE2-ND1 3.97Å; F232-H273 HydrophobicContact CG-CB 4.42Å; F232-H273 HydrophobicContact CZ-CB 3.46Å; F232-H273 VanDerWaalsContact CZ-CB 3.46Å; F232-H273 PolarHBondContact N-O 3.05Å; F232-H273 PolarHBondContact O-N 2.91Å; H273-P287 HydrophobicContact CB-CB 4.1Å; H273-D289 IonicContact CD2-OD1 3.18Å
274	M	97.9	Very high	94.8	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.6	172.5	177.8	-179.1	64.1	0	0	109.1	V202 L217 V229 R230 F231 F256 M288 F290	V202-M274 HydrophobicContact CG1-CE 4Å; L217-M274 HydrophobicContact CD1-CE 4.46Å; V229-M274 HydrophobicContact CG1-CG 3.7Å; V229-M274 HydrophobicContact CG1-SD 3.89Å; R230-M274 WeakPolarHBondContact O-CA 3.44Å; F231-M274 HydrophobicContact CD1-CB 4.14Å; F231-M274 HydrophobicContact CD1-CG 4.36Å; F231-M274 HydrophobicContact CD2-CG 4.44Å; F231-M274 HydrophobicContact CE1-CB 4.03Å; F231-M274 HydrophobicContact CE1-CG 3.99Å; F231-M274 HydrophobicContact CE1-SD 3.73Å; F231-M274 HydrophobicContact CE2-CG 4.07Å; F231-M274 HydrophobicContact CE2-SD 3.92Å; F231-M274 HydrophobicContact CZ-CB 4.39Å; F231-M274 HydrophobicContact CZ-CG 3.83Å; F231-M274 HydrophobicContact CZ-SD 3.29Å; F231-M274 WeakPolarHBondContact CZ-SD 3.45Å; F256-M274 HydrophobicContact CE1-SD 4.5Å; F256-M274 HydrophobicContact CE2-SD 4.47Å; F256-M274 HydrophobicContact CZ-SD 3.67Å; M274-M288 HydrophobicContact CE-CE 3.32Å; M274-M288 PolarHBondContact N-O 3.29Å; M274-M288 PolarHBondContact O-N 2.82Å; M274-F290 HydrophobicContact CB-CB 4.22Å
275	Q	98.3	Very high	95.4	Very high	11 Å²	11	54.7 Å²	54.7	5%	0.051	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	162.4	178.3	68.6	-172.1	37.4	0	0	111	R230 F232	R230-Q275 HydrophobicContact CB-CG 4.07Å; R230-Q275 PolarHBondContact N-O 3.26Å; R230-Q275 VanDerWaalsContact NH1-NE2 3.15Å; R230-Q275 PolarHBondContact O-N 3.32Å; F232-Q275 HydrophobicContact CD1-CG 4.34Å; F232-Q275 HydrophobicContact CE1-CB 4.37Å; F232-Q275 VanDerWaalsContact CE1-CD 3.43Å; F232-Q275 HydrophobicContact CE1-CG 3.82Å
276	L	98.6	Very high	95.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	145.6	162.3	-63.1	170.5	0	0	0	109.2	L197 I199 L217 C219 V222 I227 V229 I254 V284 S285	L197-L276 HydrophobicContact CB-CB 4.25Å; L197-L276 HydrophobicContact CD1-CB 4.04Å; I199-L276 HydrophobicContact CD1-CG 4.42Å; I199-L276 HydrophobicContact CG1-CD1 4.04Å; I199-L276 HydrophobicContact CG1-CG 3.83Å; L217-L276 HydrophobicContact CD1-CD2 4.42Å; L217-L276 HydrophobicContact CD2-CD2 4.2Å; C219-L276 HydrophobicContact CB-CD1 3.88Å; V222-L276 HydrophobicContact CG1-CD1 4.47Å; I227-L276 HydrophobicContact CD1-CB 4.18Å; I227-L276 HydrophobicContact CD1-CD2 4.3Å; I227-L276 HydrophobicContact CG1-CD2 4.34Å; V229-L276 HydrophobicContact CG2-CD2 4.18Å; I254-L276 HydrophobicContact CD1-CD2 3.87Å; L276-V284 CarbonylContact O-C 3.56Å; L276-V284 VanDerWaalsContact O-CA 3.27Å; L276-V284 WeakPolarHBondContact O-CA 3.34Å; L276-S285 PolarHBondContact N-OG 2.92Å; L276-S285 PolarHBondContact O-N 3.21Å
277	R	98.3	Very high	96.3	Very high	30 Å²	30	57.3 Å²	57.3	11%	0.113	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	139.9	164.9	-179.2	167.4	67	-155.7	-9.1	109.7	E228 R230 E238 P279 E283 V284	E228-R277 HydrophobicContact CG-CB 4.11Å; E228-R277 PolarHBondContact N-O 3.4Å; E228-R277 PolarHBondContact O-N 3.05Å; E228-R277 IonicContact OE1-CZ 3.14Å; E228-R277 IonicContact OE1-NE 3.14Å; E228-R277 PolarHBondContact OE1-NE 2.83Å; E228-R277 IonicContact OE1-NH2 2.77Å; E228-R277 PolarHBondContact OE1-NH2 2.89Å; R230-R277 HydrophobicContact CB-CB 4.47Å; E238-R277 IonicContact OE1-CZ 2.67Å; E238-R277 VanDerWaalsContact OE1-CZ 3.25Å; E238-R277 IonicContact OE1-NH1 3Å; E238-R277 PolarHBondContact OE1-NH1 2.91Å; E238-R277 IonicContact OE1-NH2 3.96Å; E238-R277 PolarHBondContact OE1-NH2 2.84Å; E238-R277 IonicContact OE2-NH1 3.2Å; R277-P279 WeakPolarHBondContact O-CD 3.36Å; R277-E283 CarbonylContact C-O 3.34Å; R277-E283 WeakPolarHBondContact CA-O 3.03Å; R277-V284 HydrophobicContact CB-CG1 4.14Å; R277-V284 HydrophobicContact CG-CG1 4.03Å
278	R	97.8	Very high	96.7	Very high	1 Å²	1	53.9 Å²	53.9	0%	0.004	29%	0.29	C	S	.	.			trans	-94.6	112.5	168.4	-173.3	-172.6	-46.5	-84	7.9	108.6	P192 N193 A195 L197 D226 S280 D281 Q282 E283	P192-R278 PolarHBondContact O-NH1 2.86Å; P192-R278 PolarHBondContact O-NH2 2.87Å; P192-R278 VanDerWaalsContact O-NH2 3.08Å; N193-R278 VanDerWaalsContact O-CZ 3.23Å; N193-R278 PolarHBondContact O-NE 3.48Å; A195-R278 PolarHBondContact O-NH2 3.46Å; L197-R278 HydrophobicContact CD1-CB 4.05Å; D226-R278 VanDerWaalsContact CG-CG 3.45Å; D226-R278 WeakPolarHBondContact OD1-CG 3.25Å; D226-R278 VanDerWaalsContact OD2-CD 3.27Å; D226-R278 WeakPolarHBondContact OD2-CD 3.38Å; D226-R278 WeakPolarHBondContact OD2-CG 3.45Å; D226-R278 IonicContact OD2-NH1 2.78Å; R278-S280 VanDerWaalsContact C-N 3.29Å; R278-S280 VanDerWaalsContact CD-OG 3.31Å; R278-S280 WeakPolarHBondContact CD-OG 3.46Å; R278-S280 WeakPolarHBondContact CG-OG 3.13Å; R278-S280 PolarHBondContact O-N 2.95Å; R278-D281 VanDerWaalsContact CD-OD1 3.25Å; R278-D281 WeakPolarHBondContact CD-OD1 3.47Å; R278-D281 IonicContact NE-OD1 2.86Å; R278-Q282 WeakPolarHBondContact O-CA 3.3Å; R278-Q282 PolarHBondContact O-N 3.31Å; R278-E283 HydrophobicContact CB-CB 4.33Å; R278-E283 PolarHBondContact N-O 3.02Å
279	P	97.6	Very high	97	Very high	51 Å²	51	50.8 Å²	50.8	33%	0.331	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-34.5	-179.4	-29.3	37.2	0	0	0	115	D226 E228 R277 D281 Q282	D226-P279 VanDerWaalsContact OD1-CD 3.29Å; D226-P279 WeakPolarHBondContact OD1-CD 3.31Å; E228-P279 HydrophobicContact CG-CG 4.09Å; R277-P279 WeakPolarHBondContact O-CD 3.36Å; P279-D281 PolarHBondContact O-N 2.86Å; P279-Q282 PolarHBondContact O-NE2 2.87Å
280	S	96.6	Very high	97.2	Very high	85 Å²	85	47.8 Å²	47.8	59%	0.594	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-34.5	-172.1	64.8	0	0	0	0	115.7	D226 R278	D226-S280 VanDerWaalsContact CG-OG 3.25Å; D226-S280 VanDerWaalsContact OD1-CB 3.25Å; D226-S280 WeakPolarHBondContact OD1-CB 3.45Å; D226-S280 PolarHBondContact OD1-N 2.92Å; D226-S280 PolarHBondContact OD1-OG 2.62Å; D226-S280 WeakPolarHBondContact OD2-CB 3.1Å; D226-S280 PolarHBondContact OD2-OG 3.22Å; R278-S280 VanDerWaalsContact C-N 3.29Å; R278-S280 VanDerWaalsContact CD-OG 3.31Å; R278-S280 WeakPolarHBondContact CD-OG 3.46Å; R278-S280 WeakPolarHBondContact CG-OG 3.13Å; R278-S280 PolarHBondContact O-N 2.95Å
281	D	94.3	Very high	97.3	Very high	55 Å²	55	51.7 Å²	51.7	29%	0.294	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	2.9	178.6	69.4	0.7	0	0	0	114	R30 R278 P279 E283	R30-D281 IonicContact CZ-OD2 3.75Å; R30-D281 IonicContact NH1-OD2 3.66Å; R30-D281 PolarHBondContact NH1-OD2 3.16Å; R30-D281 IonicContact NH2-OD2 2.82Å; R30-D281 PolarHBondContact NH2-OD2 3.1Å; R278-D281 VanDerWaalsContact CD-OD1 3.25Å; R278-D281 WeakPolarHBondContact CD-OD1 3.47Å; R278-D281 IonicContact NE-OD1 2.86Å; P279-D281 PolarHBondContact O-N 2.86Å; D281-E283 PolarHBondContact O-N 2.91Å; D281-E283 WeakPolarHBondContact OD1-CB 3.29Å; D281-E283 PolarHBondContact OD1-N 3.1Å
282	Q	96.3	Very high	97.3	Very high	110 Å²	110	48.8 Å²	48.8	51%	0.514	25%	0.25	S	S	.	.			trans	60.1	17.7	-175.6	-58.2	-67.6	-61.9	0	0	114.5	R278 P279	R278-Q282 WeakPolarHBondContact O-CA 3.3Å; R278-Q282 PolarHBondContact O-N 3.31Å; P279-Q282 PolarHBondContact O-NE2 2.87Å
283	E	95.6	Very high	97.2	Very high	51 Å²	51	52 Å²	52	24%	0.238	27%	0.267	C	S	.	.			trans	-60.4	145.1	171.3	-169.3	68.1	-150.3	0	0	110.7	R30 L197 R277 R278 D281	R30-E283 WeakPolarHBondContact CG-OE1 3.32Å; R30-E283 IonicContact CZ-OE2 2.7Å; R30-E283 IonicContact NE-OE1 3.87Å; R30-E283 IonicContact NE-OE2 2.96Å; R30-E283 PolarHBondContact NE-OE2 2.84Å; R30-E283 IonicContact NH2-OE2 3.32Å; R30-E283 PolarHBondContact NH2-OE2 3.35Å; L197-E283 WeakPolarHBondContact CD1-O 3.43Å; R277-E283 CarbonylContact C-O 3.34Å; R277-E283 WeakPolarHBondContact CA-O 3.03Å; R278-E283 HydrophobicContact CB-CB 4.33Å; R278-E283 PolarHBondContact N-O 3.02Å; D281-E283 PolarHBondContact O-N 2.91Å; D281-E283 WeakPolarHBondContact OD1-CB 3.29Å; D281-E283 PolarHBondContact OD1-N 3.1Å
284	V	97.2	Very high	97	Very high	58 Å²	58	51 Å²	51	35%	0.352	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-131.1	153.5	-176	-63.7	0	0	0	0	111.1	L276 R277	L276-V284 CarbonylContact O-C 3.56Å; L276-V284 VanDerWaalsContact O-CA 3.27Å; L276-V284 WeakPolarHBondContact O-CA 3.34Å; R277-V284 HydrophobicContact CB-CG1 4.14Å; R277-V284 HydrophobicContact CG-CG1 4.03Å
285	S	97.8	Very high	96.2	Very high	4 Å²	4	54.8 Å²	54.8	3%	0.028	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-78.2	164	166.2	72	0	0	0	0	111.1	L197 L276	L197-S285 VanDerWaalsContact O-CA 3.24Å; L197-S285 WeakPolarHBondContact O-CA 3.13Å; L197-S285 WeakPolarHBondContact O-CB 3.24Å; L276-S285 PolarHBondContact N-OG 2.92Å; L276-S285 PolarHBondContact O-N 3.21Å
286	E	96.5	Very high	95.2	Very high	165 Å²	165	59.1 Å²	59.1	77%	0.771	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-46.9	137.9	155.7	-68.8	-60.4	150.1	0	0	110.3
287	P	97.4	Very high	93.8	Very high	64 Å²	64	67.7 Å²	67.7	42%	0.416	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-78	153.7	179.6	32	-34.6	0	0	0	111.8	F232 H273	F232-P287 HydrophobicContact CE1-CB 4.38Å; F232-P287 HydrophobicContact CZ-CB 4.11Å; H273-P287 HydrophobicContact CB-CB 4.1Å
288	M	97.1	Very high	92.7	Very high	58 Å²	58	67.2 Å²	67.2	29%	0.286	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	138.9	175.7	-178.7	-179.9	69	0	0	110.5	I199 V202 M274 F290	I199-M288 HydrophobicContact CG2-CE 3.93Å; I199-M288 HydrophobicContact CG2-SD 4.26Å; V202-M288 HydrophobicContact CB-CE 4.2Å; V202-M288 HydrophobicContact CG1-CE 3.68Å; V202-M288 HydrophobicContact CG2-CE 3.45Å; V202-M288 VanDerWaalsContact CG2-CE 3.45Å; V202-M288 HydrophobicContact CG2-SD 4.24Å; M274-M288 HydrophobicContact CE-CE 3.32Å; M274-M288 PolarHBondContact N-O 3.29Å; M274-M288 PolarHBondContact O-N 2.82Å; M288-F290 PolarHBondContact O-N 3.48Å
289	D	97.8	Very high	91.3	Very high	89 Å²	89	71.8 Å²	71.8	48%	0.476	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	133.1	179.5	-74.9	11	0	0	0	112.9	T271 H273	T271-D289 HydrophobicContact CG2-CB 3.91Å; H273-D289 IonicContact CD2-OD1 3.18Å
290	F	98.1	Very high	90.1	Very high	0 Å²	0	79.8 Å²	79.8	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131	164.8	-175.7	-92.4	0	0	0	110.2	N205 S206 G207 I215 F231 T258 T271 V272 M274 M288 Y292	N205-F290 VanDerWaalsContact C-CD2 3.46Å; N205-F290 CarbonylContact O-C 3.47Å; N205-F290 WeakPolarHBondContact O-CA 3.38Å; S206-F290 VanDerWaalsContact C-CZ 3.49Å; G207-F290 VanDerWaalsContact N-CZ 3.31Å; I215-F290 HydrophobicContact CD1-CD2 4.13Å; I215-F290 HydrophobicContact CD1-CE2 3.51Å; I215-F290 HydrophobicContact CD1-CZ 4.23Å; F231-F290 HydrophobicContact CD1-CB 4.45Å; F231-F290 HydrophobicContact CD1-CD1 4.24Å; F231-F290 HydrophobicContact CD1-CG 4.39Å; F231-F290 HydrophobicContact CE1-CB 4.04Å; F231-F290 AromaticContact CE1-CD1 3.75Å; F231-F290 HydrophobicContact CE1-CD1 3.75Å; F231-F290 HydrophobicContact CE1-CD2 4.18Å; F231-F290 HydrophobicContact CE1-CE1 4.27Å; F231-F290 AromaticContact CE1-CG 3.7Å; F231-F290 HydrophobicContact CE1-CG 3.7Å; T258-F290 HydrophobicContact CG2-CE1 4.24Å; T258-F290 HydrophobicContact CG2-CE2 4.12Å; T258-F290 HydrophobicContact CG2-CZ 3.65Å; T271-F290 WeakPolarHBondContact CA-O 3.39Å; V272-F290 HydrophobicContact CG2-CB 4.2Å; V272-F290 HydrophobicContact CG2-CD1 4.26Å; V272-F290 WeakPolarHBondContact CG2-O 3.31Å; V272-F290 PolarHBondContact N-O 3.12Å; V272-F290 PolarHBondContact O-N 2.85Å; V272-F290 VanDerWaalsContact O-O 3.09Å; M274-F290 HydrophobicContact CB-CB 4.22Å; M288-F290 PolarHBondContact O-N 3.48Å; F290-Y292 HydrophobicContact CD1-CD2 4.34Å; F290-Y292 HydrophobicContact CD1-CE2 4.24Å; F290-Y292 AromaticContact CE1-CD1 3.9Å; F290-Y292 HydrophobicContact CE1-CD1 3.9Å; F290-Y292 HydrophobicContact CE1-CD2 4.45Å; F290-Y292 AromaticContact CE1-CE1 3.85Å; F290-Y292 HydrophobicContact CE1-CE1 3.85Å; F290-Y292 HydrophobicContact CE1-CE2 4.38Å; F290-Y292 HydrophobicContact CE1-CG 4.23Å
291	R	97.6	Very high	89	Confident	123 Å²	123	76.9 Å²	76.9	46%	0.464	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	111.2	-176	-167.1	-179.4	-60.7	156	6.4	112.2	N205 S206 G207 V270 L293	N205-R291 PolarHBondContact O-N 2.82Å; S206-R291 WeakPolarHBondContact CA-O 3.48Å; S206-R291 VanDerWaalsContact CB-O 3.24Å; S206-R291 WeakPolarHBondContact CB-O 3.33Å; G207-R291 PolarHBondContact N-O 2.98Å; G207-R291 VanDerWaalsContact N-O 3.12Å; V270-R291 CarbonylContact O-C 3.57Å; V270-R291 WeakPolarHBondContact O-CA 3.21Å; R291-L293 HydrophobicContact CG-CD2 4.19Å
292	Y	97.3	Very high	88.1	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	132.8	166.3	-75.6	-68.6	0	0	0	110.5	G207 S208 W237 P259 Y261 S269 V270 V272 F290	G207-Y292 CarbonylContact O-C 3.56Å; G207-Y292 WeakPolarHBondContact O-CA 3.36Å; S208-Y292 WeakPolarHBondContact O-CD1 3.34Å; W237-Y292 AromaticContact CH2-CE2 3.69Å; W237-Y292 HydrophobicContact CH2-CE2 3.69Å; W237-Y292 HydrophobicContact CZ3-CE2 4Å; P259-Y292 WeakPolarHBondContact O-CE1 3.21Å; P259-Y292 PolarHBondContact O-OH 3.05Å; Y261-Y292 AromaticContact CD2-CD2 3.76Å; Y261-Y292 HydrophobicContact CD2-CD2 3.76Å; Y261-Y292 AromaticContact CD2-CE2 3.83Å; Y261-Y292 HydrophobicContact CD2-CE2 3.83Å; Y261-Y292 AromaticContact CG-CD2 3.91Å; Y261-Y292 HydrophobicContact CG-CD2 3.91Å; Y261-Y292 HydrophobicContact CG-CE2 4.18Å; Y261-Y292 HydrophobicContact CG-CG 4.34Å; S269-Y292 CarbonylContact C-O 3.56Å; S269-Y292 WeakPolarHBondContact CA-O 3.25Å; S269-Y292 WeakPolarHBondContact CB-O 3.38Å; V270-Y292 PolarHBondContact N-O 2.87Å; V270-Y292 PolarHBondContact O-N 2.7Å; V272-Y292 HydrophobicContact CG1-CD2 4.05Å; V272-Y292 HydrophobicContact CG1-CE2 4.28Å; V272-Y292 HydrophobicContact CG2-CD2 3.9Å; V272-Y292 HydrophobicContact CG2-CE2 3.7Å; F290-Y292 HydrophobicContact CD1-CD2 4.34Å; F290-Y292 HydrophobicContact CD1-CE2 4.24Å; F290-Y292 AromaticContact CE1-CD1 3.9Å; F290-Y292 HydrophobicContact CE1-CD1 3.9Å; F290-Y292 HydrophobicContact CE1-CD2 4.45Å; F290-Y292 AromaticContact CE1-CE1 3.85Å; F290-Y292 HydrophobicContact CE1-CE1 3.85Å; F290-Y292 HydrophobicContact CE1-CE2 4.38Å; F290-Y292 HydrophobicContact CE1-CG 4.23Å
293	L	95.1	Very high	87.1	Confident	68 Å²	68	80 Å²	80	36%	0.356	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	142.3	179.6	-55.7	179.9	0	0	0	109.7	G207 V209 R291	G207-L293 PolarHBondContact O-N 3.22Å; V209-L293 WeakPolarHBondContact CB-O 3.49Å; V209-L293 PolarHBondContact N-O 3.25Å; R291-L293 HydrophobicContact CG-CD2 4.19Å
294	P	92.9	Very high	86.2	Confident	49 Å²	49	83.3 Å²	83.3	32%	0.318	41%	0.409	S	S	.	.			trans	-57.2	150.2	175.3	26.6	-36.2	0	0	0	110.9	I266 N296	I266-P294 HydrophobicContact CG1-CB 4.08Å; I266-P294 VanDerWaalsContact O-CB 3.27Å; I266-P294 WeakPolarHBondContact O-CB 3.19Å; P294-N296 PolarHBondContact O-N 3.05Å; P294-N296 VanDerWaalsContact O-N 3.16Å
295	E	83.2	Confident	85.3	Confident	78 Å²	78	87.4 Å²	87.4	36%	0.364	42%	0.422	S	S	.	.			trans	-58.8	123.5	175.9	170.8	159.4	-132	0	0	110.3	K210 K297	K210-E295 VanDerWaalsContact CE-CD 3.46Å; K210-E295 WeakPolarHBondContact CE-OE1 3.44Å; K210-E295 WeakPolarHBondContact CE-OE2 3.45Å; K210-E295 IonicContact NZ-OE1 2.64Å; K210-E295 PolarHBondContact NZ-OE1 2.99Å; K210-E295 IonicContact NZ-OE2 2.75Å; K210-E295 PolarHBondContact NZ-OE2 2.81Å; E295-K297 PolarHBondContact O-N 2.8Å
296	N	76.1	Confident	84.4	Confident	103 Å²	103	92.3 Å²	92.3	55%	0.551	44%	0.442	S	S	*	.			trans	-69.8	96.3	170.4	-175.3	3.5	0	0	0	109.4	P294 D298 P299	P294-N296 PolarHBondContact O-N 3.05Å; P294-N296 VanDerWaalsContact O-N 3.16Å; N296-D298 PolarHBondContact ND2-O 2.84Å; N296-D298 PolarHBondContact O-N 2.73Å; N296-D298 WeakPolarHBondContact OD1-CA 3.4Å; N296-D298 PolarHBondContact OD1-N 2.67Å; N296-D298 PolarHBondContact OD1-O 2.87Å; N296-P299 WeakPolarHBondContact O-CD 3.37Å; N296-P299 WeakPolarHBondContact O-CG 3.29Å
297	K	70.3	Confident	83.7	Confident	180 Å²	180	92 Å²	92	78%	0.783	43%	0.434	S	S	*	.	S	Bend	trans	-66.8	1.6	175.2	-59	-177.4	-177.2	179.4	0	113.6	E295	E295-K297 PolarHBondContact O-N 2.8Å
298	D	74.2	Confident	83	Confident	20 Å²	20	95.8 Å²	95.8	11%	0.107	44%	0.444	C	S	.	.			trans	-142.8	67	178.2	-169.8	26.3	0	0	0	112.1	N296 Y300 G301 Y302 N303 E304	N296-D298 PolarHBondContact ND2-O 2.84Å; N296-D298 PolarHBondContact O-N 2.73Å; N296-D298 WeakPolarHBondContact OD1-CA 3.4Å; N296-D298 PolarHBondContact OD1-N 2.67Å; N296-D298 PolarHBondContact OD1-O 2.87Å; D298-Y300 PolarHBondContact O-N 2.78Å; D298-G301 PolarHBondContact O-N 2.86Å; D298-G301 WeakPolarHBondContact OD2-CA 3.43Å; D298-Y302 VanDerWaalsContact CG-N 3.29Å; D298-Y302 PolarHBondContact OD1-N 2.85Å; D298-Y302 PolarHBondContact OD2-N 2.77Å; D298-Y302 VanDerWaalsContact OD2-N 3.15Å; D298-N303 HydrophobicContact CB-CB 4.34Å; D298-N303 PolarHBondContact OD1-N 2.83Å; D298-N303 VanDerWaalsContact OD2-CA 3.31Å; D298-N303 WeakPolarHBondContact OD2-CA 3.32Å; D298-N303 WeakPolarHBondContact OD2-CB 3.42Å; D298-N303 PolarHBondContact OD2-N 2.7Å; D298-E304 PolarHBondContact OD2-N 3.14Å
299	P	69.1	Low	82.2	Confident	97 Å²	97	96.8 Å²	96.8	63%	0.63	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.7	-173.2	-26	35.9	0	0	0	115.2	N296	N296-P299 WeakPolarHBondContact O-CD 3.37Å; N296-P299 WeakPolarHBondContact O-CG 3.29Å
300	Y	70.8	Confident	81.4	Confident	219 Å²	219	96.4 Å²	96.4	86%	0.859	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	3	179.5	-60.6	-75.4	0	0	0	113.3	D298 Y302	D298-Y300 PolarHBondContact O-N 2.78Å; Y300-Y302 PolarHBondContact O-N 3.2Å
301	G	73.9	Confident	80.6	Confident	23 Å²	23	99.9 Å²	99.9	24%	0.237	46%	0.463	C	S	.	.	S	Bend	trans	59.5	25.6	-173.6	0	0	0	0	0	113.3	D298 K305	D298-G301 PolarHBondContact O-N 2.86Å; D298-G301 WeakPolarHBondContact OD2-CA 3.43Å; G301-K305 WeakPolarHBondContact O-CA 3.46Å; G301-K305 WeakPolarHBondContact O-CB 3.38Å; G301-K305 PolarHBondContact O-N 2.93Å
302	Y	76.5	Confident	79.9	Confident	153 Å²	153	98.5 Å²	98.5	60%	0.6	47%	0.465	S	S	*	.	H	α-helix	trans	-67.5	-45.5	-178.4	173.4	-92.2	0	0	0	111.7	D298 Y300 K306	D298-Y302 VanDerWaalsContact CG-N 3.29Å; D298-Y302 PolarHBondContact OD1-N 2.85Å; D298-Y302 PolarHBondContact OD2-N 2.77Å; D298-Y302 VanDerWaalsContact OD2-N 3.15Å; Y300-Y302 PolarHBondContact O-N 3.2Å; Y302-K306 HydrophobicContact CE1-CD 4.36Å; Y302-K306 WeakPolarHBondContact O-CB 3.04Å; Y302-K306 PolarHBondContact O-N 2.84Å
303	N	74.1	Confident	79	Confident	77 Å²	77	104.3 Å²	104.3	41%	0.412	49%	0.49	S	S	.	.	H	α-helix	trans	-73.4	-33.5	178.2	-65.4	-58.4	0	0	0	112.1	D298 R307	D298-N303 HydrophobicContact CB-CB 4.34Å; D298-N303 PolarHBondContact OD1-N 2.83Å; D298-N303 VanDerWaalsContact OD2-CA 3.31Å; D298-N303 WeakPolarHBondContact OD2-CA 3.32Å; D298-N303 WeakPolarHBondContact OD2-CB 3.42Å; D298-N303 PolarHBondContact OD2-N 2.7Å; N303-R307 WeakPolarHBondContact O-CB 3.47Å; N303-R307 VanDerWaalsContact O-CG 3.23Å; N303-R307 WeakPolarHBondContact O-CG 3.35Å; N303-R307 PolarHBondContact O-N 2.84Å; N303-R307 PolarHBondContact O-NE 2.68Å
304	E	76.4	Confident	78.1	Confident	122 Å²	122	107.3 Å²	107.3	57%	0.57	50%	0.5	S	S	*	.	H	α-helix	trans	-67.7	-48.9	169.4	-172.4	173.1	-167.9	0	0	111.8	D298 K306 R307 K308	D298-E304 PolarHBondContact OD2-N 3.14Å; E304-K306 VanDerWaalsContact C-N 3.33Å; E304-K306 PolarHBondContact O-N 3.23Å; E304-R307 PolarHBondContact O-N 3.01Å; E304-K308 VanDerWaalsContact O-CB 3.29Å; E304-K308 WeakPolarHBondContact O-CB 2.94Å; E304-K308 PolarHBondContact O-N 3.45Å
305	K	79.1	Confident	77.2	Confident	144 Å²	144	113.6 Å²	113.6	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-61.1	-40.4	175.8	-176.5	175.6	-178.9	178.4	0	111.7	G301 K308 I309	G301-K305 WeakPolarHBondContact O-CA 3.46Å; G301-K305 WeakPolarHBondContact O-CB 3.38Å; G301-K305 PolarHBondContact O-N 2.93Å; K305-K308 PolarHBondContact O-N 3.06Å; K305-I309 HydrophobicContact CG-CD1 3.84Å; K305-I309 WeakPolarHBondContact O-CB 3.46Å; K305-I309 VanDerWaalsContact O-CG1 3.24Å; K305-I309 WeakPolarHBondContact O-CG1 3.31Å; K305-I309 PolarHBondContact O-N 3.03Å
306	K	79.8	Confident	76.4	Confident	107 Å²	107	112.9 Å²	112.9	47%	0.465	52%	0.522	S	S	.	.	H	α-helix	trans	-60.8	-53	172.7	-178.3	-179	174.4	-175.6	0	110.5	Y302 E304 K308 I309 E310	Y302-K306 HydrophobicContact CE1-CD 4.36Å; Y302-K306 WeakPolarHBondContact O-CB 3.04Å; Y302-K306 PolarHBondContact O-N 2.84Å; E304-K306 VanDerWaalsContact C-N 3.33Å; E304-K306 PolarHBondContact O-N 3.23Å; K306-K308 VanDerWaalsContact C-N 3.29Å; K306-K308 PolarHBondContact O-N 2.72Å; K306-I309 PolarHBondContact O-N 3.44Å; K306-E310 VanDerWaalsContact O-CB 3.23Å; K306-E310 WeakPolarHBondContact O-CB 3.48Å; K306-E310 PolarHBondContact O-N 3.1Å
307	R	80.3	Confident	75.7	Confident	159 Å²	159	110.5 Å²	110.5	60%	0.6	52%	0.521	S	S	*	.	H	α-helix	trans	-58.4	-39.3	177	-76.6	175.4	-66.8	170.5	4.4	112.4	N303 E304 E310 D311	N303-R307 WeakPolarHBondContact O-CB 3.47Å; N303-R307 VanDerWaalsContact O-CG 3.23Å; N303-R307 WeakPolarHBondContact O-CG 3.35Å; N303-R307 PolarHBondContact O-N 2.84Å; N303-R307 PolarHBondContact O-NE 2.68Å; E304-R307 PolarHBondContact O-N 3.01Å; R307-E310 PolarHBondContact O-N 3.09Å; R307-D311 WeakPolarHBondContact O-CB 3.37Å; R307-D311 PolarHBondContact O-N 3.04Å
308	K	82.5	Confident	75.1	Confident	143 Å²	143	107 Å²	107	62%	0.622	51%	0.51	S	S	*	.	H	α-helix	trans	-70.8	-38	178.7	-168.4	168.9	-174.3	169.5	0	112.7	E304 K305 K306 L312	E304-K308 VanDerWaalsContact O-CB 3.29Å; E304-K308 WeakPolarHBondContact O-CB 2.94Å; E304-K308 PolarHBondContact O-N 3.45Å; K305-K308 PolarHBondContact O-N 3.06Å; K306-K308 VanDerWaalsContact C-N 3.29Å; K306-K308 PolarHBondContact O-N 2.72Å; K308-L312 WeakPolarHBondContact O-CB 3.24Å; K308-L312 WeakPolarHBondContact O-CD1 3.29Å; K308-L312 WeakPolarHBondContact O-CG 3.38Å; K308-L312 PolarHBondContact O-N 2.65Å
309	I	80.8	Confident	74.1	Confident	78 Å²	78	111.8 Å²	111.8	40%	0.4	54%	0.541	S	S	.	.	H	α-helix	trans	-67.9	-42.4	171.4	-72.2	169.5	0	0	0	110.2	K305 K306 L312 F313	K305-I309 HydrophobicContact CG-CD1 3.84Å; K305-I309 WeakPolarHBondContact O-CB 3.46Å; K305-I309 VanDerWaalsContact O-CG1 3.24Å; K305-I309 WeakPolarHBondContact O-CG1 3.31Å; K305-I309 PolarHBondContact O-N 3.03Å; K306-I309 PolarHBondContact O-N 3.44Å; I309-L312 WeakPolarHBondContact O-CB 3.29Å; I309-L312 PolarHBondContact O-N 3.33Å; I309-F313 HydrophobicContact CG2-CD2 3.71Å; I309-F313 HydrophobicContact CG2-CE2 3.84Å; I309-F313 WeakPolarHBondContact O-CD2 3.27Å; I309-F313 PolarHBondContact O-N 2.85Å
310	E	81.4	Confident	73.2	Confident	82 Å²	82	110.7 Å²	110.7	38%	0.383	55%	0.546	S	S	.	.	H	α-helix	trans	-66	-39.1	178.5	-163.5	-174.2	127	0	0	112.1	K306 R307 F313 K314	K306-E310 VanDerWaalsContact O-CB 3.23Å; K306-E310 WeakPolarHBondContact O-CB 3.48Å; K306-E310 PolarHBondContact O-N 3.1Å; R307-E310 PolarHBondContact O-N 3.09Å; E310-F313 PolarHBondContact O-N 2.9Å; E310-K314 HydrophobicContact CG-CD 4.34Å; E310-K314 WeakPolarHBondContact O-CB 3.47Å; E310-K314 VanDerWaalsContact O-CG 3.29Å; E310-K314 WeakPolarHBondContact O-CG 3.35Å; E310-K314 PolarHBondContact O-N 3.41Å; E310-K314 IonicContact OE1-NZ 3.9Å; E310-K314 PolarHBondContact OE1-NZ 2.79Å
311	D	82.3	Confident	71.8	Confident	72 Å²	72	103.7 Å²	103.7	39%	0.385	53%	0.53	S	S	.	.	H	α-helix	trans	-62.8	-43.3	170.3	-178.6	63.5	0	0	0	111.6	R307 F313 K314 R315	R307-D311 WeakPolarHBondContact O-CB 3.37Å; R307-D311 PolarHBondContact O-N 3.04Å; D311-F313 PolarHBondContact O-N 2.86Å; D311-K314 PolarHBondContact O-N 3.13Å; D311-R315 VanDerWaalsContact O-CB 3.29Å; D311-R315 WeakPolarHBondContact O-CB 3.23Å; D311-R315 WeakPolarHBondContact O-CD 3.33Å; D311-R315 VanDerWaalsContact O-CG 3.3Å; D311-R315 WeakPolarHBondContact O-CG 3.23Å; D311-R315 PolarHBondContact O-N 3.26Å; D311-R315 WeakPolarHBondContact OD1-CD 3.22Å; D311-R315 WeakPolarHBondContact OD2-CD 3.24Å; D311-R315 IonicContact OD2-CZ 2.73Å; D311-R315 IonicContact OD2-NE 3.41Å; D311-R315 IonicContact OD2-NH1 2.77Å; D311-R315 PolarHBondContact OD2-NH1 3.35Å
312	L	82.9	Confident	70.5	Confident	94 Å²	94	108.3 Å²	108.3	49%	0.492	56%	0.559	S	S	.	*	H	α-helix	trans	-62.8	-39.2	173.9	-74	167	0	0	0	112.4	K308 I309 S316	K308-L312 WeakPolarHBondContact O-CB 3.24Å; K308-L312 WeakPolarHBondContact O-CD1 3.29Å; K308-L312 WeakPolarHBondContact O-CG 3.38Å; K308-L312 PolarHBondContact O-N 2.65Å; I309-L312 WeakPolarHBondContact O-CB 3.29Å; I309-L312 PolarHBondContact O-N 3.33Å; L312-S316 WeakPolarHBondContact O-CB 3.24Å; L312-S316 PolarHBondContact O-N 2.86Å; L312-S316 PolarHBondContact O-OG 3.05Å
313	F	76.9	Confident	68.8	Low	123 Å²	123	109.4 Å²	109.4	54%	0.539	57%	0.567	S	S	.	*	H	α-helix	trans	-70.4	-33.4	174.8	-92.7	-76.3	0	0	0	113.3	I309 E310 D311 S316	I309-F313 HydrophobicContact CG2-CD2 3.71Å; I309-F313 HydrophobicContact CG2-CE2 3.84Å; I309-F313 WeakPolarHBondContact O-CD2 3.27Å; I309-F313 PolarHBondContact O-N 2.85Å; E310-F313 PolarHBondContact O-N 2.9Å; D311-F313 PolarHBondContact O-N 2.86Å; F313-S316 WeakPolarHBondContact CA-OG 3.34Å; F313-S316 PolarHBondContact O-OG 2.81Å; F313-S316 VanDerWaalsContact O-OG 3.13Å
314	K	76.8	Confident	67.3	Low	130 Å²	130	111.6 Å²	111.6	57%	0.565	59%	0.585	S	S	*	*	H	α-helix	trans	-70.3	-41.4	173.2	-77	165.7	171.3	171.4	0	111.2	E310 D311 G317	E310-K314 HydrophobicContact CG-CD 4.34Å; E310-K314 WeakPolarHBondContact O-CB 3.47Å; E310-K314 VanDerWaalsContact O-CG 3.29Å; E310-K314 WeakPolarHBondContact O-CG 3.35Å; E310-K314 PolarHBondContact O-N 3.41Å; E310-K314 IonicContact OE1-NZ 3.9Å; E310-K314 PolarHBondContact OE1-NZ 2.79Å; D311-K314 PolarHBondContact O-N 3.13Å; K314-G317 PolarHBondContact O-N 2.8Å
315	R	73	Confident	65.9	Low	182 Å²	182	108.9 Å²	108.9	69%	0.687	59%	0.59	S	S	*	*	H	α-helix	trans	-74.9	-21.1	177.3	-72.5	162.3	59.5	-173.6	-0.5	114.2	D311 G317	D311-R315 VanDerWaalsContact O-CB 3.29Å; D311-R315 WeakPolarHBondContact O-CB 3.23Å; D311-R315 WeakPolarHBondContact O-CD 3.33Å; D311-R315 VanDerWaalsContact O-CG 3.3Å; D311-R315 WeakPolarHBondContact O-CG 3.23Å; D311-R315 PolarHBondContact O-N 3.26Å; D311-R315 WeakPolarHBondContact OD1-CD 3.22Å; D311-R315 WeakPolarHBondContact OD2-CD 3.24Å; D311-R315 IonicContact OD2-CZ 2.73Å; D311-R315 IonicContact OD2-NE 3.41Å; D311-R315 IonicContact OD2-NH1 2.77Å; D311-R315 PolarHBondContact OD2-NH1 3.35Å; R315-G317 VanDerWaalsContact C-N 3.29Å
316	S	67.5	Low	64.2	Low	63 Å²	63	110.3 Å²	110.3	44%	0.441	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.5	-3.4	172.2	68.1	0	0	0	0	113.8	L312 F313 L318	L312-S316 WeakPolarHBondContact O-CB 3.24Å; L312-S316 PolarHBondContact O-N 2.86Å; L312-S316 PolarHBondContact O-OG 3.05Å; F313-S316 WeakPolarHBondContact CA-OG 3.34Å; F313-S316 PolarHBondContact O-OG 2.81Å; F313-S316 VanDerWaalsContact O-OG 3.13Å; S316-L318 PolarHBondContact O-N 3.34Å
317	G	60.3	Low	62.3	Low	52 Å²	52	114.5 Å²	114.5	54%	0.536	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	70.9	10.3	170.1	0	0	0	0	0	115.8	K314 R315 T319	K314-G317 PolarHBondContact O-N 2.8Å; R315-G317 VanDerWaalsContact C-N 3.29Å; G317-T319 PolarHBondContact O-N 3.42Å
318	L	59.1	Low	60.7	Low	106 Å²	106	115.4 Å²	115.4	56%	0.555	64%	0.638	S	S	*	*			trans	-75.6	10.8	-173.5	-63.4	-179.9	0	0	0	114.9	S316 G320	S316-L318 PolarHBondContact O-N 3.34Å; L318-G320 VanDerWaalsContact C-N 3.26Å; L318-G320 PolarHBondContact O-N 3.24Å
319	T	52.1	Low	58.6	Low	122 Å²	122	111.9 Å²	111.9	75%	0.748	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	63.5	173.1	55.7	0	0	0	0	111.3	G317	G317-T319 PolarHBondContact O-N 3.42Å
320	G	50.6	Low	56.5	Low	73 Å²	73	119.4 Å²	119.4	75%	0.753	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-176.5	7.4	-175.9	0	0	0	0	0	119.9	L318	L318-G320 VanDerWaalsContact C-N 3.26Å; L318-G320 PolarHBondContact O-N 3.24Å
321	S	41.1	Very low	54.7	Low	73 Å²	73	121.3 Å²	121.3	51%	0.51	69%	0.685	S	S	.	*			trans	-150.6	131.8	174.2	44.8	0	0	0	0	114	F323	S321-F323 VanDerWaalsContact OG-CE2 3.3Å; S321-F323 WeakPolarHBondContact OG-CE2 2.97Å
322	S	46.5	Very low	52.5	Low	120 Å²	120	127.5 Å²	127.5	84%	0.839	71%	0.708	S	S	*	*			trans	-75.2	119.7	169.4	-62	0	0	0	0	109.7	P324	S322-P324 WeakPolarHBondContact O-CD 3.47Å
323	F	40.5	Very low	50.5	Low	176 Å²	176	127.7 Å²	127.7	77%	0.772	72%	0.724	S	S	*	*			trans	-100.5	99.7	172.3	-78.2	-84.2	0	0	0	110.9	S321	S321-F323 VanDerWaalsContact OG-CE2 3.3Å; S321-F323 WeakPolarHBondContact OG-CE2 2.97Å
324	P	43.9	Very low	48.8	Very low	122 Å²	122	127.6 Å²	127.6	79%	0.792	73%	0.733	S	S	*	*			trans	-77.7	123.9	170.9	31.3	-32.9	0	0	0	110.7	S322	S322-P324 WeakPolarHBondContact O-CD 3.47Å
325	G	46.2	Very low	47.3	Very low	66 Å²	66	126.5 Å²	126.5	68%	0.68	74%	0.739	S	S	*	*			trans	81.4	90.7	157.5	0	0	0	0	0	117.5
326	L	43.7	Very low	45.8	Very low	174 Å²	174	126.5 Å²	126.5	91%	0.911	75%	0.746	S	S	*	*			trans	-125.8	91.5	141.8	-77.1	179.9	0	0	0	109.2	M328	L326-M328 PolarHBondContact O-N 2.98Å
327	Q	39.6	Very low	44.5	Very low	195 Å²	195	128.6 Å²	128.6	91%	0.911	76%	0.761	S	S	*	*			trans	-73	101.7	165.9	-68.2	-173.1	14.7	0	0	108.7	G329	Q327-G329 PolarHBondContact O-N 2.95Å
328	M	47.7	Very low	44.4	Very low	178 Å²	178	131.4 Å²	131.4	88%	0.877	77%	0.77	S	S	*	*			trans	-70.7	97.8	168.9	-86.5	-67.3	-74.2	0	0	109.8	L326 R330	L326-M328 PolarHBondContact O-N 2.98Å; M328-R330 PolarHBondContact O-N 3.42Å; M328-R330 VanDerWaalsContact O-N 3.14Å
329	G	36.9	Very low	43.3	Very low	69 Å²	69	134.9 Å²	134.9	71%	0.711	79%	0.786	S	S	*	*			trans	-62	110.5	177.6	0	0	0	0	0	111.7	Q327	Q327-G329 PolarHBondContact O-N 2.95Å
330	R	38	Very low	42.6	Very low	235 Å²	235	133.1 Å²	133.1	89%	0.887	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-84.3	121.3	174.5	-171.9	177.1	-174.3	172	2.1	109.6	M328 K332	M328-R330 PolarHBondContact O-N 3.42Å; M328-R330 VanDerWaalsContact O-N 3.14Å; R330-K332 PolarHBondContact O-N 2.79Å
331	P	43.3	Very low	42.2	Very low	122 Å²	122	138.2 Å²	138.2	79%	0.792	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-58	133.7	177	-26.1	35.5	0	0	0	112
332	K	35.6	Very low	42	Very low	202 Å²	202	143.6 Å²	143.6	88%	0.878	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-76.1	128.5	172.1	-75.2	-179.2	175.5	177.6	0	109.9	R330	R330-K332 PolarHBondContact O-N 2.79Å
333	A	41	Very low	41.6	Very low	98 Å²	98	149 Å²	149	81%	0.81	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-75.7	142.4	151.5	0	0	0	0	0	108.8
334	V	40.5	Very low	41.5	Very low	121 Å²	121	150.5 Å²	150.5	73%	0.733	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-96.9	130.7	-175.6	-177.6	0	0	0	0	110.2
335	P	45.9	Very low	40.9	Very low	107 Å²	107	151 Å²	151	70%	0.695	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-92.3	145.5	171.3	35.5	-31.8	0	0	0	111.7
336	H	42.4	Very low	40.3	Very low	182 Å²	182	156.6 Å²	156.6	84%	0.843	82%	0.819	S	S	*	*			trans	-144	141.4	159.7	-95.3	-78	0	0	0	111.5
337	S	40.1	Very low	39.7	Very low	107 Å²	107	151.5 Å²	151.5	75%	0.748	81%	0.809	S	S	*	*			trans	-101.9	-154.3	-175	-36.7	0	0	0	0	110.1
338	P	57.5	Low	39.7	Very low	112 Å²	112	146.7 Å²	146.7	73%	0.727	80%	0.802	S	S	*	*			cis	-80.1	-163.1	5	40.8	-41.2	0	0	0	111
339	M	35.8	Very low	39.1	Very low	178 Å²	178	145 Å²	145	88%	0.877	79%	0.794	S	S	*	*			cis	-149.3	178.9	0.6	-140.5	142	-171.3	0	0	107
340	A	37	Very low	39.2	Very low	86 Å²	86	150.4 Å²	150.4	71%	0.711	79%	0.794	S	S	*	*			cis	-149.3	-158.2	8.4	0	0	0	0	0	110.4
341	H	42.2	Very low	39.3	Very low	179 Å²	179	147.5 Å²	147.5	83%	0.829	79%	0.79	S	S	*	*			trans	-123.7	142.4	170.5	-92.3	-109.7	0	0	0	111.8
342	M	38	Very low	38.7	Very low	186 Å²	186	145 Å²	145	92%	0.916	79%	0.787	S	S	*	*			trans	-158.2	131.2	130.4	-105.9	-59.8	167.1	0	0	109.9
343	R	38.8	Very low	38.6	Very low	233 Å²	233	140.5 Å²	140.5	88%	0.879	79%	0.787	S	S	*	*			trans	-96.3	143.8	162.5	-79.6	-172.4	175.7	-157	2.7	107.9
344	K	37.5	Very low	38.3	Very low	209 Å²	209	143.6 Å²	143.6	91%	0.909	79%	0.786	S	S	*	*			trans	-151	151.7	146.6	-158.1	165.5	-177.2	-179.7	0	110.7
345	D	32	Very low	37.9	Very low	131 Å²	131	146.5 Å²	146.5	70%	0.701	78%	0.784	S	S	*	*			trans	-145.7	142.2	-171.1	-150.1	-2.1	0	0	0	110.3
346	H	33.9	Very low	37.2	Very low	185 Å²	185	148.7 Å²	148.7	86%	0.856	79%	0.785	S	S	*	*			trans	50.4	147.8	165.4	-79	74	0	0	0	123.9
347	G	31.1	Very low	36.7	Very low	67 Å²	67	146.5 Å²	146.5	69%	0.691	79%	0.785	S	S	*	*			trans	130.1	98.1	174.7	0	0	0	0	0	111.6
348	A	38	Very low	36.4	Very low	94 Å²	94	145.7 Å²	145.7	78%	0.777	78%	0.784	S	S	*	*				66.3	134.8	58.4	0	0	0	0	0	113
349	M	36.6	Very low	36	Very low	141 Å²	141	145.9 Å²	145.9	70%	0.695	79%	0.786	S	S	*	*			cis	-164.5	162.3	1.1	-116.1	168.9	179.3	0	0	108.9
350	Y	38.2	Very low	36.8	Very low	184 Å²	184	142.5 Å²	142.5	72%	0.722	78%	0.777	S	S	*	*			cis	-105.7	-119.7	-7.4	-55.7	-102.2	0	0	0	109.9
351	H	39.2	Very low	36.6	Very low	174 Å²	174	146.7 Å²	146.7	81%	0.806	78%	0.784	S	S	*	*			cis	-146.6	159.1	-4.7	-64.7	-104.2	0	0	0	107.5
352	G	31.8	Very low	36.1	Very low	70 Å²	70	143.6 Å²	143.6	72%	0.722	77%	0.774	S	S	*	*			cis	-175.9	135.8	-12.5	0	0	0	0	0	110.7
353	A	33.7	Very low	35.7	Very low	106 Å²	106	141.5 Å²	141.5	88%	0.876	76%	0.761	S	S	*	*			trans	34.5	136.7	162.2	0	0	0	0	0	122
354	M	33.8	Very low	35.3	Very low	163 Å²	163	138.3 Å²	138.3	80%	0.803	76%	0.757	S	S	*	*			cis	-167.4	163.7	-14.4	-149.5	-159.7	-168.9	0	0	110.3
355	R	32.4	Very low	35.1	Very low	182 Å²	182	135.6 Å²	135.6	69%	0.687	75%	0.752	S	S	*	*			trans	19.2	124	155.3	-78	179.8	167	-114.3	-2.7	120.3
356	Q	32.3	Very low	35.7	Very low	154 Å²	154	134.7 Å²	134.7	72%	0.72	75%	0.754	S	S	*	*				56.2	112.3	76.2	-65.6	-179.6	-15.8	0	0	115.7
357	T	31.5	Very low	35.4	Very low	136 Å²	136	131.4 Å²	131.4	83%	0.834	75%	0.746	S	S	*	*				166.3	152.1	109	41.6	0	0	0	0	112.5
358	A	33.2	Very low	35.5	Very low	89 Å²	89	136.7 Å²	136.7	74%	0.736	75%	0.75	S	S	*	*			trans	-100.6	176.5	157.6	0	0	0	0	0	109
359	P	48.8	Very low	35	Very low	117 Å²	117	137.3 Å²	137.3	76%	0.76	74%	0.741	S	S	*	*			cis	-129.5	-133.2	5.7	43.6	-23.2	0	0	0	110
360	P	53.5	Low	34.6	Very low	107 Å²	107	137.4 Å²	137.4	70%	0.695	74%	0.739	S	S	*	*			cis	-126.1	172.7	-37.4	38.7	-23.4	0	0	0	114.9
361	M	31.8	Very low	34.1	Very low	173 Å²	173	137 Å²	137	85%	0.852	74%	0.744	S	S	*	*			trans	44.8	122.5	144.9	-167.1	-179.8	178	0	0	122.1
362	N	31.4	Very low	33.5	Very low	114 Å²	114	133.3 Å²	133.3	61%	0.61	74%	0.738	S	S	*	*				152.9	134.7	116.6	-166.7	28.6	0	0	0	114.7
363	Q	30.5	Very low	33.3	Very low	142 Å²	142	139.8 Å²	139.8	66%	0.664	74%	0.742	S	S	*	*			trans	60.3	153.6	149.7	-97.7	173.1	75.5	0	0	125.8
364	Q	30.9	Very low	33.1	Very low	166 Å²	166	143.2 Å²	143.2	78%	0.776	74%	0.739	S	S	*	*			trans	79	103.4	153.5	-73	169.3	37.2	0	0	121.3
365	N	32.2	Very low	33.2	Very low	153 Å²	153	143.4 Å²	143.4	82%	0.818	74%	0.739	S	S	*	*			trans	-51.4	159.7	138.7	-92.8	-9.1	0	0	0	110.9
366	P	45.5	Very low	33.6	Very low	112 Å²	112	141.1 Å²	141.1	73%	0.727	75%	0.747	S	S	*	*				-159.4	174.2	52.5	45.3	-24	0	0	0	120.9
367	V	27.8	Very low	33.6	Very low	116 Å²	116	137.5 Å²	137.5	70%	0.703	74%	0.744	S	S	*	*			trans	72.8	116.2	135.5	157	0	0	0	0	122.2
368	F	31.5	Very low	33.7	Very low	177 Å²	177	140.4 Å²	140.4	78%	0.776	75%	0.748	S	S	*	*			trans	68.1	160	140.6	-76.1	-136.8	0	0	0	118.5
369	N	27.8	Very low	33.7	Very low	107 Å²	107	140 Å²	140	57%	0.572	75%	0.745	S	S	*	*			cis	-146.3	-177.6	1.7	-146.1	-4.6	0	0	0	114.3
370	H	29.3	Very low	32.8	Very low	143 Å²	143	141.3 Å²	141.3	66%	0.662	75%	0.75	S	S	*	*			trans	-5.5	148	145.9	-61.7	-23.3	0	0	0	117.9
371	Q	27.5	Very low	31.7	Very low	175 Å²	175	140.2 Å²	140.2	82%	0.818	76%	0.759	S	S	*	*			cis	-169	-177.8	41.8	-127.6	148.8	39.5	0	0	107.5
372	S	26.4	Very low	31.9	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	76%	0.759	S	S	*	*			cis	-160.6	178.4	5.5	50.4	0	0	0	0	110.6
373	Y	26.7	Very low	31.8	Very low	207 Å²	207	140.8 Å²	140.8	81%	0.812	78%	0.776	S	S	*	*			trans	-26.8	155.9	149	-62.2	-96.2	0	0	0	115
374	Q	30.5	Very low	31.9	Very low	177 Å²	177	142.9 Å²	142.9	83%	0.827	79%	0.788	S	S	*	*			cis	-167.7	162.5	39.3	-145.9	156.7	16.2	0	0	112.9
375	Q	34.9	Very low	31.9	Very low	168 Å²	168	141.3 Å²	141.3	79%	0.785	79%	0.79	S	S	*	*			trans	-82.5	163.1	159.3	-69.7	-176.9	-7.9	0	0	110.6
376	P	41.2	Very low	31.8	Very low	134 Å²	134	138.6 Å²	138.6	87%	0.87	78%	0.783	S	S	*	*				-132.1	-179	102.5	15.1	6	0	0	0	113.8
377	A	32.3	Very low	30.9	Very low	78 Å²	78	142.6 Å²	142.6	65%	0.645	79%	0.792	S	S	*	*			trans	-135.8	-167.6	-171.3	0	0	0	0	0	112.4
378	Q	33.8	Very low	31.1	Very low	196 Å²	196	140.4 Å²	140.4	92%	0.916	79%	0.786	S	S	*	*			trans	76.3	156.8	175.3	-53	-179.2	9.5	0	0	115
379	A	34.2	Very low	31	Very low	81 Å²	81	140.1 Å²	140.1	67%	0.669	79%	0.786	S	S	*	*			cis	-175.6	161.5	-24.4	0	0	0	0	0	108.3
380	T	29.8	Very low	31	Very low	144 Å²	144	141.5 Å²	141.5	88%	0.883	79%	0.794	S	S	*	*			cis	-164.8	148	-27	30.2	0	0	0	0	106.8
381	G	30.1	Very low	31.2	Very low	85 Å²	85	140.4 Å²	140.4	88%	0.876	80%	0.797	S	S	*	*			trans	-177	155.4	175	0	0	0	0	0	114.1
382	A	35	Very low	31.2	Very low	103 Å²	103	139.1 Å²	139.1	85%	0.851	79%	0.791	S	S	*	*			trans	-131.2	156.8	-173.7	0	0	0	0	0	112.7
383	M	30.6	Very low	31.2	Very low	195 Å²	195	140.9 Å²	140.9	96%	0.961	79%	0.792	S	S	*	*			trans	-157.2	152.6	165.4	43.6	-174.5	166	0	0	111.6
384	M	32.1	Very low	31	Very low	187 Å²	187	135 Å²	135	92%	0.921	78%	0.781	S	S	*	*			trans	-107.7	142.6	-175.9	-69	-158.6	-170	0	0	113.4
385	T	31.3	Very low	30.9	Very low	132 Å²	132	134 Å²	134	81%	0.81	78%	0.781	S	S	*	*				-143.9	142.5	129.6	51	0	0	0	0	106.6
386	S	29.4	Very low	31.1	Very low	97 Å²	97	131 Å²	131	68%	0.678	78%	0.777	S	S	*	*			cis	81.4	88.3	28.3	76.5	0	0	0	0	116.4
387	Q	27.2	Very low	30.4	Very low	196 Å²	196	136.6 Å²	136.6	92%	0.916	78%	0.781	S	S	*	*				-173.7	156	107.8	-95.9	179.2	22.6	0	0	113.1
388	A	30.8	Very low	30.1	Very low	69 Å²	69	139 Å²	139	57%	0.57	79%	0.787	S	S	*	*			trans	-101	-178.7	173.4	0	0	0	0	0	109.8
389	H	29.4	Very low	30.2	Very low	171 Å²	171	136.7 Å²	136.7	79%	0.792	78%	0.781	S	S	*	*			cis	-154.5	153.9	42.1	-57.9	71.7	0	0	0	108.5
390	N	28.7	Very low	30.3	Very low	136 Å²	136	138.6 Å²	138.6	73%	0.727	79%	0.787	S	S	*	*			cis	81.4	158.8	29.9	-157.8	16.3	0	0	0	115.2
391	V	32.9	Very low	30.5	Very low	121 Å²	121	136 Å²	136	73%	0.733	78%	0.779	S	S	*	*			trans	87.3	133.6	-164.8	-177.7	0	0	0	0	112.5
392	Q	27.8	Very low	31	Very low	147 Å²	147	137.5 Å²	137.5	69%	0.687	78%	0.777	S	S	*	*			cis	-177.1	-171.8	-34.1	-106.9	165.3	-15.5	0	0	107.4
393	L	26	Very low	31.5	Very low	134 Å²	134	138.2 Å²	138.2	70%	0.702	77%	0.773	S	S	*	*			cis	-156.5	150.3	10.4	-158.2	69.9	0	0	0	111.7
394	S	23.3	Very low	31.5	Very low	84 Å²	84	136 Å²	136	59%	0.587	76%	0.762	S	S	*	*			trans	48	133.5	145.1	64.2	0	0	0	0	126.4
395	N	28.8	Very low	31.2	Very low	155 Å²	155	135.9 Å²	135.9	83%	0.829	76%	0.761	S	S	*	*				99.8	151.7	126.4	-80.3	23.1	0	0	0	123.5
396	P	38.3	Very low	31.1	Very low	106 Å²	106	137.1 Å²	137.1	69%	0.688	76%	0.758	S	S	*	*			trans	-107.7	-176.2	-158.4	43	-36	0	0	0	114.6
397	W	26.1	Very low	30.9	Very low	251 Å²	251	137.9 Å²	137.9	95%	0.951	76%	0.759	S	S	*	*			trans	-118.6	155.6	176.3	-96.4	54.2	0	0	0	113.8
398	V	26	Very low	31	Very low	128 Å²	128	135.4 Å²	135.4	78%	0.776	76%	0.757	S	S	*	*			trans	-128.8	155	-172.2	172.5	0	0	0	0	109.9
399	N	35.4	Very low	30.8	Very low	149 Å²	149	137.5 Å²	137.5	80%	0.797	76%	0.762	S	S	*	*			trans	-104.1	138.1	-178.2	-153.1	37.8	0	0	0	111
400	P	38	Very low	31.2	Very low	121 Å²	121	136.7 Å²	136.7	79%	0.786	76%	0.762	S	S	*	*			trans	-141.3	174.9	141	37.6	-23.4	0	0	0	113.4
401	A	32.4	Very low	31.3	Very low	88 Å²	88	137.3 Å²	137.3	73%	0.727	77%	0.765	S	S	*	*			trans	-144.6	140.5	-178.5	0	0	0	0	0	114.1
402	S	41.3	Very low	31.3	Very low	117 Å²	117	136.4 Å²	136.4	82%	0.818	76%	0.762	S	S	*	*			trans	62	145.1	159.1	-56.9	0	0	0	0	118.1
403	P	45.1	Very low	31.4	Very low	119 Å²	119	135.4 Å²	135.4	77%	0.773	77%	0.771	S	S	*	*				-129.3	165.8	68.3	33.5	-16.2	0	0	0	112.9
404	M	30.7	Very low	31.5	Very low	147 Å²	147	134.9 Å²	134.9	72%	0.724	77%	0.774	S	S	*	*			cis	78.1	109.6	35.7	-172.3	175.9	177.5	0	0	116.2	E406	M404-E406 HydrophobicContact CE-CG 4.5Å
405	M	27.2	Very low	31.9	Very low	186 Å²	186	136.1 Å²	136.1	92%	0.916	78%	0.782	S	S	*	*			trans	-159.4	161.8	135.4	-127.7	170.4	-88.9	0	0	111
406	E	28.9	Very low	32	Very low	158 Å²	158	136.3 Å²	136.3	74%	0.738	78%	0.782	S	S	*	*			trans	-98.8	157.9	-168.9	-62.7	162.5	95.7	0	0	113.2	M404	M404-E406 HydrophobicContact CE-CG 4.5Å
407	T	24.5	Very low	31.5	Very low	113 Å²	113	134.9 Å²	134.9	69%	0.693	79%	0.786	S	S	*	*				175.1	120.9	121.8	-73.1	0	0	0	0	110.4	T409	T407-T409 WeakPolarHBondContact CG2-OG1 3.22Å
408	V	28.5	Very low	31.6	Very low	144 Å²	144	129.5 Å²	129.5	87%	0.873	78%	0.776	S	S	*	*			trans	-131.6	90.9	154.2	-179.8	0	0	0	0	107.7	I410	V408-I410 PolarHBondContact O-N 2.92Å
409	T	28.1	Very low	32	Very low	112 Å²	112	131.7 Å²	131.7	69%	0.687	78%	0.777	S	S	*	*			trans	-67.3	127.9	174.1	-49.8	0	0	0	0	109.6	T407 N411	T407-T409 WeakPolarHBondContact CG2-OG1 3.22Å; T409-N411 PolarHBondContact O-N 3.16Å
410	I	37	Very low	32.7	Very low	154 Å²	154	129.7 Å²	129.7	79%	0.79	77%	0.773	S	S	*	*			trans	-69.8	115.6	171.2	-63.5	170.9	0	0	0	108	V408	V408-I410 PolarHBondContact O-N 2.92Å
411	N	30.6	Very low	32.3	Very low	149 Å²	149	131.1 Å²	131.1	80%	0.797	77%	0.774	S	S	*	*			trans	-80.6	126.2	177.5	-140.3	11.1	0	0	0	109.6	T409	T409-N411 PolarHBondContact O-N 3.16Å
412	P	33.4	Very low	32.3	Very low	102 Å²	102	131.1 Å²	131.1	66%	0.662	77%	0.768	S	S	*	*			trans	-79.2	144.8	-176	31.7	-34.8	0	0	0	112.1
413	S	29.4	Very low	31.8	Very low	126 Å²	126	130.1 Å²	130.1	88%	0.881	76%	0.761	S	S	*	*			trans	-118.2	125.4	169.5	-67.5	0	0	0	0	109.7
414	V	29.1	Very low	31.2	Very low	124 Å²	124	135.2 Å²	135.2	75%	0.752	77%	0.765	S	S	*	*			trans	-118.9	124.5	-171.3	176.4	0	0	0	0	111.3
415	S	31.1	Very low	31.2	Very low	110 Å²	110	134.9 Å²	134.9	77%	0.769	76%	0.761	S	S	*	*			trans	-161.5	102	158	45.1	0	0	0	0	108.2
416	I	29.9	Very low	31.6	Very low	159 Å²	159	132.9 Å²	132.9	82%	0.815	75%	0.75	S	S	*	*				77.3	118.4	84.5	-69.5	164.6	0	0	0	112.4
417	G	27.9	Very low	31.8	Very low	76 Å²	76	131.9 Å²	131.9	78%	0.784	75%	0.745	S	S	*	*			trans	174.8	50.9	-175.8	0	0	0	0	0	118.2
418	N	28.1	Very low	32.1	Very low	137 Å²	137	133.2 Å²	133.2	73%	0.733	75%	0.747	S	S	*	*			trans	21.1	118.8	158.9	-62.3	-2.4	0	0	0	122.8
419	H	35.2	Very low	32.1	Very low	174 Å²	174	130.8 Å²	130.8	81%	0.806	74%	0.737	S	S	*	*				43.2	157.8	116.4	-63.5	-59.8	0	0	0	123.5
420	P	50.3	Low	32.1	Very low	108 Å²	108	137.7 Å²	137.7	70%	0.701	75%	0.75	S	S	*	*			cis	-143.1	-159.2	-30.9	41.3	-21.7	0	0	0	114.1
421	N	30.1	Very low	31.7	Very low	151 Å²	151	133.4 Å²	133.4	81%	0.807	74%	0.744	S	S	*	*			trans	79.3	145.1	160.3	-96.4	-3.1	0	0	0	119.3
422	S	32.4	Very low	31.6	Very low	87 Å²	87	133.3 Å²	133.3	61%	0.608	75%	0.749	S	S	*	*			cis	-156.3	147	-7.3	-162.6	0	0	0	0	114.9
423	S	30.5	Very low	31.4	Very low	96 Å²	96	131.9 Å²	131.9	67%	0.671	75%	0.752	S	S	*	*			trans	38.3	120.4	144.2	64.5	0	0	0	0	122.5
424	R	31.6	Very low	31.5	Very low	227 Å²	227	135.4 Å²	135.4	86%	0.857	75%	0.748	S	S	*	*				163.2	158.7	110.1	-88.3	-175.9	176.5	-177.5	-0	110.4
425	Q	31.2	Very low	31.6	Very low	139 Å²	139	137.2 Å²	137.2	65%	0.65	75%	0.748	S	S	*	*			cis	-172.9	164.8	-31.6	-169.4	170.1	-9.7	0	0	106.9
426	H	36.2	Very low	31.6	Very low	144 Å²	144	138.6 Å²	138.6	67%	0.667	74%	0.742	S	S	*	*			trans	73.8	146	174.7	-62.4	-89.8	0	0	0	117.3
427	Q	32.7	Very low	31.6	Very low	137 Å²	137	138.6 Å²	138.6	64%	0.64	74%	0.736	S	S	*	*			cis	-172.4	148.5	-31.7	-124.2	-175.3	-29.9	0	0	109.8
428	L	30.6	Very low	31.8	Very low	142 Å²	142	142.6 Å²	142.6	74%	0.743	74%	0.739	S	S	*	*			trans	61.8	154.2	150.6	-61.7	167	0	0	0	118.7
429	S	29.4	Very low	31.7	Very low	93 Å²	93	143.5 Å²	143.5	65%	0.65	74%	0.743	S	S	*	*			cis	-173.4	165.2	-30.7	-108.9	0	0	0	0	110.6
430	R	27.5	Very low	32	Very low	257 Å²	257	140.9 Å²	140.9	97%	0.97	74%	0.742	S	S	*	*			trans	71.9	145.6	173.5	-56	177.5	173.4	-175.3	-3.3	116
431	G	27.7	Very low	30.9	Very low	64 Å²	64	139.2 Å²	139.2	66%	0.66	74%	0.744	S	S	*	*			cis	167.4	119.6	-12.2	0	0	0	0	0	116.1
432	T	29.7	Very low	30.7	Very low	147 Å²	147	137.5 Å²	137.5	90%	0.902	74%	0.744	S	S	*	*			trans	41.7	123	142.8	53.3	0	0	0	0	121.5
433	G	28.7	Very low	30.4	Very low	71 Å²	71	137.9 Å²	137.9	73%	0.732	75%	0.746	S	S	*	*			trans	-163.5	83	165.2	0	0	0	0	0	115.2
434	Y	32.5	Very low	30.4	Very low	201 Å²	201	141.4 Å²	141.4	79%	0.788	75%	0.752	S	S	*	*			trans	28.8	115.6	152.8	-63.8	-83.1	0	0	0	120.7
435	Q	29.6	Very low	30.5	Very low	161 Å²	161	137.4 Å²	137.4	75%	0.752	75%	0.747	S	S	*	*				72.2	150.7	101.2	-72.6	-172.4	-20	0	0	115.2
436	H	31.9	Very low	30.9	Very low	139 Å²	139	138.8 Å²	138.8	64%	0.644	76%	0.759	S	S	*	*			cis	-154	123	23.2	-152.6	-120	0	0	0	107.2
437	K	30.2	Very low	31.1	Very low	160 Å²	160	136.7 Å²	136.7	70%	0.696	77%	0.766	S	S	*	*				86	131.5	88	-162.5	-168.4	-177.5	-178.8	0	115.6
438	L	31	Very low	31.5	Very low	160 Å²	160	137.9 Å²	137.9	84%	0.838	78%	0.777	S	S	*	*			trans	113.2	119.2	162.2	-60.5	179.8	0	0	0	118.6
439	D	27.5	Very low	32.1	Very low	155 Å²	155	137 Å²	137	83%	0.829	78%	0.78	S	S	*	*			trans	-75.8	-177.1	167.4	-93.8	-64.9	0	0	0	113.7
440	P	41.7	Very low	32.7	Very low	119 Å²	119	140.2 Å²	140.2	77%	0.773	78%	0.784	S	S	*	*			cis	-135.4	173.3	-24.2	32	-13.7	0	0	0	114.5
441	G	26.5	Very low	33.3	Very low	73 Å²	73	132.3 Å²	132.3	75%	0.753	76%	0.76	S	S	*	*			trans	122.1	125.3	134.4	0	0	0	0	0	121
442	S	26.7	Very low	34.9	Very low	116 Å²	116	131.5 Å²	131.5	81%	0.811	75%	0.745	S	S	*	*			trans	74	149.2	143.1	-157.4	0	0	0	0	122.7
443	C	25.8	Very low	35.7	Very low	94 Å²	94	128.5 Å²	128.5	64%	0.635	74%	0.735	S	S	*	*			trans	54	102.9	155	57.2	0	0	0	0	123.1
444	E	29.1	Very low	36.8	Very low	171 Å²	171	133.2 Å²	133.2	80%	0.799	73%	0.731	S	S	*	*				76.3	155.5	115	-66.7	-179.6	126.9	0	0	123.8
445	N	35.3	Very low	37.5	Very low	143 Å²	143	127.4 Å²	127.4	77%	0.765	71%	0.713	S	S	*	*			trans	82.9	112.7	157.6	-64.7	-51.9	0	0	0	120.7
446	N	38.9	Very low	38.4	Very low	168 Å²	168	124.5 Å²	124.5	90%	0.898	70%	0.703	S	S	*	*			trans	-70.5	142.6	153	-71.5	-71.4	0	0	0	109.9
447	A	39.5	Very low	39.1	Very low	99 Å²	99	126 Å²	126	82%	0.818	71%	0.71	S	S	*	*			trans	-140.8	130.6	168.1	0	0	0	0	0	111.3
448	L	41.6	Very low	39.8	Very low	163 Å²	163	123.8 Å²	123.8	85%	0.853	71%	0.713	S	S	*	*			trans	-107.9	146.6	164.5	-76.8	167.7	0	0	0	108.5
449	P	44.4	Very low	40.2	Very low	124 Å²	124	123.8 Å²	123.8	81%	0.805	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-72.3	143.7	-166.3	27.9	-35.5	0	0	0	113.6
450	Q	41.8	Very low	40.5	Very low	159 Å²	159	123.2 Å²	123.2	74%	0.743	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-95.8	125.6	176	-76	-166	1.5	0	0	113.9	K549 I551	Q450-K549 WeakPolarHBondContact O-CE 3.46Å; Q450-I551 HydrophobicContact CB-CD1 3.93Å; Q450-I551 HydrophobicContact CG-CD1 3.95Å
451	L	38.3	Very low	40.1	Very low	91 Å²	91	124.2 Å²	124.2	48%	0.476	71%	0.714	S	S	.	*	P	Polyproline II helix	trans	-58.3	154.7	154.1	-73.4	179.1	0	0	0	110.6	G550 I551	L451-G550 CarbonylContact C-O 3.52Å; L451-I551 HydrophobicContact CB-CD1 3.81Å; L451-I551 HydrophobicContact CB-CG1 3.31Å; L451-I551 VanDerWaalsContact O-CD1 3.26Å; L451-I551 WeakPolarHBondContact O-CD1 3.3Å; L451-I551 WeakPolarHBondContact O-CG1 3.39Å
452	S	62.6	Low	40.5	Very low	48 Å²	48	127.1 Å²	127.1	34%	0.336	72%	0.717	S	S	.	*			trans	-146.5	120.4	175.6	68.7	0	0	0	0	115.9	R454 K549 G550	S452-R454 VanDerWaalsContact C-N 3.32Å; S452-R454 PolarHBondContact O-N 2.98Å; S452-K549 CarbonylContact C-O 2.94Å; S452-K549 VanDerWaalsContact N-C 3.33Å; S452-K549 VanDerWaalsContact N-CB 3.3Å; S452-K549 CarbonylContact O-C 3.55Å; S452-K549 VanDerWaalsContact O-C 3.24Å; S452-K549 WeakPolarHBondContact O-CB 3.48Å; S452-K549 VanDerWaalsContact OG-CD 3.3Å; S452-K549 WeakPolarHBondContact OG-CD 3.35Å; S452-K549 WeakPolarHBondContact OG-CE 3.47Å; S452-K549 PolarHBondContact OG-NZ 2.78Å; S452-G550 CarbonylContact C-O 3.53Å; S452-G550 WeakPolarHBondContact CA-O 3.22Å; S452-G550 PolarHBondContact N-O 3.29Å
453	A	47.3	Very low	40.9	Very low	84 Å²	84	127.5 Å²	127.5	69%	0.694	71%	0.714	S	S	*	*	S	Bend	trans	35.8	5.8	163.7	0	0	0	0	0	124	G550	A453-G550 PolarHBondContact N-O 3.04Å
454	R	50.6	Low	40.9	Very low	170 Å²	170	131.9 Å²	131.9	64%	0.642	73%	0.725	S	S	*	*	S	Bend	trans	-97.5	-45.9	169	-96.5	-171.2	176.3	173.3	-0.5	113.5	S452 L456 Q457 K549	S452-R454 VanDerWaalsContact C-N 3.32Å; S452-R454 PolarHBondContact O-N 2.98Å; R454-L456 PolarHBondContact O-N 2.78Å; R454-Q457 PolarHBondContact O-N 2.77Å; R454-K549 CarbonylContact C-O 3.12Å; R454-K549 VanDerWaalsContact CA-O 3.32Å; R454-K549 WeakPolarHBondContact CA-O 3.32Å; R454-K549 WeakPolarHBondContact CB-O 3.38Å; R454-K549 PolarHBondContact N-O 3.23Å
455	D	47.3	Very low	40.8	Very low	79 Å²	79	127.3 Å²	127.3	42%	0.422	72%	0.724	S	S	.	*	G	3₁₀ helix	trans	-66.3	-5.1	-174.4	-45.2	-20.2	0	0	0	114.5	K549 G550	D455-K549 VanDerWaalsContact CG-O 3.24Å; D455-K549 PolarHBondContact N-O 2.94Å; D455-K549 WeakPolarHBondContact OD1-CA 3.42Å; D455-K549 PolarHBondContact OD1-N 2.76Å; D455-K549 WeakPolarHBondContact OD2-CA 3.39Å; D455-G550 VanDerWaalsContact CG-N 3.29Å; D455-G550 WeakPolarHBondContact OD2-CA 3.03Å; D455-G550 PolarHBondContact OD2-N 3.22Å
456	L	48.7	Very low	40.3	Very low	100 Å²	100	127.4 Å²	127.4	52%	0.524	72%	0.724	S	S	.	*	G	3₁₀ helix	trans	-83.6	-8.8	178.5	-81.3	179.2	0	0	0	114.5	R454 C458 I551	R454-L456 PolarHBondContact O-N 2.78Å; L456-C458 VanDerWaalsContact C-N 3.25Å; L456-C458 PolarHBondContact O-N 3.15Å; L456-I551 VanDerWaalsContact CD1-O 3.28Å; L456-I551 WeakPolarHBondContact CD1-O 3.29Å
457	Q	47.2	Very low	39.7	Very low	170 Å²	170	127.1 Å²	127.1	79%	0.794	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-80.1	2.9	-177.9	-71.7	-171.6	-40.8	0	0	115	R454	R454-Q457 PolarHBondContact O-N 2.77Å
458	C	44.7	Very low	39.2	Very low	113 Å²	113	131.2 Å²	131.2	76%	0.764	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-93.5	3.6	-177.9	-59.6	0	0	0	0	115	L456	L456-C458 VanDerWaalsContact C-N 3.25Å; L456-C458 PolarHBondContact O-N 3.15Å
459	L	39.5	Very low	38.5	Very low	160 Å²	160	130.7 Å²	130.7	84%	0.838	72%	0.722	S	S	*	*	S	Bend	trans	-136.7	41.3	-170.5	-76	176.7	0	0	0	115
460	D	32.6	Very low	38.5	Very low	144 Å²	144	129.6 Å²	129.6	77%	0.77	72%	0.715	S	S	*	*			trans	-161.6	120.9	146.9	-128.4	-29.4	0	0	0	113.4
461	T	33.4	Very low	37.9	Very low	140 Å²	140	126.4 Å²	126.4	86%	0.859	71%	0.71	S	S	*	*			trans	-168.5	93.1	158.5	-4.3	0	0	0	0	111.6
462	V	35.6	Very low	37.4	Very low	134 Å²	134	130.8 Å²	130.8	81%	0.812	73%	0.728	S	S	*	*			trans	-136.7	107	166.5	179.2	0	0	0	0	109.8
463	V	33.9	Very low	35.8	Very low	123 Å²	123	133.6 Å²	133.6	75%	0.745	75%	0.748	S	S	*	*			trans	-141.7	112.9	172.8	-179.5	0	0	0	0	110.7
464	Q	27.3	Very low	34.8	Very low	187 Å²	187	137.8 Å²	137.8	87%	0.874	75%	0.753	S	S	*	*			trans	34.6	142.8	144	-54.4	172.1	-42.3	0	0	121.9
465	G	26.2	Very low	33.7	Very low	74 Å²	74	136.5 Å²	136.5	76%	0.763	76%	0.758	S	S	*	*			trans	155	68.3	144	0	0	0	0	0	121.1
466	N	26.1	Very low	32.7	Very low	146 Å²	146	140.2 Å²	140.2	78%	0.781	78%	0.775	S	S	*	*			trans	29.3	136.6	148	-77.9	18.1	0	0	0	124.7
467	M	25.8	Very low	31.6	Very low	161 Å²	161	142.9 Å²	142.9	79%	0.793	78%	0.782	S	S	*	*			trans	66.3	110.1	139.8	-65.4	174.4	68.6	0	0	121
468	M	27.9	Very low	30.6	Very low	186 Å²	186	141.1 Å²	141.1	92%	0.916	77%	0.774	S	S	*	*				-164.7	158.2	100.3	-103.1	-173.9	-178.8	0	0	112.8
469	N	27.4	Very low	29.8	Very low	152 Å²	152	143.7 Å²	143.7	81%	0.813	78%	0.775	S	S	*	*			trans	-101.9	177.7	169.1	-131.2	10.1	0	0	0	107.7
470	P	44.6	Very low	29.3	Very low	100 Å²	100	143.6 Å²	143.6	65%	0.649	77%	0.77	S	S	*	*			cis	-145.9	179.6	32.2	40.4	-19.2	0	0	0	117.9
471	S	29.6	Very low	29.1	Very low	93 Å²	93	145 Å²	145	65%	0.65	77%	0.772	S	S	*	*			trans	60.5	150.9	152.2	49.8	0	0	0	0	119
472	E	27.7	Very low	28.8	Very low	182 Å²	182	146.1 Å²	146.1	85%	0.85	77%	0.768	S	S	*	*			cis	-169.4	165	-14.9	-108.5	177.8	123	0	0	104.9
473	S	28	Very low	28.4	Very low	107 Å²	107	151.1 Å²	151.1	75%	0.748	77%	0.772	S	S	*	*			cis	-154.9	-177.5	1.3	43.6	0	0	0	0	109.9
474	Q	26.8	Very low	28.2	Very low	172 Å²	172	151.6 Å²	151.6	80%	0.804	77%	0.77	S	S	*	*			trans	-85.1	168.9	-176	-62.9	173.5	-12.7	0	0	112.1
475	L	28.5	Very low	28.1	Very low	144 Å²	144	149.9 Å²	149.9	75%	0.754	77%	0.767	S	S	*	*				-176.6	159.6	68.7	-91	173.9	0	0	0	113.8
476	M	24.9	Very low	28.1	Very low	157 Å²	157	152.4 Å²	152.4	77%	0.773	76%	0.762	S	S	*	*			trans	54.6	120	152	-61.1	-75.4	-83.2	0	0	118.4
477	F	26.4	Very low	28.1	Very low	155 Å²	155	152.2 Å²	152.2	68%	0.68	76%	0.761	S	S	*	*			cis	77.3	106.8	34.4	-144.8	-111.2	0	0	0	115.2
478	Q	25.9	Very low	28.3	Very low	133 Å²	133	148.2 Å²	148.2	62%	0.621	75%	0.749	S	S	*	*			trans	68.3	136.7	130.8	-155.7	179	93.2	0	0	117.7
479	Q	27.7	Very low	28.2	Very low	167 Å²	167	147.1 Å²	147.1	78%	0.78	74%	0.742	S	S	*	*			cis	-156.9	175.5	46.8	-158.8	161.4	85.8	0	0	114
480	Q	29.4	Very low	28.2	Very low	159 Å²	159	144.9 Å²	144.9	74%	0.743	74%	0.738	S	S	*	*			trans	-129	132	-179.2	167.3	-168.9	12.7	0	0	108.7
481	H	28.7	Very low	27.5	Very low	173 Å²	173	148.7 Å²	148.7	80%	0.801	75%	0.747	S	S	*	*			trans	-170.7	164.4	142.4	-101.7	-40.2	0	0	0	114.1
482	Q	27.1	Very low	27.4	Very low	164 Å²	164	151 Å²	151	77%	0.766	75%	0.752	S	S	*	*			trans	-108.6	159.8	178.5	-56.6	153.6	-59.2	0	0	109.2
483	R	27.6	Very low	27.5	Very low	239 Å²	239	150.6 Å²	150.6	90%	0.902	75%	0.75	S	S	*	*				-166.1	164.2	111.8	-113.8	-177.4	-179.7	164.6	3.1	114.7
484	D	29.1	Very low	27.4	Very low	132 Å²	132	154.1 Å²	154.1	71%	0.706	76%	0.757	S	S	*	*			trans	-91.8	155.7	-172.4	-36.6	-102.9	0	0	0	112.8
485	D	24.6	Very low	27.5	Very low	151 Å²	151	150.2 Å²	150.2	81%	0.807	76%	0.755	S	S	*	*			trans	-172.6	150.5	158	-90	-28.5	0	0	0	105.8
486	L	27.5	Very low	27.5	Very low	128 Å²	128	149.5 Å²	149.5	67%	0.67	75%	0.751	S	S	*	*			cis	-166.3	151.8	-10.9	-115.3	165.3	0	0	0	108.6
487	N	26	Very low	27.6	Very low	142 Å²	142	149.6 Å²	149.6	76%	0.759	75%	0.75	S	S	*	*			trans	60.3	164.9	158.1	-73.9	5.3	0	0	0	118.7
488	S	28.5	Very low	27.7	Very low	77 Å²	77	146.6 Å²	146.6	54%	0.538	75%	0.748	S	S	.	*			cis	-154.8	169.1	-12.3	-124.2	0	0	0	0	110.7
489	E	26.6	Very low	27.9	Very low	162 Å²	162	148.9 Å²	148.9	76%	0.757	76%	0.759	S	S	*	*			trans	33.8	106.4	146.9	-68.6	151.1	106.5	0	0	119
490	S	26.8	Very low	27.8	Very low	105 Å²	105	145 Å²	145	73%	0.734	76%	0.756	S	S	*	*				65.4	122.1	74.5	78.8	0	0	0	0	116.1
491	Q	30.1	Very low	27.7	Very low	181 Å²	181	145.3 Å²	145.3	85%	0.846	76%	0.761	S	S	*	*				162.2	112.3	119.2	-172.4	164.9	21.3	0	0	113.5
492	N	28.7	Very low	27.7	Very low	140 Å²	140	144.3 Å²	144.3	75%	0.749	76%	0.757	S	S	*	*			trans	32.6	149.6	143.4	-93.5	-22.3	0	0	0	125.3
493	Q	29.6	Very low	27.8	Very low	175 Å²	175	142.6 Å²	142.6	82%	0.818	75%	0.753	S	S	*	*			trans	71.7	125.5	160.6	-65.1	164	19	0	0	116.3
494	M	26	Very low	27.6	Very low	180 Å²	180	139 Å²	139	89%	0.887	75%	0.748	S	S	*	*			cis	103.3	109.7	17.9	-169.6	174.3	-174.2	0	0	114.5
495	A	28.3	Very low	27.4	Very low	91 Å²	91	143.2 Å²	143.2	75%	0.752	76%	0.755	S	S	*	*			trans	66.9	154.3	171.2	0	0	0	0	0	115.6
496	N	28	Very low	27.5	Very low	128 Å²	128	143.6 Å²	143.6	68%	0.684	75%	0.752	S	S	*	*			cis	-150.8	178.8	2.2	-149.5	-7.5	0	0	0	112.1
497	Q	27.9	Very low	27.5	Very low	160 Å²	160	140.5 Å²	140.5	75%	0.748	75%	0.75	S	S	*	*			trans	-1.8	146.7	145.5	-77.8	164.7	77.4	0	0	119
498	S	28.7	Very low	27.6	Very low	91 Å²	91	143.6 Å²	143.6	64%	0.636	76%	0.757	S	S	*	*			cis	-178.8	174.9	10.2	45.2	0	0	0	0	114
499	Q	29.5	Very low	27.7	Very low	181 Å²	181	143.3 Å²	143.3	85%	0.846	77%	0.767	S	S	*	*			trans	76.1	106.2	149.7	-78.1	172.9	5.4	0	0	122.2
500	A	24.7	Very low	27.7	Very low	87 Å²	87	142.6 Å²	142.6	72%	0.719	77%	0.774	S	S	*	*				78.1	137.8	116.7	0	0	0	0	0	123.7
501	L	28.4	Very low	27.8	Very low	165 Å²	165	141.8 Å²	141.8	86%	0.864	77%	0.773	S	S	*	*			trans	71.6	148.3	165	-62.2	154.1	0	0	0	115.4
502	Q	28.2	Very low	28.6	Very low	151 Å²	151	138.4 Å²	138.4	71%	0.706	77%	0.767	S	S	*	*			cis	-155.6	172.8	16.1	-150	175.4	14.4	0	0	112.8
503	N	28.3	Very low	28.7	Very low	128 Å²	128	140.8 Å²	140.8	68%	0.684	77%	0.774	S	S	*	*			trans	76	148.9	165.4	-53.1	-35.1	0	0	0	117.3
504	M	24.3	Very low	28.7	Very low	163 Å²	163	136.4 Å²	136.4	80%	0.803	77%	0.767	S	S	*	*			cis	-157	130.3	-6.3	-111.6	165.3	56.2	0	0	107.1
505	W	25.5	Very low	28.9	Very low	221 Å²	221	135.8 Å²	135.8	84%	0.837	76%	0.762	S	S	*	*				82.9	143.6	78.4	-97.2	90.6	0	0	0	118.5
506	Q	26.6	Very low	28.9	Very low	160 Å²	160	137 Å²	137	75%	0.748	76%	0.755	S	S	*	*			trans	71.5	137.2	-172.9	-44.3	-65.9	-5.2	0	0	114.6
507	G	27.9	Very low	29	Very low	62 Å²	62	137.6 Å²	137.6	64%	0.639	76%	0.759	S	S	*	*			cis	148.1	139.3	-3.7	0	0	0	0	0	110.1
508	F	27.2	Very low	29.1	Very low	208 Å²	208	135.2 Å²	135.2	91%	0.912	76%	0.755	S	S	*	*			cis	-115.3	-111.8	5	-64.5	-87.9	0	0	0	112.3
509	G	30.1	Very low	29.3	Very low	71 Å²	71	135.9 Å²	135.9	73%	0.732	76%	0.76	S	S	*	*			cis	150.5	152.5	-0.3	0	0	0	0	0	110.2
510	T	26.8	Very low	29.3	Very low	147 Å²	147	132.9 Å²	132.9	90%	0.902	75%	0.75	S	S	*	*			cis	-149	-140.1	-4.4	60.3	0	0	0	0	111
511	A	28.9	Very low	29.6	Very low	88 Å²	88	137.8 Å²	137.8	73%	0.727	75%	0.751	S	S	*	*			trans	-161.1	178.5	-176.8	0	0	0	0	0	110.8
512	P	47.8	Very low	29.6	Very low	110 Å²	110	137.1 Å²	137.1	71%	0.714	75%	0.748	S	S	*	*			cis	-142.3	-179.7	6.6	45.9	-27.8	0	0	0	118.3
513	Q	30.5	Very low	29.7	Very low	190 Å²	190	132.4 Å²	132.4	89%	0.888	74%	0.741	S	S	*	*			trans	64.6	155.9	160.8	-70.6	-172	-0.1	0	0	119.4
514	A	29.3	Very low	29.8	Very low	82 Å²	82	132.2 Å²	132.2	68%	0.678	75%	0.749	S	S	*	*			cis	-168.4	166.6	-24.8	0	0	0	0	0	112.6
515	H	29.9	Very low	30.5	Very low	167 Å²	167	131.2 Å²	131.2	77%	0.773	75%	0.752	S	S	*	*			trans	84.7	121.9	150.7	-106.8	53.8	0	0	0	124
516	N	28.9	Very low	31.7	Very low	116 Å²	116	126.1 Å²	126.1	62%	0.62	75%	0.747	S	S	*	*			trans	63.1	132.2	138.4	-69.8	4.7	0	0	0	126
517	N	28.7	Very low	31.9	Very low	142 Å²	142	122.8 Å²	122.8	76%	0.759	75%	0.747	S	S	*	*			trans	66.6	153.3	141.8	-74	-3.2	0	0	0	119.4
518	T	31.3	Very low	32.1	Very low	109 Å²	109	128 Å²	128	67%	0.669	76%	0.76	S	S	*	*			cis	-142.9	143.4	2.6	0.3	0	0	0	0	106.8
519	S	32.1	Very low	32.2	Very low	106 Å²	106	121.2 Å²	121.2	74%	0.741	75%	0.749	S	S	*	*				50.8	143.7	84.3	114.5	0	0	0	0	115.2
520	N	29.3	Very low	32.4	Very low	117 Å²	117	122.7 Å²	122.7	63%	0.626	75%	0.748	S	S	*	*			cis	-176.3	176.9	-14.6	-168.6	7.2	0	0	0	107.1
521	Y	31.5	Very low	32.7	Very low	191 Å²	191	125.1 Å²	125.1	75%	0.749	75%	0.749	S	S	*	*			trans	70.1	137.9	169.7	-60.4	-65.5	0	0	0	115.1
522	N	28.8	Very low	32.8	Very low	150 Å²	150	124.8 Å²	124.8	80%	0.802	75%	0.754	S	S	*	*			cis	67.3	131.3	49.4	-157.5	63.1	0	0	0	111.2
523	G	29.3	Very low	32	Very low	53 Å²	53	129.3 Å²	129.3	55%	0.546	77%	0.766	S	S	.	*			cis	135.9	94	6.2	0	0	0	0	0	108.6
524	S	30.7	Very low	31.9	Very low	123 Å²	123	124 Å²	124	86%	0.86	76%	0.761	S	S	*	*			trans	-139.4	105	-167.3	-56.1	0	0	0	0	113.1
525	V	39.8	Very low	31.9	Very low	142 Å²	142	125.7 Å²	125.7	86%	0.861	77%	0.769	S	S	*	*			trans	-95.4	167.1	147	-120	0	0	0	0	106.4
526	P	50	Low	31.9	Very low	114 Å²	114	127.4 Å²	127.4	74%	0.74	77%	0.774	S	S	*	*			cis	-141	-172.5	3.5	42.1	-22.5	0	0	0	116.6
527	A	32.3	Very low	32.7	Very low	91 Å²	91	127.5 Å²	127.5	75%	0.752	78%	0.781	S	S	*	*			trans	84.9	131.4	136.5	0	0	0	0	0	123.6
528	D	30.8	Very low	32.6	Very low	171 Å²	171	129.4 Å²	129.4	91%	0.914	78%	0.783	S	S	*	*			trans	78.5	160.8	141.6	-141.2	-5.2	0	0	0	121
529	G	29.1	Very low	32.5	Very low	65 Å²	65	131.2 Å²	131.2	67%	0.67	79%	0.788	S	S	*	*			trans	125.2	57.9	164.5	0	0	0	0	0	119.3
530	S	34.8	Very low	32.3	Very low	102 Å²	102	133.2 Å²	133.2	71%	0.713	79%	0.79	S	S	*	*			trans	-21.3	141.9	163.3	59.9	0	0	0	0	120.6
531	Q	33.3	Very low	32.1	Very low	199 Å²	199	130.3 Å²	130.3	93%	0.93	79%	0.788	S	S	*	*				172.5	150.3	111.6	-93.4	-171.2	32.3	0	0	113.8
532	G	30.2	Very low	32	Very low	81 Å²	81	129.9 Å²	129.9	84%	0.835	80%	0.795	S	S	*	*			trans	166.9	131.6	172.4	0	0	0	0	0	112.7
533	Q	32	Very low	32.1	Very low	205 Å²	205	128.9 Å²	128.9	96%	0.958	79%	0.794	S	S	*	*			trans	-103.2	158.8	-173.1	-63.1	177.7	-13.5	0	0	113.2
534	G	28.1	Very low	32	Very low	77 Å²	77	131.4 Å²	131.4	79%	0.794	80%	0.803	S	S	*	*			trans	168.3	121.3	163.6	0	0	0	0	0	114.6
535	S	29.8	Very low	32	Very low	118 Å²	118	132.2 Å²	132.2	83%	0.825	80%	0.798	S	S	*	*			trans	-128.6	163.8	179	-66.5	0	0	0	0	112.3
536	F	29.4	Very low	31.7	Very low	203 Å²	203	133 Å²	133	89%	0.89	80%	0.798	S	S	*	*			trans	-37.6	151.8	172.6	-54.2	-82.9	0	0	0	116.1
537	P	45.3	Very low	30.6	Very low	119 Å²	119	135.6 Å²	135.6	77%	0.773	80%	0.797	S	S	*	*				-128.7	177.6	60.3	12.9	12.9	0	0	0	113.9
538	F	26.5	Very low	30.7	Very low	181 Å²	181	135.4 Å²	135.4	79%	0.794	78%	0.784	S	S	*	*			cis	92.6	139.2	24.9	-155.9	-95.3	0	0	0	115.9
539	L	29.6	Very low	30.7	Very low	147 Å²	147	130.7 Å²	130.7	77%	0.77	76%	0.755	S	S	*	*			trans	65.9	164	-171.5	-65.7	137.2	0	0	0	116.5
540	D	27	Very low	30.8	Very low	149 Å²	149	127.6 Å²	127.6	80%	0.797	72%	0.723	S	S	*	*			cis	-173.9	162.1	-38.7	-173.2	24.9	0	0	0	109.9
541	G	25.5	Very low	30.9	Very low	55 Å²	55	126.5 Å²	126.5	57%	0.567	71%	0.709	S	S	*	*			trans	86.7	116.7	148	0	0	0	0	0	119.9
542	M	29.5	Very low	30.9	Very low	183 Å²	183	123 Å²	123	90%	0.901	70%	0.7	S	S	*	*			trans	-165.1	98	134.7	-107.6	171.6	-169.2	0	0	112.5
543	T	30.9	Very low	30.9	Very low	128 Å²	128	122.5 Å²	122.5	79%	0.785	70%	0.695	S	S	*	*			trans	31	111.9	140.4	56.2	0	0	0	0	119.5
544	S	27.5	Very low	31	Very low	106 Å²	106	116.1 Å²	116.1	74%	0.741	68%	0.684	S	S	*	*				65.7	113.4	74.7	-97.5	0	0	0	0	118
545	D	31.4	Very low	31.8	Very low	140 Å²	140	118.1 Å²	118.1	75%	0.749	68%	0.683	S	S	*	*			trans	50.5	118.9	133.6	-51.7	-70.1	0	0	0	123.3
546	D	31.7	Very low	31.9	Very low	159 Å²	159	118.9 Å²	118.9	85%	0.85	68%	0.683	S	S	*	*			trans	170.2	167.3	132.5	-100	-13.7	0	0	0	109.8
547	F	28.6	Very low	31.9	Very low	168 Å²	168	118.3 Å²	118.3	74%	0.737	68%	0.68	S	S	*	*			cis	-167.8	167.5	-45.2	-158.9	-112.2	0	0	0	107.3
548	L	34.1	Very low	31.1	Very low	88 Å²	88	122.1 Å²	122.1	46%	0.461	69%	0.688	S	S	.	*			trans	76.9	165.9	175.3	-51.8	172.5	0	0	0	117.7
549	K	31.4	Very low	31.1	Very low	71 Å²	71	119.6 Å²	119.6	31%	0.309	69%	0.691	S	S	.	*				172	136.6	-50.7	-100.3	-179.6	103.5	-157.3	0	111.1	Q450 S452 R454 D455	Q450-K549 WeakPolarHBondContact O-CE 3.46Å; S452-K549 CarbonylContact C-O 2.94Å; S452-K549 VanDerWaalsContact N-C 3.33Å; S452-K549 VanDerWaalsContact N-CB 3.3Å; S452-K549 CarbonylContact O-C 3.55Å; S452-K549 VanDerWaalsContact O-C 3.24Å; S452-K549 WeakPolarHBondContact O-CB 3.48Å; S452-K549 VanDerWaalsContact OG-CD 3.3Å; S452-K549 WeakPolarHBondContact OG-CD 3.35Å; S452-K549 WeakPolarHBondContact OG-CE 3.47Å; S452-K549 PolarHBondContact OG-NZ 2.78Å; R454-K549 CarbonylContact C-O 3.12Å; R454-K549 VanDerWaalsContact CA-O 3.32Å; R454-K549 WeakPolarHBondContact CA-O 3.32Å; R454-K549 WeakPolarHBondContact CB-O 3.38Å; R454-K549 PolarHBondContact N-O 3.23Å; D455-K549 VanDerWaalsContact CG-O 3.24Å; D455-K549 PolarHBondContact N-O 2.94Å; D455-K549 WeakPolarHBondContact OD1-CA 3.42Å; D455-K549 PolarHBondContact OD1-N 2.76Å; D455-K549 WeakPolarHBondContact OD2-CA 3.39Å
550	G	30.8	Very low	31	Very low	1 Å²	1	121.2 Å²	121.2	1%	0.01	69%	0.692	C	S	.	*			trans	-130.9	-130.4	-174	0	0	0	0	0	121.9	L451 S452 A453 D455	L451-G550 CarbonylContact C-O 3.52Å; S452-G550 CarbonylContact C-O 3.53Å; S452-G550 WeakPolarHBondContact CA-O 3.22Å; S452-G550 PolarHBondContact N-O 3.29Å; A453-G550 PolarHBondContact N-O 3.04Å; D455-G550 VanDerWaalsContact CG-N 3.29Å; D455-G550 WeakPolarHBondContact OD2-CA 3.03Å; D455-G550 PolarHBondContact OD2-N 3.22Å
551	I	37.1	Very low	31	Very low	79 Å²	79	121.5 Å²	121.5	41%	0.405	69%	0.688	S	S	.	*			trans	66.5	150.9	-176.7	-26.1	180	0	0	0	119	Q450 L451 L456	Q450-I551 HydrophobicContact CB-CD1 3.93Å; Q450-I551 HydrophobicContact CG-CD1 3.95Å; L451-I551 HydrophobicContact CB-CD1 3.81Å; L451-I551 HydrophobicContact CB-CG1 3.31Å; L451-I551 VanDerWaalsContact O-CD1 3.26Å; L451-I551 WeakPolarHBondContact O-CD1 3.3Å; L451-I551 WeakPolarHBondContact O-CG1 3.39Å; L456-I551 VanDerWaalsContact CD1-O 3.28Å; L456-I551 WeakPolarHBondContact CD1-O 3.29Å
552	V	32.4	Very low	30.9	Very low	125 Å²	125	126 Å²	126	76%	0.758	70%	0.695	S	S	*	*			trans	122	129.8	142.3	-175.4	0	0	0	0	112.9
553	G	30.9	Very low	31.6	Very low	70 Å²	70	122.3 Å²	122.3	72%	0.722	68%	0.684	S	S	*	*			cis	178.2	-167.6	-1	0	0	0	0	0	114.9
554	G	32.5	Very low	31.4	Very low	71 Å²	71	123.6 Å²	123.6	73%	0.732	68%	0.681	S	S	*	*			trans	-78.8	-139.2	176.8	0	0	0	0	0	114.3
555	P	46.7	Very low	31.4	Very low	119 Å²	119	124.1 Å²	124.1	77%	0.773	68%	0.68	S	S	*	*			cis	-77.9	-137.7	12.5	-22.1	40.1	0	0	0	117.7
556	V	31.7	Very low	31.1	Very low	134 Å²	134	121.9 Å²	121.9	81%	0.812	68%	0.675	S	S	*	*			cis	-151.5	-169.8	21.8	-143	0	0	0	0	113.4
557	F	29.5	Very low	30.9	Very low	192 Å²	192	121.6 Å²	121.6	84%	0.842	68%	0.679	S	S	*	*			trans	-147.6	156	-162.9	-78.7	-96.8	0	0	0	115.1
558	Q	27.1	Very low	30.8	Very low	198 Å²	198	116.9 Å²	116.9	93%	0.925	68%	0.678	S	S	*	*				-175.5	170.5	114	-99.2	-170.7	11.9	0	0	113.3
559	C	27.5	Very low	30.6	Very low	128 Å²	128	120.8 Å²	120.8	87%	0.865	69%	0.694	S	S	*	*			trans	-155.8	137.6	-164.9	179.1	0	0	0	0	114.8
560	K	26.9	Very low	30.5	Very low	182 Å²	182	123.9 Å²	123.9	79%	0.791	71%	0.714	S	S	*	*			trans	-177.2	170.6	166.2	-90.1	-138.8	172.8	-153.1	0	110.8
561	Q	26.5	Very low	30.4	Very low	154 Å²	154	128 Å²	128	72%	0.72	76%	0.756	S	S	*	*			cis	-171	154.4	-39.6	-168.9	-178.5	-13.6	0	0	109
562	E	24.7	Very low	29.8	Very low	150 Å²	150	128.1 Å²	128.1	70%	0.701	78%	0.777	S	S	*	*			trans	-79	168.5	170.3	-135.4	-153.5	106.8	0	0	112.9	Q564	E562-Q564 PolarHBondContact OE1-N 2.91Å
563	P	43.5	Very low	29.7	Very low	105 Å²	105	127.9 Å²	127.9	68%	0.682	78%	0.781	S	S	*	*				-156	161	67.5	42.8	-21.3	0	0	0	121.2
564	Q	27.2	Very low	30.2	Very low	155 Å²	155	130.2 Å²	130.2	72%	0.724	78%	0.783	S	S	*	*			trans	75.6	126.8	132.6	-82.4	-171	-39.1	0	0	127	E562	E562-Q564 PolarHBondContact OE1-N 2.91Å
565	V	27.3	Very low	30	Very low	118 Å²	118	134 Å²	134	72%	0.715	79%	0.786	S	S	*	*				76.6	149.8	121.2	168.4	0	0	0	0	122.2
566	S	26.1	Very low	29.1	Very low	93 Å²	93	135 Å²	135	65%	0.65	78%	0.782	S	S	*	*			cis	-177.9	174.6	-32.9	-77.8	0	0	0	0	110.4
567	V	25.8	Very low	28.9	Very low	152 Å²	152	135.9 Å²	135.9	92%	0.921	78%	0.777	S	S	*	*			trans	77.8	142.8	161.8	-172.3	0	0	0	0	115.3
568	G	27.3	Very low	28.9	Very low	70 Å²	70	131 Å²	131	72%	0.722	77%	0.767	S	S	*	*			cis	-153.8	-154.1	11.1	0	0	0	0	0	116.2
569	Q	30	Very low	29.1	Very low	169 Å²	169	128.8 Å²	128.8	79%	0.79	76%	0.757	S	S	*	*			trans	-133.3	170.6	-149.7	-138.7	-176	-72	0	0	114.4
570	D	28.2	Very low	29.5	Very low	137 Å²	137	131.7 Å²	131.7	73%	0.733	75%	0.749	S	S	*	*			trans	71.9	127	156.6	-58.2	-26.3	0	0	0	122
571	G	28.9	Very low	29.9	Very low	86 Å²	86	129.6 Å²	129.6	89%	0.887	74%	0.742	S	S	*	*				97.6	109.6	120	0	0	0	0	0	120.1
572	G	25.2	Very low	30.2	Very low	83 Å²	83	127 Å²	127	86%	0.856	74%	0.742	S	S	*	*			trans	131	144.1	146.3	0	0	0	0	0	118
573	S	30.1	Very low	30.7	Very low	120 Å²	120	127.4 Å²	127.4	84%	0.839	74%	0.743	S	S	*	*			trans	-123.2	130.7	158.7	-65.4	0	0	0	0	107.5
574	P	42	Very low	30.3	Very low	118 Å²	118	125.2 Å²	125.2	77%	0.766	74%	0.74	S	S	*	*				-144.6	137.9	106.3	36.4	-20.1	0	0	0	112.8
575	L	27.5	Very low	30.4	Very low	151 Å²	151	124.2 Å²	124.2	79%	0.791	74%	0.739	S	S	*	*				92.3	145.4	87.9	-166.2	78.8	0	0	0	114
576	M	27.4	Very low	30.6	Very low	139 Å²	139	124.2 Å²	124.2	69%	0.685	74%	0.74	S	S	*	*			trans	72.4	141.4	174.8	-64.9	-69.3	92.7	0	0	117.1
577	Q	28.4	Very low	30.8	Very low	154 Å²	154	130.3 Å²	130.3	72%	0.72	75%	0.75	S	S	*	*			cis	-164.3	145.4	-18.5	-164.6	173.9	12.9	0	0	112.1
578	S	29.4	Very low	31.1	Very low	89 Å²	89	129.6 Å²	129.6	62%	0.622	75%	0.746	S	S	*	*			trans	68.8	147.2	154.6	-93.2	0	0	0	0	120.8
579	Q	31.6	Very low	31.3	Very low	152 Å²	152	133.2 Å²	133.2	71%	0.71	75%	0.749	S	S	*	*			cis	-157	128.6	-5.8	-151.4	154.2	-40.8	0	0	113.7
580	R	34.7	Very low	31.4	Very low	189 Å²	189	133.4 Å²	133.4	71%	0.713	76%	0.755	S	S	*	*			trans	51.6	143.2	147.3	-67.8	-178.3	167.6	-115.9	0.1	120.5
581	E	35.8	Very low	31.6	Very low	137 Å²	137	135 Å²	135	64%	0.64	76%	0.76	S	S	*	*			cis	-176.6	165.4	-3.3	-112.3	161.6	168	0	0	106.5
582	S	33.8	Very low	31.9	Very low	101 Å²	101	136.5 Å²	136.5	71%	0.706	75%	0.754	S	S	*	*			cis	-165.9	165.4	-13.1	-142	0	0	0	0	106.5
583	Q	35.5	Very low	32.1	Very low	157 Å²	157	144 Å²	144	73%	0.734	76%	0.756	S	S	*	*			cis	-113.8	-115.9	4.8	-55.4	173.8	9.1	0	0	109.9	N585	Q583-N585 PolarHBondContact OE1-ND2 3.05Å
584	G	34.3	Very low	32.1	Very low	59 Å²	59	144.5 Å²	144.5	61%	0.608	76%	0.755	S	S	*	*			cis	82.3	158.3	-0.1	0	0	0	0	0	115.9
585	N	29.6	Very low	31.6	Very low	134 Å²	134	148.1 Å²	148.1	72%	0.717	76%	0.764	S	S	*	*			cis	-158.8	165.9	-3.3	-89.7	-62.8	0	0	0	110.1	Q583	Q583-N585 PolarHBondContact OE1-ND2 3.05Å
586	T	31.1	Very low	31.8	Very low	119 Å²	119	146 Å²	146	73%	0.73	76%	0.762	S	S	*	*			cis	-172	148.3	-35.7	-79.3	0	0	0	0	107.6
587	Y	30.3	Very low	32	Very low	220 Å²	220	147.5 Å²	147.5	86%	0.863	77%	0.772	S	S	*	*			trans	-89.7	144.3	-177.3	-111.5	-102.7	0	0	0	113.8
588	T	31.7	Very low	32.1	Very low	137 Å²	137	143.6 Å²	143.6	84%	0.84	77%	0.774	S	S	*	*			trans	-176.1	167	135.1	16.9	0	0	0	0	114.7
589	N	31.7	Very low	32.2	Very low	147 Å²	147	144 Å²	144	79%	0.786	78%	0.782	S	S	*	*			trans	-66.3	152.4	-172.7	-51.4	-83.5	0	0	0	116.3
590	L	31.3	Very low	32.1	Very low	173 Å²	173	143.8 Å²	143.8	91%	0.906	79%	0.786	S	S	*	*			trans	-149.7	152.9	142.5	-86.4	-168.9	0	0	0	112.7
591	M	33	Very low	32.2	Very low	169 Å²	169	141.7 Å²	141.7	83%	0.833	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-81.7	161.1	175	-82.8	-73.5	176.3	0	0	112.6
592	P	35	Very low	32	Very low	119 Å²	119	141.2 Å²	141.2	77%	0.773	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-65.7	140.9	178.4	27.9	-35.3	0	0	0	112.3
593	R	30.7	Very low	31.9	Very low	239 Å²	239	144.3 Å²	144.3	90%	0.902	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-95.5	144.7	173	-83.9	-170	172.2	-168	-1.6	112.1
594	T	29.5	Very low	31.7	Very low	131 Å²	131	146.6 Å²	146.6	80%	0.804	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-72.3	159.3	167.4	44	0	0	0	0	111.9
595	M	31.8	Very low	31.5	Very low	194 Å²	194	153 Å²	153	96%	0.956	81%	0.811	S	S	*	*			trans	-111.2	142.4	159.9	-78.5	-69.4	168.7	0	0	108.7
596	S	31.1	Very low	31.7	Very low	108 Å²	108	153.2 Å²	153.2	76%	0.755	81%	0.808	S	S	*	*			trans	-147.4	134.8	-177.7	-177.5	0	0	0	0	110.9
597	N	31.9	Very low	31.6	Very low	169 Å²	169	154.6 Å²	154.6	90%	0.904	81%	0.811	S	S	*	*			trans	-165.7	141.2	158.1	-95.6	-21.5	0	0	0	106.9
598	G	29.6	Very low	31.7	Very low	73 Å²	73	150.8 Å²	150.8	75%	0.753	81%	0.81	S	S	*	*			cis	169.7	25.9	-1.1	0	0	0	0	0	117
599	A	32.9	Very low	31.6	Very low	96 Å²	96	147.9 Å²	147.9	79%	0.793	81%	0.808	S	S	*	*			trans	-154.9	121.2	170.6	0	0	0	0	0	108.5
600	N	29.3	Very low	31.4	Very low	149 Å²	149	144.8 Å²	144.8	80%	0.797	81%	0.81	S	S	*	*			cis	77.3	85.7	40	-167	8.8	0	0	0	114.8
601	V	37.3	Very low	31.4	Very low	144 Å²	144	143.1 Å²	143.1	87%	0.873	81%	0.807	S	S	*	*			trans	-141.1	137.5	130.6	176.2	0	0	0	0	107.6
602	D	30.5	Very low	31.5	Very low	127 Å²	127	141.7 Å²	141.7	68%	0.679	81%	0.808	S	S	*	*			trans	-90.5	141.4	176.4	-136.6	-40.3	0	0	0	110.4
603	L	32	Very low	31.3	Very low	166 Å²	166	144.7 Å²	144.7	87%	0.869	81%	0.812	S	S	*	*				-170.1	141.4	124.6	-124.1	77.3	0	0	0	115.8
604	R	30.3	Very low	32.3	Very low	206 Å²	206	138.1 Å²	138.1	78%	0.777	80%	0.8	S	S	*	*			trans	-46.9	146.7	176.6	-68.3	172	166.3	-169.8	-3.8	120.1
605	R	31.9	Very low	32.3	Very low	193 Å²	193	140.3 Å²	140.3	73%	0.728	81%	0.806	S	S	*	*				84.7	136.3	126.7	-86	178.2	168.6	-135.5	6.8	122.9
606	Q	32.7	Very low	32.2	Very low	139 Å²	139	134.9 Å²	134.9	65%	0.65	79%	0.791	S	S	*	*			trans	70.8	107.4	139.4	-70.8	179.4	-95.8	0	0	120.8
607	D	29.2	Very low	32.2	Very low	148 Å²	148	137.4 Å²	137.4	79%	0.791	80%	0.796	S	S	*	*				58.6	156.6	103.1	-112.8	-42.6	0	0	0	122.6
608	V	31.9	Very low	32.2	Very low	140 Å²	140	137 Å²	137	85%	0.848	79%	0.793	S	S	*	*			trans	73.9	135.2	178.8	-167.5	0	0	0	0	114.9
609	G	29.6	Very low	33	Very low	76 Å²	76	138.8 Å²	138.8	78%	0.784	79%	0.792	S	S	*	*			trans	-111.6	173.6	175.8	0	0	0	0	0	113.2
610	G	29	Very low	33	Very low	82 Å²	82	144.1 Å²	144.1	85%	0.845	80%	0.798	S	S	*	*			trans	-171.8	130.7	178.6	0	0	0	0	0	112.7
611	V	31.4	Very low	33	Very low	138 Å²	138	140.1 Å²	140.1	84%	0.836	79%	0.791	S	S	*	*			trans	-77.9	134.1	-175.9	180	0	0	0	0	111.4
612	T	33.2	Very low	32.7	Very low	138 Å²	138	142.3 Å²	142.3	85%	0.847	79%	0.794	S	S	*	*			trans	174.6	162.3	132.9	27.1	0	0	0	0	112.9
613	Q	32.5	Very low	32.9	Very low	183 Å²	183	143 Å²	143	86%	0.855	80%	0.803	S	S	*	*			trans	-118.8	-165.2	172.1	-41.8	-178.8	-13.8	0	0	108.8
614	P	51.2	Low	33.4	Very low	101 Å²	101	140.5 Å²	140.5	66%	0.656	80%	0.797	S	S	*	*			cis	-133.6	169.8	-19.8	37.6	-21.9	0	0	0	114.3
615	L	28.8	Very low	33.7	Very low	177 Å²	177	139.9 Å²	139.9	93%	0.927	80%	0.803	S	S	*	*				-162.5	170.1	125.7	-133.8	72	0	0	0	112
616	A	30.7	Very low	34.5	Very low	79 Å²	79	134.2 Å²	134.2	65%	0.653	80%	0.804	S	S	*	*			trans	-101.8	152.8	-164	0	0	0	0	0	114.9
617	N	30.2	Very low	34.9	Very low	161 Å²	161	139.5 Å²	139.5	86%	0.861	82%	0.818	S	S	*	*				-168.6	147.5	110.6	-92	-28.3	0	0	0	112.2
618	L	32.8	Very low	36.8	Very low	160 Å²	160	138.9 Å²	138.9	84%	0.838	81%	0.805	S	S	*	*			trans	-119.7	165	172	-75.5	169.3	0	0	0	109
619	P	45	Very low	38.2	Very low	111 Å²	111	136.6 Å²	136.6	72%	0.721	80%	0.801	S	S	*	*				-141	138.6	98.8	26.4	-7.5	0	0	0	115.6
620	F	33.7	Very low	39.8	Very low	209 Å²	209	136.6 Å²	136.6	92%	0.917	78%	0.783	S	S	*	*			trans	34.2	139.9	147.7	-60.2	-81.6	0	0	0	122.7
621	G	29.9	Very low	41	Very low	64 Å²	64	138.4 Å²	138.4	66%	0.66	77%	0.773	S	S	*	*			cis	177.2	169.6	-0.5	0	0	0	0	0	115.1
622	M	30	Very low	42.6	Very low	191 Å²	191	136.2 Å²	136.2	94%	0.941	76%	0.76	S	S	*	*			trans	-146.1	157.6	176.5	-88.9	-70	175.2	0	0	109.6
623	V	34.7	Very low	44.1	Very low	141 Å²	141	133.9 Å²	133.9	86%	0.855	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-91.9	135.4	-177.1	-177.8	0	0	0	0	110.5
624	P	43.3	Very low	45.9	Very low	114 Å²	114	132 Å²	132	74%	0.74	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-96.5	148.3	-171.2	36.1	-35.3	0	0	0	115.2
625	E	36.5	Very low	46.7	Very low	193 Å²	193	132 Å²	132	90%	0.902	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-78	146	158	-65.9	179.3	116.6	0	0	111
626	G	47.9	Very low	48.3	Very low	73 Å²	73	130.7 Å²	130.7	75%	0.753	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-79.6	130.6	179.3	0	0	0	0	0	113.6
627	R	41.7	Very low	49.9	Very low	250 Å²	250	129.3 Å²	129.3	94%	0.943	69%	0.69	S	S	*	*			trans	-110.4	128.6	165.9	-69.2	-176.7	177.1	-176.5	-1	109.9
628	Y	69.7	Low	50.8	Low	136 Å²	136	126.1 Å²	126.1	53%	0.533	68%	0.68	S	S	.	*			trans	-80.3	142	172.3	-60.1	-75.3	0	0	0	110.5	E633 W634	Y628-E633 HydrophobicContact CD1-CB 4.26Å; Y628-W634 HydrophobicContact CD2-CB 4.44Å; Y628-W634 AromaticContact CD2-CD1 3.89Å; Y628-W634 HydrophobicContact CG-CB 4.41Å
629	A	59.7	Low	51.6	Low	91 Å²	91	122.9 Å²	122.9	75%	0.752	67%	0.671	S	S	*	*	S	Bend	trans	-87.4	-18	-171.8	0	0	0	0	0	113.4	E633	A629-E633 WeakPolarHBondContact CB-OE2 3.35Å; A629-E633 PolarHBondContact N-OE2 3.08Å
630	N	64.4	Low	51.7	Low	76 Å²	76	126.3 Å²	126.3	41%	0.406	68%	0.678	S	S	.	*	S	Bend	trans	-154	164.4	176.1	61.2	78.4	0	0	0	112.1	T632 E633 W634	N630-T632 PolarHBondContact O-N 3.29Å; N630-T632 WeakPolarHBondContact OD1-CA 3.31Å; N630-T632 WeakPolarHBondContact OD1-CB 3.13Å; N630-T632 PolarHBondContact OD1-N 2.87Å; N630-T632 VanDerWaalsContact OD1-N 3.07Å; N630-T632 PolarHBondContact OD1-OG1 3.41Å; N630-E633 PolarHBondContact O-N 2.85Å; N630-E633 PolarHBondContact OD1-N 2.61Å; N630-W634 PolarHBondContact O-N 3.31Å
631	L	54.1	Low	52	Low	121 Å²	121	121.9 Å²	121.9	63%	0.634	67%	0.672	S	S	*	*	H	α-helix	trans	-60.6	-31.7	-179.1	-164.8	72.1	0	0	0	112.7	W634 I635	L631-W634 HydrophobicContact CD1-CE3 4.2Å; L631-W634 PolarHBondContact O-N 2.88Å; L631-I635 HydrophobicContact CD2-CD1 4.44Å; L631-I635 HydrophobicContact CG-CD1 4.08Å; L631-I635 WeakPolarHBondContact O-CG1 3.37Å; L631-I635 PolarHBondContact O-N 3.07Å; L631-I635 VanDerWaalsContact O-N 3.07Å
632	T	65.3	Low	52.5	Low	91 Å²	91	132.2 Å²	132.2	56%	0.558	70%	0.699	S	S	*	*	H	α-helix	trans	-71.2	-31.7	-177.1	-37.4	0	0	0	0	112.7	N630 K636	N630-T632 PolarHBondContact O-N 3.29Å; N630-T632 WeakPolarHBondContact OD1-CA 3.31Å; N630-T632 WeakPolarHBondContact OD1-CB 3.13Å; N630-T632 PolarHBondContact OD1-N 2.87Å; N630-T632 VanDerWaalsContact OD1-N 3.07Å; N630-T632 PolarHBondContact OD1-OG1 3.41Å; T632-K636 WeakPolarHBondContact O-CG 3.11Å; T632-K636 PolarHBondContact O-N 2.87Å
633	E	64.6	Low	53.6	Low	89 Å²	89	129.3 Å²	129.3	42%	0.416	69%	0.687	S	S	.	*	H	α-helix	trans	-70.1	-45.4	170.8	-73.3	179.7	148.7	0	0	111.7	Y628 A629 N630 I635 K636 S637	Y628-E633 HydrophobicContact CD1-CB 4.26Å; A629-E633 WeakPolarHBondContact CB-OE2 3.35Å; A629-E633 PolarHBondContact N-OE2 3.08Å; N630-E633 PolarHBondContact O-N 2.85Å; N630-E633 PolarHBondContact OD1-N 2.61Å; E633-I635 PolarHBondContact O-N 2.76Å; E633-K636 PolarHBondContact O-N 3.29Å; E633-K636 VanDerWaalsContact O-N 3.16Å; E633-S637 PolarHBondContact O-N 3.03Å
634	W	69.3	Low	54.6	Low	144 Å²	144	128.6 Å²	128.6	55%	0.545	68%	0.678	S	S	.	*	H	α-helix	trans	-59.6	-45.5	179.5	-179.7	64.7	0	0	0	111.8	Y628 N630 L631 K636 S637 S638	Y628-W634 HydrophobicContact CD2-CB 4.44Å; Y628-W634 AromaticContact CD2-CD1 3.89Å; Y628-W634 HydrophobicContact CG-CB 4.41Å; N630-W634 PolarHBondContact O-N 3.31Å; L631-W634 HydrophobicContact CD1-CE3 4.2Å; L631-W634 PolarHBondContact O-N 2.88Å; W634-K636 VanDerWaalsContact C-N 3.28Å; W634-K636 PolarHBondContact O-N 3.04Å; W634-S637 WeakPolarHBondContact O-CB 3.19Å; W634-S637 PolarHBondContact O-N 2.75Å; W634-S637 VanDerWaalsContact O-N 3.1Å; W634-S637 PolarHBondContact O-OG 3.07Å; W634-S638 PolarHBondContact O-N 2.64Å
635	I	69.8	Low	55.3	Low	102 Å²	102	129.4 Å²	129.4	52%	0.523	68%	0.675	S	S	.	*	H	α-helix	trans	-59.8	-37.1	177.4	-70	167.4	0	0	0	111.8	L631 E633	L631-I635 HydrophobicContact CD2-CD1 4.44Å; L631-I635 HydrophobicContact CG-CD1 4.08Å; L631-I635 WeakPolarHBondContact O-CG1 3.37Å; L631-I635 PolarHBondContact O-N 3.07Å; L631-I635 VanDerWaalsContact O-N 3.07Å; E633-I635 PolarHBondContact O-N 2.76Å
636	K	62.3	Low	56.4	Low	149 Å²	149	125.7 Å²	125.7	65%	0.648	66%	0.661	S	S	*	*	H	α-helix	trans	-68.9	-39	175.1	-74.5	179.7	177.1	-178.5	0	112.5	T632 E633 W634 S638 S639	T632-K636 WeakPolarHBondContact O-CG 3.11Å; T632-K636 PolarHBondContact O-N 2.87Å; E633-K636 PolarHBondContact O-N 3.29Å; E633-K636 VanDerWaalsContact O-N 3.16Å; W634-K636 VanDerWaalsContact C-N 3.28Å; W634-K636 PolarHBondContact O-N 3.04Å; K636-S638 PolarHBondContact O-N 3.18Å; K636-S639 PolarHBondContact O-N 3.01Å; K636-S639 VanDerWaalsContact O-N 3.14Å; K636-S639 PolarHBondContact O-OG 3.14Å
637	S	63.8	Low	56.9	Low	49 Å²	49	129 Å²	129	34%	0.343	66%	0.656	S	S	.	*	H	α-helix	trans	-59.3	-34.2	178.9	77.8	0	0	0	0	112.6	E633 W634 S639	E633-S637 PolarHBondContact O-N 3.03Å; W634-S637 WeakPolarHBondContact O-CB 3.19Å; W634-S637 PolarHBondContact O-N 2.75Å; W634-S637 VanDerWaalsContact O-N 3.1Å; W634-S637 PolarHBondContact O-OG 3.07Å; S637-S639 PolarHBondContact O-N 3.41Å
638	S	49.4	Very low	57.9	Low	94 Å²	94	120.9 Å²	120.9	66%	0.657	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-3.4	-179.5	-167.1	0	0	0	0	114.8	W634 K636	W634-S638 PolarHBondContact O-N 2.64Å; K636-S638 PolarHBondContact O-N 3.18Å
639	S	48.3	Very low	57.1	Low	93 Å²	93	119.9 Å²	119.9	65%	0.65	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-0.3	-177.8	67.6	0	0	0	0	115.5	K636 S637	K636-S639 PolarHBondContact O-N 3.01Å; K636-S639 VanDerWaalsContact O-N 3.14Å; K636-S639 PolarHBondContact O-OG 3.14Å; S637-S639 PolarHBondContact O-N 3.41Å
640	Q	47	Very low	56.9	Low	183 Å²	183	122.1 Å²	122.1	86%	0.855	64%	0.636	S	S	*	*	S	Bend	trans	-121.9	64.1	175.6	-74.4	-169.6	-28.1	0	0	111.9
641	S	40.3	Very low	56.2	Low	115 Å²	115	125.9 Å²	125.9	80%	0.804	66%	0.655	S	S	*	*			trans	-149.2	111.4	164.5	-179.9	0	0	0	0	108.5
642	K	41	Very low	56.4	Low	281 Å²	281	126.4 Å²	126.4	100%	1.222	66%	0.657	S	S	*	*			trans	-152.7	0	-178.4	-155.2	-176.9	-172.8	-174.1	0	110.3

Retrieved 642 of 642 residues in 1004 ms (Link to these results)

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