A0A3Q0KD53_SCHMA Loading...

Pinch, putative

AlphaFold DB , UniProt , Accession A0A3Q0KD53, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 358 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.2	Very low	50.6	Low	192 Å²	192	103.5 Å²	103.5	95%	0.946	49%	0.485	S	S	*	.				0	123.3	0	-79.2	-172.7	-87.8	0	0	106.9	H3 Q139	M1-H3 PolarHBondContact O-CD2 3.04Å; M1-H3 VanDerWaalsContact O-CD2 3.27Å; M1-H3 PolarHBondContact O-N 3.44Å; M1-Q139 VanDerWaalsContact C-OE1 3.27Å; M1-Q139 PolarHBondContact O-OE1 2.82Å
2	L	56	Low	50.2	Low	104 Å²	104	98.8 Å²	98.8	55%	0.545	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-59.3	120	173.3	-81.2	161	0	0	0	108.3	Q139 K148	L2-Q139 HydrophobicContact CD2-CG 4.08Å; L2-K148 HydrophobicContact CD2-CD 4.43Å; L2-K148 HydrophobicContact CD2-CG 4.05Å
3	H	58.7	Low	49.7	Very low	74 Å²	74	100.5 Å²	100.5	34%	0.343	47%	0.473	S	S	.	.	B	Isolated β-bridge	trans	-97.1	131.9	173.5	-76.7	-82	0	0	0	108.9	M1 F138	M1-H3 PolarHBondContact O-CD2 3.04Å; M1-H3 VanDerWaalsContact O-CD2 3.27Å; M1-H3 PolarHBondContact O-N 3.44Å; H3-F138 HydrophobicContact CB-CD1 4.5Å; H3-F138 HydrophobicContact CB-CD2 4.01Å; H3-F138 HydrophobicContact CB-CE1 4.02Å; H3-F138 HydrophobicContact CB-CE2 3.5Å; H3-F138 HydrophobicContact CB-CG 4.49Å; H3-F138 HydrophobicContact CB-CZ 3.49Å; H3-F138 VanDerWaalsContact CB-CZ 3.49Å; H3-F138 PolarHBondContact N-O 3.23Å; H3-F138 WeakPolarHBondContact O-CD1 3.45Å; H3-F138 PolarHBondContact O-N 3.44Å
4	E	58.2	Low	49.3	Very low	157 Å²	157	103.7 Å²	103.7	73%	0.734	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-98	131	172.6	-67	-176.2	162.1	0	0	109.2	R6	E4-R6 PolarHBondContact O-N 3.31Å
5	A	59.6	Low	49.6	Very low	12 Å²	12	105.5 Å²	105.5	10%	0.099	50%	0.502	C	S	.	.			trans	-71.6	115.1	170.8	0	0	0	0	0	107.6	N7 V112 L124 F138	A5-N7 PolarHBondContact O-N 3.13Å; A5-V112 HydrophobicContact CB-CG1 3.77Å; A5-L124 HydrophobicContact CB-CD2 3.54Å; A5-F138 HydrophobicContact CB-CE1 4.06Å
6	R	57.8	Low	50.2	Low	189 Å²	189	101.2 Å²	101.2	71%	0.713	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	109.7	172.3	-72.6	-175.8	179.5	172.7	-0.1	107.3	E4 K8 K113	E4-R6 PolarHBondContact O-N 3.31Å; R6-K8 VanDerWaalsContact C-N 3.25Å; R6-K8 HydrophobicContact CB-CG 4.43Å; R6-K8 PolarHBondContact O-N 3.48Å; R6-K113 PolarHBondContact N-O 3.34Å; R6-K113 PolarHBondContact O-N 3.2Å
7	N	52.8	Low	51	Low	60 Å²	60	97.3 Å²	97.3	32%	0.321	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	88.6	170.8	-151.2	-24.6	0	0	0	107.8	A5 K110 I134	A5-N7 PolarHBondContact O-N 3.13Å; N7-K110 WeakPolarHBondContact ND2-CE 3.27Å; N7-K110 PolarHBondContact ND2-NZ 3.16Å; N7-K110 WeakPolarHBondContact OD1-CD 3Å; N7-K110 WeakPolarHBondContact OD1-CE 3.32Å; N7-K110 WeakPolarHBondContact OD1-CG 3.38Å; N7-I134 HydrophobicContact CB-CG2 4.5Å; N7-I134 WeakPolarHBondContact ND2-CG2 3.45Å
8	K	46.8	Very low	51.9	Low	77 Å²	77	95.6 Å²	95.6	34%	0.335	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	123.8	172.6	-69.5	-157.1	-179.9	-172.6	0	107.3	R6 E10	R6-K8 VanDerWaalsContact C-N 3.25Å; R6-K8 HydrophobicContact CB-CG 4.43Å; R6-K8 PolarHBondContact O-N 3.48Å; K8-E10 HydrophobicContact CB-CB 3.94Å; K8-E10 HydrophobicContact CB-CG 4.05Å; K8-E10 HydrophobicContact CD-CB 4.34Å; K8-E10 HydrophobicContact CD-CG 3.87Å; K8-E10 VanDerWaalsContact CD-OE1 3.28Å; K8-E10 WeakPolarHBondContact CD-OE1 3.01Å; K8-E10 WeakPolarHBondContact CD-OE2 3.4Å; K8-E10 WeakPolarHBondContact CE-OE1 3.21Å; K8-E10 IonicContact NZ-OE1 3.83Å; K8-E10 PolarHBondContact NZ-OE1 3.09Å; K8-E10 IonicContact NZ-OE2 3.72Å; K8-E10 PolarHBondContact NZ-OE2 3.18Å; K8-E10 PolarHBondContact O-N 2.82Å
9	Q	41.5	Very low	52.8	Low	121 Å²	121	92.3 Å²	92.3	57%	0.565	45%	0.451	S	S	*	.			trans	-72.4	50.3	156.3	-69	-172.8	-0.9	0	0	109.5	L11 K13	Q9-L11 VanDerWaalsContact C-N 3.28Å; Q9-L11 PolarHBondContact O-N 3.44Å; Q9-K13 HydrophobicContact CB-CD 4.03Å; Q9-K13 WeakPolarHBondContact O-CD 3.36Å; Q9-K13 WeakPolarHBondContact O-CG 3.34Å
10	E	37.2	Very low	53.1	Low	101 Å²	101	94.5 Å²	94.5	47%	0.472	46%	0.459	S	S	.	.			trans	-95.5	65.6	171.1	-82.1	178.7	-171	0	0	108	K8 V12	K8-E10 HydrophobicContact CB-CB 3.94Å; K8-E10 HydrophobicContact CB-CG 4.05Å; K8-E10 HydrophobicContact CD-CB 4.34Å; K8-E10 HydrophobicContact CD-CG 3.87Å; K8-E10 VanDerWaalsContact CD-OE1 3.28Å; K8-E10 WeakPolarHBondContact CD-OE1 3.01Å; K8-E10 WeakPolarHBondContact CD-OE2 3.4Å; K8-E10 WeakPolarHBondContact CE-OE1 3.21Å; K8-E10 IonicContact NZ-OE1 3.83Å; K8-E10 PolarHBondContact NZ-OE1 3.09Å; K8-E10 IonicContact NZ-OE2 3.72Å; K8-E10 PolarHBondContact NZ-OE2 3.18Å; K8-E10 PolarHBondContact O-N 2.82Å; E10-V12 VanDerWaalsContact C-N 3.33Å
11	L	40.6	Very low	53.4	Low	51 Å²	51	90.4 Å²	90.4	27%	0.267	44%	0.439	S	S	.	.	S	Bend	trans	-95.8	76.4	154.9	-96.5	170.6	0	0	0	106.2	Q9 K13 M108 S109 V111	Q9-L11 VanDerWaalsContact C-N 3.28Å; Q9-L11 PolarHBondContact O-N 3.44Å; L11-K13 HydrophobicContact CB-CG 4.36Å; L11-K13 WeakPolarHBondContact O-CA 3.36Å; L11-K13 WeakPolarHBondContact O-CG 3.33Å; L11-K13 PolarHBondContact O-N 3.19Å; L11-M108 WeakPolarHBondContact CD2-O 3.33Å; L11-S109 WeakPolarHBondContact CD1-O 3.39Å; L11-S109 WeakPolarHBondContact CD2-O 3.45Å; L11-S109 WeakPolarHBondContact CG-O 3.02Å; L11-V111 HydrophobicContact CD2-CG2 4.28Å; L11-V111 HydrophobicContact CG-CG2 4.34Å
12	V	46	Very low	53.5	Low	48 Å²	48	87.4 Å²	87.4	29%	0.291	43%	0.427	S	S	.	.	S	Bend	trans	43	41.8	168.7	-148.6	0	0	0	0	112.6	E10 D14 H15 V16 F82	E10-V12 VanDerWaalsContact C-N 3.33Å; V12-D14 VanDerWaalsContact C-N 3.26Å; V12-D14 PolarHBondContact O-N 3.3Å; V12-H15 PolarHBondContact O-N 2.91Å; V12-V16 HydrophobicContact CB-CB 3.89Å; V12-V16 HydrophobicContact CB-CG2 3.38Å; V12-V16 HydrophobicContact CG1-CB 4.14Å; V12-V16 HydrophobicContact CG1-CG2 3.17Å; V12-V16 HydrophobicContact CG2-CG2 4.12Å; V12-V16 PolarHBondContact O-N 3.4Å; V12-F82 HydrophobicContact CG1-CD2 3.77Å; V12-F82 HydrophobicContact CG1-CE2 3.36Å; V12-F82 HydrophobicContact CG1-CZ 4.31Å
13	K	43.5	Very low	53.3	Low	120 Å²	120	86.5 Å²	86.5	52%	0.522	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-9.4	-153.1	-93.8	-153.4	178.3	-168.2	0	114.4	Q9 L11	Q9-K13 HydrophobicContact CB-CD 4.03Å; Q9-K13 WeakPolarHBondContact O-CD 3.36Å; Q9-K13 WeakPolarHBondContact O-CG 3.34Å; L11-K13 HydrophobicContact CB-CG 4.36Å; L11-K13 WeakPolarHBondContact O-CA 3.36Å; L11-K13 WeakPolarHBondContact O-CG 3.33Å; L11-K13 PolarHBondContact O-N 3.19Å
14	D	44.1	Very low	52.9	Low	146 Å²	146	89.4 Å²	89.4	78%	0.781	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-11.6	177.9	-62.9	-24.1	0	0	0	112.8	V12	V12-D14 VanDerWaalsContact C-N 3.26Å; V12-D14 PolarHBondContact O-N 3.3Å
15	H	53.9	Low	52.7	Low	130 Å²	130	85.7 Å²	85.7	60%	0.602	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.5	1.5	-175.9	-65	-56	0	0	0	117	V12 F82	V12-H15 PolarHBondContact O-N 2.91Å; H15-F82 HydrophobicContact CB-CD2 4.19Å; H15-F82 HydrophobicContact CB-CE2 4.16Å
16	V	58.6	Low	52.4	Low	37 Å²	37	90.7 Å²	90.7	22%	0.224	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	113.6	174.8	179.2	0	0	0	0	112.5	V12 Y80 E81 F82 F92	V12-V16 HydrophobicContact CB-CB 3.89Å; V12-V16 HydrophobicContact CB-CG2 3.38Å; V12-V16 HydrophobicContact CG1-CB 4.14Å; V12-V16 HydrophobicContact CG1-CG2 3.17Å; V12-V16 HydrophobicContact CG2-CG2 4.12Å; V12-V16 PolarHBondContact O-N 3.4Å; V16-Y80 HydrophobicContact CG1-CD1 4.25Å; V16-E81 VanDerWaalsContact CA-O 3.23Å; V16-E81 WeakPolarHBondContact CA-O 3.46Å; V16-F82 HydrophobicContact CG2-CB 4.05Å; V16-F82 HydrophobicContact CG2-CD2 3.34Å; V16-F82 HydrophobicContact CG2-CE2 4.13Å; V16-F82 HydrophobicContact CG2-CG 4.05Å; V16-F92 HydrophobicContact CB-CE2 4.41Å; V16-F92 HydrophobicContact CB-CZ 4.24Å; V16-F92 HydrophobicContact CG1-CE1 4.46Å; V16-F92 HydrophobicContact CG1-CE2 3.75Å; V16-F92 HydrophobicContact CG1-CZ 3.57Å; V16-F92 HydrophobicContact CG2-CE2 3.65Å; V16-F92 HydrophobicContact CG2-CZ 3.68Å
17	A	65.3	Low	52.2	Low	35 Å²	35	85.6 Å²	85.6	29%	0.289	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	114.1	167.6	0	0	0	0	0	108.8	R19 E81	A17-R19 HydrophobicContact CB-CG 4.1Å; A17-R19 PolarHBondContact O-N 3.08Å; A17-E81 HydrophobicContact CB-CB 4.33Å; A17-E81 PolarHBondContact N-O 2.95Å; A17-E81 VanDerWaalsContact N-O 3.16Å; A17-E81 PolarHBondContact O-N 3.38Å
18	V	66.8	Low	52.4	Low	66 Å²	66	84.2 Å²	84.2	40%	0.4	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	119.9	159.2	-177	0	0	0	0	106.1	F20 E78 Y80	V18-F20 HydrophobicContact CG1-CE2 4.21Å; V18-F20 HydrophobicContact CG1-CZ 4.21Å; V18-E78 HydrophobicContact CG1-CG 3.74Å; V18-Y80 HydrophobicContact CG2-CD1 3.89Å; V18-Y80 HydrophobicContact CG2-CE1 3.59Å
19	R	67.7	Low	52.7	Low	34 Å²	34	85.6 Å²	85.6	13%	0.128	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	139.5	-179.4	-70.1	-168.9	-171.8	172.6	13.5	109.6	A17 E78 F79 E81	A17-R19 HydrophobicContact CB-CG 4.1Å; A17-R19 PolarHBondContact O-N 3.08Å; R19-E78 WeakPolarHBondContact O-CA 3.45Å; R19-F79 HydrophobicContact CB-CD1 3.97Å; R19-F79 HydrophobicContact CB-CD2 4.35Å; R19-F79 HydrophobicContact CB-CE1 3.29Å; R19-F79 HydrophobicContact CB-CE2 3.8Å; R19-F79 HydrophobicContact CB-CG 4.45Å; R19-F79 HydrophobicContact CB-CZ 3.25Å; R19-F79 VanDerWaalsContact CD-CZ 3.45Å; R19-F79 HydrophobicContact CG-CE1 4.42Å; R19-F79 HydrophobicContact CG-CE2 4.23Å; R19-F79 HydrophobicContact CG-CZ 3.92Å; R19-F79 PolarHBondContact N-O 3.03Å; R19-F79 PolarHBondContact O-N 3.03Å; R19-E81 IonicContact CZ-OE1 3.26Å; R19-E81 IonicContact CZ-OE2 2.9Å; R19-E81 IonicContact NE-OE2 3.07Å; R19-E81 PolarHBondContact NE-OE2 2.77Å; R19-E81 IonicContact NH1-OE2 3.91Å; R19-E81 PolarHBondContact NH1-OE2 2.91Å; R19-E81 IonicContact NH2-OE1 2.65Å; R19-E81 PolarHBondContact NH2-OE1 3.42Å; R19-E81 IonicContact NH2-OE2 2.66Å; R19-E81 PolarHBondContact NH2-OE2 3.02Å
20	F	60.1	Low	53.1	Low	136 Å²	136	84.1 Å²	84.1	60%	0.596	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	112.7	169.5	-61.9	-83.5	0	0	0	106.5	V18 D22 K77 E78	V18-F20 HydrophobicContact CG1-CE2 4.21Å; V18-F20 HydrophobicContact CG1-CZ 4.21Å; F20-D22 PolarHBondContact O-N 3.11Å; F20-D22 VanDerWaalsContact O-N 3.16Å; F20-K77 CarbonylContact C-O 3.57Å; F20-K77 WeakPolarHBondContact CA-O 3.28Å; F20-E78 HydrophobicContact CD1-CB 4.34Å; F20-E78 HydrophobicContact CE1-CB 4.15Å; F20-E78 HydrophobicContact CE1-CG 4.05Å; F20-E78 HydrophobicContact CZ-CG 4.49Å
21	N	58.1	Low	53.7	Low	8 Å²	8	86.3 Å²	86.3	4%	0.043	45%	0.448	C	S	.	.			trans	-67.1	106.1	164.9	-87.2	-7	0	0	0	107.3	I23 V55 F65 K77 F79	N21-I23 HydrophobicContact CB-CD1 4.45Å; N21-I23 HydrophobicContact CB-CG1 3.65Å; N21-I23 PolarHBondContact O-N 3.3Å; N21-V55 VanDerWaalsContact OD1-CG2 3.31Å; N21-V55 WeakPolarHBondContact OD1-CG2 3.13Å; N21-F65 WeakPolarHBondContact ND2-CE1 3.33Å; N21-F65 WeakPolarHBondContact ND2-CZ 3.27Å; N21-K77 PolarHBondContact N-O 3.2Å; N21-F79 HydrophobicContact CB-CE1 4.45Å; N21-F79 WeakPolarHBondContact OD1-CE1 3.48Å
22	D	51.2	Low	54.1	Low	129 Å²	129	92.2 Å²	92.2	69%	0.69	48%	0.48	S	S	*	.			trans	-71.5	86.1	150.3	-64.7	-39.8	0	0	0	105.2	F20 E24	F20-D22 PolarHBondContact O-N 3.11Å; F20-D22 VanDerWaalsContact O-N 3.16Å; D22-E24 PolarHBondContact O-N 3.31Å
23	I	51.7	Low	54.4	Low	85 Å²	85	95.6 Å²	95.6	44%	0.436	50%	0.5	S	S	.	.			trans	-69.7	84.7	176.1	-52	175.1	0	0	0	106.5	N21 V25	N21-I23 HydrophobicContact CB-CD1 4.45Å; N21-I23 HydrophobicContact CB-CG1 3.65Å; N21-I23 PolarHBondContact O-N 3.3Å; I23-V25 HydrophobicContact CG2-CG2 3.59Å
24	E	49.9	Very low	55.1	Low	136 Å²	136	97.3 Å²	97.3	64%	0.636	52%	0.52	S	S	*	.			trans	-85.2	100.9	155	-68.5	-174.5	166.7	0	0	105.2	D22 E26	D22-E24 PolarHBondContact O-N 3.31Å; E24-E26 HydrophobicContact CB-CG 4.04Å; E24-E26 PolarHBondContact O-N 2.79Å
25	V	52.8	Low	56.2	Low	79 Å²	79	98.4 Å²	98.4	48%	0.479	52%	0.521	S	S	.	.			trans	-70.5	90.7	167.5	-175	0	0	0	0	105.6	I23 N51	I23-V25 HydrophobicContact CG2-CG2 3.59Å; V25-N51 HydrophobicContact CG1-CB 3.45Å; V25-N51 VanDerWaalsContact CG1-CB 3.45Å; V25-N51 WeakPolarHBondContact CG1-OD1 3.33Å
26	E	53.6	Low	57.2	Low	117 Å²	117	98.8 Å²	98.8	55%	0.547	52%	0.523	S	S	.	.			trans	-91.9	141.3	173.3	-63	-167.2	146	0	0	109.1	E24	E24-E26 HydrophobicContact CB-CG 4.04Å; E24-E26 PolarHBondContact O-N 2.79Å
27	N	54.6	Low	58.4	Low	81 Å²	81	99 Å²	99	43%	0.433	53%	0.525	S	S	.	.	B	Isolated β-bridge	trans	-79.7	140.7	166.9	-69.1	1.8	0	0	0	108	V29	N27-V29 PolarHBondContact O-N 2.85Å; N27-V29 VanDerWaalsContact O-N 3.09Å
28	I	56.5	Low	59.5	Low	31 Å²	31	101.7 Å²	101.7	16%	0.159	53%	0.531	C	S	.	.			trans	-68.6	110.3	173.1	-58	173.2	0	0	0	108.3	T30 P37 F46 I52	I28-T30 HydrophobicContact CG2-CG2 3.76Å; I28-P37 HydrophobicContact CD1-CG 3.88Å; I28-P37 HydrophobicContact CG2-CG 4.07Å; I28-F46 HydrophobicContact CD1-CB 3.19Å; I28-F46 HydrophobicContact CD1-CD1 4.2Å; I28-F46 HydrophobicContact CD1-CD2 3.91Å; I28-F46 HydrophobicContact CD1-CG 3.53Å; I28-I52 HydrophobicContact CD1-CG2 3.67Å; I28-I52 HydrophobicContact CG1-CD1 4.19Å; I28-I52 HydrophobicContact CG1-CG2 3.74Å
29	V	53.6	Low	60.6	Low	107 Å²	107	98.5 Å²	98.5	65%	0.648	51%	0.512	S	S	*	.			trans	-90.2	100.8	164.7	-171	0	0	0	0	107	N27 H31	N27-V29 PolarHBondContact O-N 2.85Å; N27-V29 VanDerWaalsContact O-N 3.09Å; V29-H31 PolarHBondContact O-N 3.22Å
30	T	48.8	Very low	61.6	Low	89 Å²	89	102.6 Å²	102.6	55%	0.546	53%	0.531	S	S	.	.			trans	-72.1	107	177.1	46	0	0	0	0	109.8	I28	I28-T30 HydrophobicContact CG2-CG2 3.76Å
31	H	50.5	Low	62.8	Low	148 Å²	148	101.3 Å²	101.3	69%	0.685	52%	0.522	S	S	*	.			trans	-113.3	105.7	168.2	-80.1	-60.8	0	0	0	109.5	V29 T33	V29-H31 PolarHBondContact O-N 3.22Å; H31-T33 PolarHBondContact O-N 2.71Å
32	D	49.8	Very low	64.4	Low	175 Å²	175	103.3 Å²	103.3	94%	0.936	54%	0.536	S	S	*	.	S	Bend	trans	31	54.5	160.5	-66.3	-24.2	0	0	0	117.9
33	T	52.3	Low	66.2	Low	119 Å²	119	102.8 Å²	102.8	73%	0.73	53%	0.533	S	S	*	.			trans	-122.3	136.6	164.8	53	0	0	0	0	110.7	H31 E35	H31-T33 PolarHBondContact O-N 2.71Å; T33-E35 PolarHBondContact O-N 3.03Å; T33-E35 VanDerWaalsContact O-N 3.08Å
34	V	57.6	Low	68.1	Low	155 Å²	155	104.5 Å²	104.5	94%	0.939	54%	0.54	S	S	*	.	S	Bend	trans	-70.3	-3.1	-163.3	-179.5	0	0	0	0	114.8
35	E	67.7	Low	70	Confident	170 Å²	170	100.4 Å²	100.4	79%	0.794	53%	0.525	S	S	*	.	S	Bend	trans	-125.2	122.8	178.2	-68.2	-177.1	169.8	0	0	110.1	T33	T33-E35 PolarHBondContact O-N 3.03Å; T33-E35 VanDerWaalsContact O-N 3.08Å
36	E	73.5	Confident	71.6	Confident	138 Å²	138	97.7 Å²	97.7	65%	0.645	51%	0.507	S	S	*	.			trans	-65.4	138.4	174.7	-69.2	172.9	-176.5	0	0	109.6	H38	E36-H38 PolarHBondContact O-CE1 2.97Å; E36-H38 VanDerWaalsContact O-CE1 3.22Å; E36-H38 PolarHBondContact O-N 3.35Å; E36-H38 PolarHBondContact O-ND1 2.94Å
37	P	83.4	Confident	73	Confident	41 Å²	41	96.5 Å²	96.5	27%	0.266	51%	0.507	S	S	.	.			trans	-62.8	131	173.6	23	-29.9	0	0	0	109.9	I28 F46 I59	I28-P37 HydrophobicContact CD1-CG 3.88Å; I28-P37 HydrophobicContact CG2-CG 4.07Å; P37-F46 HydrophobicContact CB-CD2 4.08Å; P37-F46 HydrophobicContact CG-CD2 4.41Å; P37-F46 WeakPolarHBondContact O-CD2 3.26Å; P37-F46 PolarHBondContact O-N 3.16Å; P37-I59 HydrophobicContact CB-CD1 3.31Å
38	H	88.7	Confident	73.8	Confident	91 Å²	91	100.1 Å²	100.1	42%	0.421	52%	0.522	S	S	.	.	B	Isolated β-bridge	trans	-116.1	142.5	177.7	-67.4	77.7	0	0	0	110.9	E36 K40 D43 I59	E36-H38 PolarHBondContact O-CE1 2.97Å; E36-H38 VanDerWaalsContact O-CE1 3.22Å; E36-H38 PolarHBondContact O-N 3.35Å; E36-H38 PolarHBondContact O-ND1 2.94Å; H38-K40 PolarHBondContact O-N 2.99Å; H38-D43 PolarHBondContact CD2-O 3Å; H38-D43 VanDerWaalsContact CD2-O 3.31Å; H38-I59 WeakPolarHBondContact O-CG1 2.91Å
39	C	89.9	Confident	74.7	Confident	0 Å²	0	104.5 Å²	104.5	0%	0	55%	0.546	C	S	.	.			trans	-68.8	122	177.3	172	0	0	0	0	110.8	R41 C42 D43 E44 F46 I59 H61	C39-R41 PolarHBondContact O-N 2.92Å; C39-C42 VanDerWaalsContact CB-SG 3.57Å; C39-C42 PolarHBondContact O-N 3.48Å; C39-C42 VanDerWaalsContact SG-SG 3.69Å; C39-D43 VanDerWaalsContact O-CA 3.27Å; C39-D43 WeakPolarHBondContact O-CA 3.23Å; C39-D43 PolarHBondContact O-N 2.93Å; C39-E44 PolarHBondContact N-O 2.89Å; C39-F46 HydrophobicContact CB-CE1 4.4Å; C39-F46 HydrophobicContact CB-CE2 4.04Å; C39-F46 HydrophobicContact CB-CZ 3.74Å; C39-I59 WeakPolarHBondContact CA-O 3.34Å; C39-H61 WeakPolarHBondContact CB-CE1 3.4Å; C39-H61 VanDerWaalsContact CB-ND1 3.33Å; C39-H61 WeakPolarHBondContact CB-ND1 3.46Å; C39-H61 PolarHBondContact SG-N 3.13Å; C39-H61 VanDerWaalsContact SG-N 3.44Å
40	K	88.3	Confident	75.9	Confident	120 Å²	120	102 Å²	102	52%	0.522	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-15.3	-178.3	-174.3	62.1	166.7	-149.3	0	115.9	H38 D58 I59 Y60	H38-K40 PolarHBondContact O-N 2.99Å; K40-D58 HydrophobicContact CB-CB 4.11Å; K40-D58 WeakPolarHBondContact CD-OD1 3.45Å; K40-D58 WeakPolarHBondContact CE-OD1 3.41Å; K40-D58 HydrophobicContact CG-CB 4.02Å; K40-D58 WeakPolarHBondContact CG-OD1 2.99Å; K40-D58 IonicContact NZ-OD1 3.89Å; K40-D58 PolarHBondContact NZ-OD1 3.05Å; K40-I59 PolarHBondContact N-O 3.29Å; K40-Y60 HydrophobicContact CB-CD1 4.13Å; K40-Y60 HydrophobicContact CB-CE1 3.56Å; K40-Y60 HydrophobicContact CG-CE1 3.97Å
41	R	86.7	Confident	77.4	Confident	108 Å²	108	101.7 Å²	101.7	41%	0.408	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-45.2	-178.8	-178.3	179	176.4	-160.5	-3.7	113.5	C39 Y60 C64 V66	C39-R41 PolarHBondContact O-N 2.92Å; R41-Y60 HydrophobicContact CB-CD1 4.07Å; R41-Y60 HydrophobicContact CB-CE1 4.34Å; R41-C64 HydrophobicContact CB-CB 4.07Å; R41-C64 WeakPolarHBondContact CD-O 3.47Å; R41-C64 HydrophobicContact CG-CB 4.48Å; R41-C64 PolarHBondContact NH1-O 3.37Å; R41-V66 VanDerWaalsContact CZ-CG2 3.42Å
42	C	90.7	Very high	79	Confident	51 Å²	51	95.7 Å²	95.7	35%	0.345	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-8.3	-175.5	63.4	0	0	0	0	113	C39 E44 H61	C39-C42 VanDerWaalsContact CB-SG 3.57Å; C39-C42 PolarHBondContact O-N 3.48Å; C39-C42 VanDerWaalsContact SG-SG 3.69Å; C42-E44 HydrophobicContact CB-CG 4.28Å; C42-E44 PolarHBondContact O-N 2.91Å; C42-E44 VanDerWaalsContact O-N 3.11Å; C42-H61 VanDerWaalsContact SG-CE1 3.51Å; C42-H61 PolarHBondContact SG-ND1 2.87Å
43	D	90	Very high	80.6	Confident	117 Å²	117	88.2 Å²	88.2	63%	0.626	46%	0.455	S	S	*	.			trans	56.2	18.7	-175.9	-60	-34.9	0	0	0	113.9	H38 C39	H38-D43 PolarHBondContact CD2-O 3Å; H38-D43 VanDerWaalsContact CD2-O 3.31Å; C39-D43 VanDerWaalsContact O-CA 3.27Å; C39-D43 WeakPolarHBondContact O-CA 3.23Å; C39-D43 PolarHBondContact O-N 2.93Å
44	E	90.8	Very high	82.1	Confident	121 Å²	121	85.7 Å²	85.7	57%	0.565	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-86.4	144.8	173	-62.7	-67.1	158.2	0	0	110.1	C39 C42	C39-E44 PolarHBondContact N-O 2.89Å; C42-E44 HydrophobicContact CB-CG 4.28Å; C42-E44 PolarHBondContact O-N 2.91Å; C42-E44 VanDerWaalsContact O-N 3.11Å
45	P	89.2	Confident	83.1	Confident	51 Å²	51	78.8 Å²	78.8	33%	0.331	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-69.5	152.7	174.9	31	-35	0	0	0	110.9
46	F	86.5	Confident	83.7	Confident	21 Å²	21	77.6 Å²	77.6	9%	0.092	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-84.1	144.3	173	-65	-90	0	0	0	110.8	I28 P37 C39 I52 I59 H61	I28-F46 HydrophobicContact CD1-CB 3.19Å; I28-F46 HydrophobicContact CD1-CD1 4.2Å; I28-F46 HydrophobicContact CD1-CD2 3.91Å; I28-F46 HydrophobicContact CD1-CG 3.53Å; P37-F46 HydrophobicContact CB-CD2 4.08Å; P37-F46 HydrophobicContact CG-CD2 4.41Å; P37-F46 WeakPolarHBondContact O-CD2 3.26Å; P37-F46 PolarHBondContact O-N 3.16Å; C39-F46 HydrophobicContact CB-CE1 4.4Å; C39-F46 HydrophobicContact CB-CE2 4.04Å; C39-F46 HydrophobicContact CB-CZ 3.74Å; F46-I52 HydrophobicContact CD1-CG2 3.5Å; F46-I52 HydrophobicContact CE1-CB 4.26Å; F46-I52 HydrophobicContact CE1-CG2 3.5Å; F46-I52 VanDerWaalsContact CE1-CG2 3.5Å; F46-I52 HydrophobicContact CG-CG2 4.09Å; F46-I52 HydrophobicContact CZ-CG2 4.11Å; F46-I59 HydrophobicContact CD2-CD1 4.1Å; F46-I59 HydrophobicContact CE2-CB 4.12Å; F46-I59 HydrophobicContact CE2-CD1 3.47Å; F46-I59 VanDerWaalsContact CE2-CD1 3.47Å; F46-I59 HydrophobicContact CE2-CG1 3.68Å; F46-I59 HydrophobicContact CZ-CB 4.08Å; F46-I59 HydrophobicContact CZ-CD1 4.29Å; F46-I59 HydrophobicContact CZ-CG1 4.1Å; F46-H61 AromaticContact CD1-CD2 3.36Å; F46-H61 WeakPolarHBondContact CD1-CD2 3.31Å; F46-H61 AromaticContact CD1-NE2 3.4Å; F46-H61 WeakPolarHBondContact CD1-NE2 3.28Å; F46-H61 AromaticContact CE1-CD2 3.34Å; F46-H61 WeakPolarHBondContact CE1-CD2 3.48Å; F46-H61 AromaticContact CE1-CG 3.92Å; F46-H61 AromaticContact CE1-NE2 3.62Å; F46-H61 AromaticContact CG-NE2 3.96Å
47	T	83.9	Confident	84.1	Confident	92 Å²	92	78.7 Å²	78.7	56%	0.564	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-78.8	156.9	173	62.6	0	0	0	0	111.9	D49 E50	T47-D49 PolarHBondContact O-N 2.84Å; T47-E50 PolarHBondContact N-OE2 3.47Å; T47-E50 VanDerWaalsContact N-OE2 3.13Å; T47-E50 WeakPolarHBondContact O-CB 3.45Å; T47-E50 PolarHBondContact O-N 2.92Å
48	E	72.3	Confident	84.3	Confident	158 Å²	158	79.2 Å²	79.2	74%	0.738	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	131.3	165.1	-63.7	179.8	173	0	0	108.7	E50	E48-E50 PolarHBondContact O-N 3.31Å
49	D	74.9	Confident	84.2	Confident	123 Å²	123	76.7 Å²	76.7	66%	0.658	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	12.8	-174.6	-54.5	-46.8	0	0	0	117.6	T47	T47-D49 PolarHBondContact O-N 2.84Å
50	E	78.2	Confident	84.1	Confident	55 Å²	55	77.6 Å²	77.6	26%	0.257	40%	0.396	S	S	.	.			trans	-77.5	133.3	173.7	-158.1	170.7	-177.5	0	0	112.4	T47 E48 I52 H61	T47-E50 PolarHBondContact N-OE2 3.47Å; T47-E50 VanDerWaalsContact N-OE2 3.13Å; T47-E50 WeakPolarHBondContact O-CB 3.45Å; T47-E50 PolarHBondContact O-N 2.92Å; E48-E50 PolarHBondContact O-N 3.31Å; E50-I52 PolarHBondContact O-N 2.8Å; E50-H61 IonicContact OE1-CD2 2.69Å; E50-H61 PolarHBondContact OE1-CD2 3.06Å; E50-H61 IonicContact OE1-NE2 4Å; E50-H61 IonicContact OE2-CD2 3.4Å; E50-H61 IonicContact OE2-NE2 3.6Å
51	N	81.2	Confident	84	Confident	82 Å²	82	72.5 Å²	72.5	44%	0.439	38%	0.375	S	S	.	.	B	Isolated β-bridge	trans	-63.9	130.9	172.9	-71.1	-26.8	0	0	0	110.3	V25 P62	V25-N51 HydrophobicContact CG1-CB 3.45Å; V25-N51 VanDerWaalsContact CG1-CB 3.45Å; V25-N51 WeakPolarHBondContact CG1-OD1 3.33Å; N51-P62 HydrophobicContact CB-CG 4Å; N51-P62 WeakPolarHBondContact O-CD 3.37Å; N51-P62 VanDerWaalsContact O-CG 3.32Å; N51-P62 WeakPolarHBondContact O-CG 3.19Å
52	I	83.5	Confident	83.9	Confident	21 Å²	21	70.1 Å²	70.1	11%	0.108	37%	0.373	C	S	.	.			trans	-112.4	156.5	175.6	66.2	174.8	0	0	0	113	I28 F46 E50 I59	I28-I52 HydrophobicContact CD1-CG2 3.67Å; I28-I52 HydrophobicContact CG1-CD1 4.19Å; I28-I52 HydrophobicContact CG1-CG2 3.74Å; F46-I52 HydrophobicContact CD1-CG2 3.5Å; F46-I52 HydrophobicContact CE1-CB 4.26Å; F46-I52 HydrophobicContact CE1-CG2 3.5Å; F46-I52 VanDerWaalsContact CE1-CG2 3.5Å; F46-I52 HydrophobicContact CG-CG2 4.09Å; F46-I52 HydrophobicContact CZ-CG2 4.11Å; E50-I52 PolarHBondContact O-N 2.8Å; I52-I59 HydrophobicContact CD1-CG2 4.31Å
53	V	83.8	Confident	83.8	Confident	18 Å²	18	72.9 Å²	72.9	11%	0.109	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	107.1	165.6	-176.7	0	0	0	0	108	V55 Y60 P62 F65	V53-V55 HydrophobicContact CG1-CG2 4.21Å; V53-Y60 PolarHBondContact N-O 2.89Å; V53-Y60 PolarHBondContact O-N 3.23Å; V53-P62 HydrophobicContact CG2-CB 4.38Å; V53-P62 HydrophobicContact CG2-CG 4.32Å; V53-F65 HydrophobicContact CB-CB 4.19Å; V53-F65 HydrophobicContact CB-CD2 4.2Å; V53-F65 HydrophobicContact CB-CG 4.18Å; V53-F65 HydrophobicContact CG1-CB 4.22Å; V53-F65 HydrophobicContact CG1-CD1 4.03Å; V53-F65 HydrophobicContact CG1-CD2 3.59Å; V53-F65 HydrophobicContact CG1-CE1 4.37Å; V53-F65 HydrophobicContact CG1-CE2 4Å; V53-F65 HydrophobicContact CG1-CG 3.67Å; V53-F65 HydrophobicContact CG1-CZ 4.38Å; V53-F65 HydrophobicContact CG2-CB 4.15Å; V53-F65 HydrophobicContact CG2-CG 4.45Å
54	S	82.7	Confident	83.7	Confident	66 Å²	66	68.1 Å²	68.1	46%	0.462	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	128.5	175.3	-176.6	0	0	0	0	110.5
55	V	80	Confident	83.6	Confident	11 Å²	11	62.6 Å²	62.6	7%	0.067	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	108.9	173.7	177.3	0	0	0	0	109	N21 V53 D57 D58 Y60 F65 F79	N21-V55 VanDerWaalsContact OD1-CG2 3.31Å; N21-V55 WeakPolarHBondContact OD1-CG2 3.13Å; V53-V55 HydrophobicContact CG1-CG2 4.21Å; V55-D57 PolarHBondContact O-N 3.04Å; V55-D58 PolarHBondContact N-O 3.14Å; V55-D58 PolarHBondContact O-N 3.3Å; V55-D58 VanDerWaalsContact O-N 3.16Å; V55-Y60 HydrophobicContact CB-CE2 4.46Å; V55-F65 HydrophobicContact CB-CE2 4.37Å; V55-F65 HydrophobicContact CG2-CD2 4.34Å; V55-F65 HydrophobicContact CG2-CE2 3.41Å; V55-F65 VanDerWaalsContact CG2-CE2 3.41Å; V55-F65 HydrophobicContact CG2-CZ 3.77Å; V55-F79 HydrophobicContact CG1-CE2 4.45Å; V55-F79 HydrophobicContact CG1-CZ 3.73Å; V55-F79 HydrophobicContact CG2-CZ 4.19Å
56	K	79.3	Confident	83.6	Confident	144 Å²	144	60.5 Å²	60.5	63%	0.626	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	-113.7	-169.5	-63.2	-178.6	167.1	176.7	0	110.3
57	D	82.5	Confident	83.5	Confident	161 Å²	161	59.5 Å²	59.5	86%	0.861	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-1	-177.8	-50.3	-52.7	0	0	0	111.9	V55	V55-D57 PolarHBondContact O-N 3.04Å
58	D	86.4	Confident	83.7	Confident	52 Å²	52	57.6 Å²	57.6	28%	0.278	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	138.7	-179.8	-67.1	-44.2	0	0	0	110.9	K40 V55 Y60	K40-D58 HydrophobicContact CB-CB 4.11Å; K40-D58 WeakPolarHBondContact CD-OD1 3.45Å; K40-D58 WeakPolarHBondContact CE-OD1 3.41Å; K40-D58 HydrophobicContact CG-CB 4.02Å; K40-D58 WeakPolarHBondContact CG-OD1 2.99Å; K40-D58 IonicContact NZ-OD1 3.89Å; K40-D58 PolarHBondContact NZ-OD1 3.05Å; V55-D58 PolarHBondContact N-O 3.14Å; V55-D58 PolarHBondContact O-N 3.3Å; V55-D58 VanDerWaalsContact O-N 3.16Å; D58-Y60 HydrophobicContact CB-CD2 4.49Å; D58-Y60 HydrophobicContact CB-CE2 3.51Å; D58-Y60 WeakPolarHBondContact CB-OH 3.06Å; D58-Y60 PolarHBondContact OD2-OH 2.78Å
59	I	87.6	Confident	84.2	Confident	39 Å²	39	54.8 Å²	54.8	20%	0.2	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	141.3	177.7	52.9	178	0	0	0	110.8	P37 H38 C39 K40 F46 I52	P37-I59 HydrophobicContact CB-CD1 3.31Å; H38-I59 WeakPolarHBondContact O-CG1 2.91Å; C39-I59 WeakPolarHBondContact CA-O 3.34Å; K40-I59 PolarHBondContact N-O 3.29Å; F46-I59 HydrophobicContact CD2-CD1 4.1Å; F46-I59 HydrophobicContact CE2-CB 4.12Å; F46-I59 HydrophobicContact CE2-CD1 3.47Å; F46-I59 VanDerWaalsContact CE2-CD1 3.47Å; F46-I59 HydrophobicContact CE2-CG1 3.68Å; F46-I59 HydrophobicContact CZ-CB 4.08Å; F46-I59 HydrophobicContact CZ-CD1 4.29Å; F46-I59 HydrophobicContact CZ-CG1 4.1Å; I52-I59 HydrophobicContact CD1-CG2 4.31Å
60	Y	88	Confident	84.7	Confident	18 Å²	18	51 Å²	51	7%	0.071	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	145.2	-176.4	-56.6	-91.2	0	0	0	111.8	K40 R41 V53 V55 D58 F65 R86	K40-Y60 HydrophobicContact CB-CD1 4.13Å; K40-Y60 HydrophobicContact CB-CE1 3.56Å; K40-Y60 HydrophobicContact CG-CE1 3.97Å; R41-Y60 HydrophobicContact CB-CD1 4.07Å; R41-Y60 HydrophobicContact CB-CE1 4.34Å; V53-Y60 PolarHBondContact N-O 2.89Å; V53-Y60 PolarHBondContact O-N 3.23Å; V55-Y60 HydrophobicContact CB-CE2 4.46Å; D58-Y60 HydrophobicContact CB-CD2 4.49Å; D58-Y60 HydrophobicContact CB-CE2 3.51Å; D58-Y60 WeakPolarHBondContact CB-OH 3.06Å; D58-Y60 PolarHBondContact OD2-OH 2.78Å; Y60-F65 AromaticContact CD2-CD2 3.76Å; Y60-F65 HydrophobicContact CD2-CD2 3.76Å; Y60-F65 HydrophobicContact CD2-CE2 4.19Å; Y60-F65 HydrophobicContact CE2-CD2 4.4Å; Y60-F65 HydrophobicContact CE2-CE2 4.45Å; Y60-F65 AromaticContact CG-CD2 3.94Å; Y60-F65 HydrophobicContact CG-CD2 3.94Å; Y60-R86 VanDerWaalsContact CD1-NH1 3.27Å; Y60-R86 VanDerWaalsContact CZ-NH1 3.28Å
61	H	86.6	Confident	85	Confident	14 Å²	14	54.7 Å²	54.7	7%	0.065	29%	0.293	C	S	.	.			trans	-59.3	145.6	160	-57.9	113.2	0	0	0	109.5	C39 C42 F46 E50 T63 C64 F65	C39-H61 WeakPolarHBondContact CB-CE1 3.4Å; C39-H61 VanDerWaalsContact CB-ND1 3.33Å; C39-H61 WeakPolarHBondContact CB-ND1 3.46Å; C39-H61 PolarHBondContact SG-N 3.13Å; C39-H61 VanDerWaalsContact SG-N 3.44Å; C42-H61 VanDerWaalsContact SG-CE1 3.51Å; C42-H61 PolarHBondContact SG-ND1 2.87Å; F46-H61 AromaticContact CD1-CD2 3.36Å; F46-H61 WeakPolarHBondContact CD1-CD2 3.31Å; F46-H61 AromaticContact CD1-NE2 3.4Å; F46-H61 WeakPolarHBondContact CD1-NE2 3.28Å; F46-H61 AromaticContact CE1-CD2 3.34Å; F46-H61 WeakPolarHBondContact CE1-CD2 3.48Å; F46-H61 AromaticContact CE1-CG 3.92Å; F46-H61 AromaticContact CE1-NE2 3.62Å; F46-H61 AromaticContact CG-NE2 3.96Å; E50-H61 IonicContact OE1-CD2 2.69Å; E50-H61 PolarHBondContact OE1-CD2 3.06Å; E50-H61 IonicContact OE1-NE2 4Å; E50-H61 IonicContact OE2-CD2 3.4Å; E50-H61 IonicContact OE2-NE2 3.6Å; H61-T63 PolarHBondContact O-N 3.34Å; H61-C64 HydrophobicContact CB-CB 3.81Å; H61-C64 CarbonylContact O-C 3.54Å; H61-C64 WeakPolarHBondContact O-CA 3.49Å; H61-C64 WeakPolarHBondContact O-CB 3.47Å; H61-C64 PolarHBondContact O-N 3.5Å; H61-F65 PolarHBondContact O-N 3.33Å
62	P	85	Confident	85.1	Confident	57 Å²	57	56.8 Å²	56.8	37%	0.37	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-36.3	174.5	-28.2	34.6	0	0	0	112.4	N51 V53 C64 F65	N51-P62 HydrophobicContact CB-CG 4Å; N51-P62 WeakPolarHBondContact O-CD 3.37Å; N51-P62 VanDerWaalsContact O-CG 3.32Å; N51-P62 WeakPolarHBondContact O-CG 3.19Å; V53-P62 HydrophobicContact CG2-CB 4.38Å; V53-P62 HydrophobicContact CG2-CG 4.32Å; P62-C64 VanDerWaalsContact C-N 3.34Å; P62-F65 PolarHBondContact O-N 3.16Å
63	T	87.1	Confident	85.2	Confident	110 Å²	110	59.1 Å²	59.1	68%	0.675	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-24.4	174.4	56	0	0	0	0	113.3	H61 V66	H61-T63 PolarHBondContact O-N 3.34Å; T63-V66 WeakPolarHBondContact O-CG1 3.35Å
64	C	88.7	Confident	85.3	Confident	16 Å²	16	58.8 Å²	58.8	11%	0.108	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-21.3	176.2	-74.7	0	0	0	0	112.7	R41 H61 P62 V66	R41-C64 HydrophobicContact CB-CB 4.07Å; R41-C64 WeakPolarHBondContact CD-O 3.47Å; R41-C64 HydrophobicContact CG-CB 4.48Å; R41-C64 PolarHBondContact NH1-O 3.37Å; H61-C64 HydrophobicContact CB-CB 3.81Å; H61-C64 CarbonylContact O-C 3.54Å; H61-C64 WeakPolarHBondContact O-CA 3.49Å; H61-C64 WeakPolarHBondContact O-CB 3.47Å; H61-C64 PolarHBondContact O-N 3.5Å; P62-C64 VanDerWaalsContact C-N 3.34Å; C64-V66 VanDerWaalsContact C-N 3.33Å; C64-V66 PolarHBondContact O-N 3.27Å
65	F	89.3	Confident	84.3	Confident	5 Å²	5	60.3 Å²	60.3	2%	0.022	32%	0.323	C	S	.	.			trans	-80	75.6	177.8	-162.4	-95.5	0	0	0	111.8	N21 V53 V55 Y60 H61 P62 L74 F79	N21-F65 WeakPolarHBondContact ND2-CE1 3.33Å; N21-F65 WeakPolarHBondContact ND2-CZ 3.27Å; V53-F65 HydrophobicContact CB-CB 4.19Å; V53-F65 HydrophobicContact CB-CD2 4.2Å; V53-F65 HydrophobicContact CB-CG 4.18Å; V53-F65 HydrophobicContact CG1-CB 4.22Å; V53-F65 HydrophobicContact CG1-CD1 4.03Å; V53-F65 HydrophobicContact CG1-CD2 3.59Å; V53-F65 HydrophobicContact CG1-CE1 4.37Å; V53-F65 HydrophobicContact CG1-CE2 4Å; V53-F65 HydrophobicContact CG1-CG 3.67Å; V53-F65 HydrophobicContact CG1-CZ 4.38Å; V53-F65 HydrophobicContact CG2-CB 4.15Å; V53-F65 HydrophobicContact CG2-CG 4.45Å; V55-F65 HydrophobicContact CB-CE2 4.37Å; V55-F65 HydrophobicContact CG2-CD2 4.34Å; V55-F65 HydrophobicContact CG2-CE2 3.41Å; V55-F65 VanDerWaalsContact CG2-CE2 3.41Å; V55-F65 HydrophobicContact CG2-CZ 3.77Å; Y60-F65 AromaticContact CD2-CD2 3.76Å; Y60-F65 HydrophobicContact CD2-CD2 3.76Å; Y60-F65 HydrophobicContact CD2-CE2 4.19Å; Y60-F65 HydrophobicContact CE2-CD2 4.4Å; Y60-F65 HydrophobicContact CE2-CE2 4.45Å; Y60-F65 AromaticContact CG-CD2 3.94Å; Y60-F65 HydrophobicContact CG-CD2 3.94Å; H61-F65 PolarHBondContact O-N 3.33Å; P62-F65 PolarHBondContact O-N 3.16Å; F65-L74 HydrophobicContact CD1-CB 3.71Å; F65-L74 HydrophobicContact CD1-CD1 4.01Å; F65-L74 HydrophobicContact CD1-CG 4.38Å; F65-L74 HydrophobicContact CE1-CB 3.58Å; F65-L74 HydrophobicContact CE1-CD1 3.58Å; F65-L74 HydrophobicContact CE1-CG 4.2Å; F65-L74 HydrophobicContact CZ-CD1 4.03Å; F65-L74 PolarHBondContact O-N 3.4Å; F65-F79 HydrophobicContact CE1-CD1 4.45Å; F65-F79 HydrophobicContact CZ-CD1 4.17Å; F65-F79 HydrophobicContact CZ-CD2 4.38Å; F65-F79 HydrophobicContact CZ-CE1 4.03Å; F65-F79 HydrophobicContact CZ-CE2 4.2Å; F65-F79 HydrophobicContact CZ-CG 4.33Å; F65-F79 AromaticContact CZ-CZ 3.99Å; F65-F79 HydrophobicContact CZ-CZ 3.99Å
66	V	88	Confident	83.4	Confident	8 Å²	8	64.7 Å²	64.7	5%	0.048	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-121.4	163.5	-175.7	-48.5	0	0	0	0	112.3	R41 T63 C64 T68 F71 Q72	R41-V66 VanDerWaalsContact CZ-CG2 3.42Å; T63-V66 WeakPolarHBondContact O-CG1 3.35Å; C64-V66 VanDerWaalsContact C-N 3.33Å; C64-V66 PolarHBondContact O-N 3.27Å; V66-T68 PolarHBondContact O-N 3.05Å; V66-F71 WeakPolarHBondContact CB-O 3.23Å; V66-F71 HydrophobicContact CG2-CB 4.45Å; V66-F71 HydrophobicContact CG2-CD1 4.24Å; V66-Q72 CarbonylContact C-O 3.58Å; V66-Q72 VanDerWaalsContact CA-O 3.26Å; V66-Q72 WeakPolarHBondContact CA-O 3.39Å; V66-Q72 VanDerWaalsContact CB-O 3.28Å; V66-Q72 WeakPolarHBondContact CB-O 3.36Å
67	C	85.1	Confident	82.8	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.344	C	S	.	.			trans	-66.1	130.8	167.8	178.1	0	0	0	0	111.1	Q69 C70 F71 Q72 L74 R86 Y87 C88 D91	C67-Q69 PolarHBondContact O-N 3Å; C67-Q69 VanDerWaalsContact O-N 3.16Å; C67-Q69 PolarHBondContact SG-N 2.68Å; C67-C70 WeakPolarHBondContact CB-SG 3.38Å; C67-F71 WeakPolarHBondContact O-CA 3.37Å; C67-F71 PolarHBondContact O-N 3.01Å; C67-Q72 PolarHBondContact N-O 3.39Å; C67-L74 HydrophobicContact CB-CD2 3.85Å; C67-L74 HydrophobicContact CB-CG 4.45Å; C67-R86 CarbonylContact C-O 3.47Å; C67-R86 WeakPolarHBondContact CA-O 3.37Å; C67-Y87 VanDerWaalsContact SG-CA 3.59Å; C67-C88 HydrophobicContact CB-CB 4.12Å; C67-C88 PolarHBondContact SG-N 3.46Å; C67-D91 PolarHBondContact SG-OD2 3.39Å
68	T	88	Confident	82.7	Confident	51 Å²	51	59.4 Å²	59.4	31%	0.313	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-22.1	177.1	-54.3	0	0	0	0	113.7	V66 R85 R86	V66-T68 PolarHBondContact O-N 3.05Å; T68-R85 HydrophobicContact CG2-CB 4.35Å; T68-R85 HydrophobicContact CG2-CG 4.35Å; T68-R86 WeakPolarHBondContact CB-O 3.29Å; T68-R86 PolarHBondContact N-O 2.95Å; T68-R86 PolarHBondContact OG1-N 3.27Å; T68-R86 PolarHBondContact OG1-O 3.22Å; T68-R86 VanDerWaalsContact OG1-O 3.13Å
69	Q	82	Confident	82.8	Confident	100 Å²	100	56.9 Å²	56.9	47%	0.467	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-59.3	-178.4	-177.4	65	9.5	0	0	112.6	C67 Y87 D91 L95	C67-Q69 PolarHBondContact O-N 3Å; C67-Q69 VanDerWaalsContact O-N 3.16Å; C67-Q69 PolarHBondContact SG-N 2.68Å; Q69-Y87 HydrophobicContact CB-CD1 4.16Å; Q69-Y87 HydrophobicContact CB-CE1 4.37Å; Q69-D91 HydrophobicContact CB-CB 3.81Å; Q69-D91 HydrophobicContact CG-CB 4Å; Q69-L95 HydrophobicContact CB-CD1 4.24Å; Q69-L95 HydrophobicContact CG-CD1 4.03Å
70	C	84.8	Confident	82.8	Confident	43 Å²	43	55.7 Å²	55.7	29%	0.291	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-6.7	-177.6	66.3	0	0	0	0	114.9	C67 Q72 D91	C67-C70 WeakPolarHBondContact CB-SG 3.38Å; C70-Q72 HydrophobicContact CB-CG 4.21Å; C70-Q72 PolarHBondContact O-N 3.16Å; C70-D91 VanDerWaalsContact CB-OD2 3.23Å; C70-D91 WeakPolarHBondContact CB-OD2 3.09Å; C70-D91 PolarHBondContact N-OD2 2.89Å; C70-D91 PolarHBondContact SG-OD2 3.19Å
71	F	85.2	Confident	82.6	Confident	133 Å²	133	56.7 Å²	56.7	58%	0.583	30%	0.301	S	S	*	.			trans	56.8	10.4	-175.3	-54.1	-72.9	0	0	0	115.6	V66 C67	V66-F71 WeakPolarHBondContact CB-O 3.23Å; V66-F71 HydrophobicContact CG2-CB 4.45Å; V66-F71 HydrophobicContact CG2-CD1 4.24Å; C67-F71 WeakPolarHBondContact O-CA 3.37Å; C67-F71 PolarHBondContact O-N 3.01Å
72	Q	84.2	Confident	82.2	Confident	125 Å²	125	57.3 Å²	57.3	58%	0.584	30%	0.304	S	S	*	.			trans	-70.6	141.2	172.3	-62.6	-58.7	-53	0	0	109.9	V66 C67 C70 L74	V66-Q72 CarbonylContact C-O 3.58Å; V66-Q72 VanDerWaalsContact CA-O 3.26Å; V66-Q72 WeakPolarHBondContact CA-O 3.39Å; V66-Q72 VanDerWaalsContact CB-O 3.28Å; V66-Q72 WeakPolarHBondContact CB-O 3.36Å; C67-Q72 PolarHBondContact N-O 3.39Å; C70-Q72 HydrophobicContact CB-CG 4.21Å; C70-Q72 PolarHBondContact O-N 3.16Å; Q72-L74 PolarHBondContact O-N 2.94Å
73	P	85.9	Confident	82	Confident	70 Å²	70	61.2 Å²	61.2	46%	0.455	32%	0.317	S	S	.	.	B	Isolated β-bridge	trans	-48.9	135.6	168.4	-23.6	33	0	0	0	109.2	P75	P73-P75 WeakPolarHBondContact O-CD 3.2Å; P73-P75 WeakPolarHBondContact O-CG 2.97Å; P73-P75 VanDerWaalsContact O-N 3.15Å
74	L	84.1	Confident	81.7	Confident	11 Å²	11	59.1 Å²	59.1	6%	0.058	32%	0.317	C	S	.	.			trans	-79.5	92.2	175.3	-68.6	166.5	0	0	0	107	F65 C67 Q72 N76 F79 R86 C88	F65-L74 HydrophobicContact CD1-CB 3.71Å; F65-L74 HydrophobicContact CD1-CD1 4.01Å; F65-L74 HydrophobicContact CD1-CG 4.38Å; F65-L74 HydrophobicContact CE1-CB 3.58Å; F65-L74 HydrophobicContact CE1-CD1 3.58Å; F65-L74 HydrophobicContact CE1-CG 4.2Å; F65-L74 HydrophobicContact CZ-CD1 4.03Å; F65-L74 PolarHBondContact O-N 3.4Å; C67-L74 HydrophobicContact CB-CD2 3.85Å; C67-L74 HydrophobicContact CB-CG 4.45Å; Q72-L74 PolarHBondContact O-N 2.94Å; L74-N76 VanDerWaalsContact C-N 3.31Å; L74-N76 PolarHBondContact O-N 3.31Å; L74-F79 HydrophobicContact CD1-CB 4.12Å; L74-F79 HydrophobicContact CD1-CG 4.46Å; L74-F79 HydrophobicContact CD2-CB 4.27Å; L74-R86 HydrophobicContact CD1-CB 3.9Å; L74-C88 HydrophobicContact CD2-CB 3.86Å
75	P	62.7	Low	81.4	Confident	98 Å²	98	65 Å²	65	64%	0.636	34%	0.337	S	S	*	.			trans	-87	-10.9	-164.4	18	0.7	0	0	0	111.7	P73	P73-P75 WeakPolarHBondContact O-CD 3.2Å; P73-P75 WeakPolarHBondContact O-CG 2.97Å; P73-P75 VanDerWaalsContact O-N 3.15Å
76	N	60.4	Low	81.3	Confident	103 Å²	103	65.9 Å²	65.9	55%	0.551	34%	0.34	S	S	*	.	S	Bend	trans	-103.5	146.8	-168.6	-64.3	-21.8	0	0	0	108.9	L74 E78	L74-N76 VanDerWaalsContact C-N 3.31Å; L74-N76 PolarHBondContact O-N 3.31Å; N76-E78 PolarHBondContact O-N 3.21Å
77	K	67.6	Low	81.2	Confident	137 Å²	137	66.1 Å²	66.1	60%	0.596	34%	0.34	S	S	*	.	S	Bend	trans	-49.1	-35.5	170.2	-64.3	-168.3	175.4	-166.6	0	110.3	F20 N21	F20-K77 CarbonylContact C-O 3.57Å; F20-K77 WeakPolarHBondContact CA-O 3.28Å; N21-K77 PolarHBondContact N-O 3.2Å
78	E	81	Confident	81.2	Confident	57 Å²	57	67.4 Å²	67.4	27%	0.266	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	123.8	-178.3	-164.1	-173.7	164.4	0	0	113.5	V18 R19 F20 N76 Y80	V18-E78 HydrophobicContact CG1-CG 3.74Å; R19-E78 WeakPolarHBondContact O-CA 3.45Å; F20-E78 HydrophobicContact CD1-CB 4.34Å; F20-E78 HydrophobicContact CE1-CB 4.15Å; F20-E78 HydrophobicContact CE1-CG 4.05Å; F20-E78 HydrophobicContact CZ-CG 4.49Å; N76-E78 PolarHBondContact O-N 3.21Å; E78-Y80 HydrophobicContact CG-CE2 4.17Å; E78-Y80 WeakPolarHBondContact OE1-CE2 3.26Å; E78-Y80 VanDerWaalsContact OE1-CZ 3.24Å; E78-Y80 PolarHBondContact OE1-OH 2.93Å
79	F	88.5	Confident	81.1	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	162.9	166	69.2	-78.9	0	0	0	111.1	R19 N21 V55 F65 L74 R86	R19-F79 HydrophobicContact CB-CD1 3.97Å; R19-F79 HydrophobicContact CB-CD2 4.35Å; R19-F79 HydrophobicContact CB-CE1 3.29Å; R19-F79 HydrophobicContact CB-CE2 3.8Å; R19-F79 HydrophobicContact CB-CG 4.45Å; R19-F79 HydrophobicContact CB-CZ 3.25Å; R19-F79 VanDerWaalsContact CD-CZ 3.45Å; R19-F79 HydrophobicContact CG-CE1 4.42Å; R19-F79 HydrophobicContact CG-CE2 4.23Å; R19-F79 HydrophobicContact CG-CZ 3.92Å; R19-F79 PolarHBondContact N-O 3.03Å; R19-F79 PolarHBondContact O-N 3.03Å; N21-F79 HydrophobicContact CB-CE1 4.45Å; N21-F79 WeakPolarHBondContact OD1-CE1 3.48Å; V55-F79 HydrophobicContact CG1-CE2 4.45Å; V55-F79 HydrophobicContact CG1-CZ 3.73Å; V55-F79 HydrophobicContact CG2-CZ 4.19Å; F65-F79 HydrophobicContact CE1-CD1 4.45Å; F65-F79 HydrophobicContact CZ-CD1 4.17Å; F65-F79 HydrophobicContact CZ-CD2 4.38Å; F65-F79 HydrophobicContact CZ-CE1 4.03Å; F65-F79 HydrophobicContact CZ-CE2 4.2Å; F65-F79 HydrophobicContact CZ-CG 4.33Å; F65-F79 AromaticContact CZ-CZ 3.99Å; F65-F79 HydrophobicContact CZ-CZ 3.99Å; L74-F79 HydrophobicContact CD1-CB 4.12Å; L74-F79 HydrophobicContact CD1-CG 4.46Å; L74-F79 HydrophobicContact CD2-CB 4.27Å; F79-R86 HydrophobicContact CD2-CB 4.35Å; F79-R86 HydrophobicContact CD2-CG 4.09Å; F79-R86 HydrophobicContact CE2-CG 4.05Å
80	Y	86.2	Confident	81.2	Confident	13 Å²	13	72.5 Å²	72.5	5%	0.051	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	126.4	-175.4	-68.2	-105.3	0	0	0	109.9	V16 V18 E78 R86 Y87 K89 F92 M108	V16-Y80 HydrophobicContact CG1-CD1 4.25Å; V18-Y80 HydrophobicContact CG2-CD1 3.89Å; V18-Y80 HydrophobicContact CG2-CE1 3.59Å; E78-Y80 HydrophobicContact CG-CE2 4.17Å; E78-Y80 WeakPolarHBondContact OE1-CE2 3.26Å; E78-Y80 VanDerWaalsContact OE1-CZ 3.24Å; E78-Y80 PolarHBondContact OE1-OH 2.93Å; Y80-R86 CarbonylContact O-C 3.59Å; Y80-R86 WeakPolarHBondContact O-CA 3.33Å; Y80-Y87 PolarHBondContact N-O 3.45Å; Y80-Y87 PolarHBondContact O-N 2.56Å; Y80-K89 HydrophobicContact CD2-CB 4.35Å; Y80-K89 HydrophobicContact CE2-CB 3.81Å; Y80-K89 HydrophobicContact CE2-CG 3.89Å; Y80-F92 VanDerWaalsContact CB-CD2 3.44Å; Y80-F92 HydrophobicContact CD1-CB 4.33Å; Y80-F92 AromaticContact CD1-CD1 3.39Å; Y80-F92 HydrophobicContact CD1-CD1 3.39Å; Y80-F92 HydrophobicContact CD1-CD2 4.01Å; Y80-F92 AromaticContact CD1-CE1 3.61Å; Y80-F92 HydrophobicContact CD1-CE1 3.61Å; Y80-F92 HydrophobicContact CD1-CE2 4.2Å; Y80-F92 AromaticContact CD1-CG 3.61Å; Y80-F92 HydrophobicContact CD1-CG 3.61Å; Y80-F92 HydrophobicContact CD1-CZ 4.02Å; Y80-F92 HydrophobicContact CD2-CB 4.25Å; Y80-F92 HydrophobicContact CD2-CG 4.38Å; Y80-F92 AromaticContact CE1-CD1 3.84Å; Y80-F92 HydrophobicContact CE1-CD1 3.84Å; Y80-F92 HydrophobicContact CE1-CE1 4.02Å; Y80-F92 HydrophobicContact CE1-CG 4.44Å; Y80-F92 HydrophobicContact CG-CB 3.87Å; Y80-F92 AromaticContact CG-CD1 3.83Å; Y80-F92 HydrophobicContact CG-CD1 3.83Å; Y80-F92 AromaticContact CG-CD2 3.97Å; Y80-F92 HydrophobicContact CG-CD2 3.97Å; Y80-F92 HydrophobicContact CG-CE1 4.43Å; Y80-F92 AromaticContact CG-CG 3.58Å; Y80-F92 HydrophobicContact CG-CG 3.58Å; Y80-M108 HydrophobicContact CD1-CE 4.31Å; Y80-M108 HydrophobicContact CE1-CE 3.36Å; Y80-M108 WeakPolarHBondContact OH-CE 3.4Å
81	E	85.2	Confident	81.1	Confident	39 Å²	39	71.3 Å²	71.3	18%	0.182	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	129.6	172.7	-169.2	173.3	114.1	0	0	110.5	V16 A17 R19 R85	V16-E81 VanDerWaalsContact CA-O 3.23Å; V16-E81 WeakPolarHBondContact CA-O 3.46Å; A17-E81 HydrophobicContact CB-CB 4.33Å; A17-E81 PolarHBondContact N-O 2.95Å; A17-E81 VanDerWaalsContact N-O 3.16Å; A17-E81 PolarHBondContact O-N 3.38Å; R19-E81 IonicContact CZ-OE1 3.26Å; R19-E81 IonicContact CZ-OE2 2.9Å; R19-E81 IonicContact NE-OE2 3.07Å; R19-E81 PolarHBondContact NE-OE2 2.77Å; R19-E81 IonicContact NH1-OE2 3.91Å; R19-E81 PolarHBondContact NH1-OE2 2.91Å; R19-E81 IonicContact NH2-OE1 2.65Å; R19-E81 PolarHBondContact NH2-OE1 3.42Å; R19-E81 IonicContact NH2-OE2 2.66Å; R19-E81 PolarHBondContact NH2-OE2 3.02Å; E81-R85 CarbonylContact C-O 3.56Å; E81-R85 VanDerWaalsContact CA-O 3.26Å; E81-R85 WeakPolarHBondContact CA-O 3.19Å
82	F	78	Confident	81.1	Confident	27 Å²	27	65.4 Å²	65.4	12%	0.118	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	127.7	174	-176.7	-114.4	0	0	0	109.6	V12 H15 V16 G84 R85 Y87 F92 F96	V12-F82 HydrophobicContact CG1-CD2 3.77Å; V12-F82 HydrophobicContact CG1-CE2 3.36Å; V12-F82 HydrophobicContact CG1-CZ 4.31Å; H15-F82 HydrophobicContact CB-CD2 4.19Å; H15-F82 HydrophobicContact CB-CE2 4.16Å; V16-F82 HydrophobicContact CG2-CB 4.05Å; V16-F82 HydrophobicContact CG2-CD2 3.34Å; V16-F82 HydrophobicContact CG2-CE2 4.13Å; V16-F82 HydrophobicContact CG2-CG 4.05Å; F82-G84 PolarHBondContact O-N 2.7Å; F82-R85 PolarHBondContact N-O 3.23Å; F82-R85 WeakPolarHBondContact O-CB 3.31Å; F82-R85 PolarHBondContact O-N 3.4Å; F82-Y87 HydrophobicContact CB-CD2 4.32Å; F82-Y87 HydrophobicContact CB-CE2 4Å; F82-F92 HydrophobicContact CB-CE2 4.18Å; F82-F96 HydrophobicContact CB-CE2 4.5Å; F82-F96 AromaticContact CD1-CD1 3.81Å; F82-F96 HydrophobicContact CD1-CD1 3.81Å; F82-F96 HydrophobicContact CD1-CD2 4.37Å; F82-F96 AromaticContact CD1-CE1 3.39Å; F82-F96 HydrophobicContact CD1-CE1 3.39Å; F82-F96 HydrophobicContact CD1-CE2 4.01Å; F82-F96 HydrophobicContact CD1-CG 4.29Å; F82-F96 AromaticContact CD1-CZ 3.51Å; F82-F96 HydrophobicContact CD1-CZ 3.51Å; F82-F96 AromaticContact CE1-CD1 3.71Å; F82-F96 HydrophobicContact CE1-CD1 3.71Å; F82-F96 AromaticContact CE1-CE1 3.42Å; F82-F96 HydrophobicContact CE1-CE1 3.42Å; F82-F96 VanDerWaalsContact CE1-CE1 3.42Å; F82-F96 HydrophobicContact CE1-CZ 4.03Å; F82-F96 HydrophobicContact CG-CE1 4.48Å; F82-F96 HydrophobicContact CG-CZ 4.45Å; F82-F96 HydrophobicContact CZ-CD1 4.43Å
83	E	79.5	Confident	81.1	Confident	139 Å²	139	61.1 Å²	61.1	65%	0.65	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	40.9	-178.3	-62.1	-178.5	165.6	0	0	113.2	R85	E83-R85 PolarHBondContact O-N 2.69Å
84	G	80.9	Confident	80.5	Confident	66 Å²	66	61.3 Å²	61.3	68%	0.68	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	6.1	-179.1	0	0	0	0	0	115.1	F82	F82-G84 PolarHBondContact O-N 2.7Å
85	R	83	Confident	80	Confident	140 Å²	140	64.5 Å²	64.5	53%	0.528	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	150.3	178.6	-64	175.4	178.9	-175	2.4	111.2	T68 E81 F82 E83 Y87	T68-R85 HydrophobicContact CG2-CB 4.35Å; T68-R85 HydrophobicContact CG2-CG 4.35Å; E81-R85 CarbonylContact C-O 3.56Å; E81-R85 VanDerWaalsContact CA-O 3.26Å; E81-R85 WeakPolarHBondContact CA-O 3.19Å; F82-R85 PolarHBondContact N-O 3.23Å; F82-R85 WeakPolarHBondContact O-CB 3.31Å; F82-R85 PolarHBondContact O-N 3.4Å; E83-R85 PolarHBondContact O-N 2.69Å; R85-Y87 HydrophobicContact CB-CE2 3.61Å; R85-Y87 WeakPolarHBondContact CD-OH 3.32Å
86	R	87.3	Confident	80.9	Confident	24 Å²	24	62.7 Å²	62.7	9%	0.091	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130.2	-175.2	-65.7	166.6	-70.3	176.8	-4.9	110.6	Y60 C67 T68 L74 F79 Y80	Y60-R86 VanDerWaalsContact CD1-NH1 3.27Å; Y60-R86 VanDerWaalsContact CZ-NH1 3.28Å; C67-R86 CarbonylContact C-O 3.47Å; C67-R86 WeakPolarHBondContact CA-O 3.37Å; T68-R86 WeakPolarHBondContact CB-O 3.29Å; T68-R86 PolarHBondContact N-O 2.95Å; T68-R86 PolarHBondContact OG1-N 3.27Å; T68-R86 PolarHBondContact OG1-O 3.22Å; T68-R86 VanDerWaalsContact OG1-O 3.13Å; L74-R86 HydrophobicContact CD1-CB 3.9Å; F79-R86 HydrophobicContact CD2-CB 4.35Å; F79-R86 HydrophobicContact CD2-CG 4.09Å; F79-R86 HydrophobicContact CE2-CG 4.05Å; Y80-R86 CarbonylContact O-C 3.59Å; Y80-R86 WeakPolarHBondContact O-CA 3.33Å
87	Y	85.2	Confident	81.7	Confident	12 Å²	12	58.4 Å²	58.4	5%	0.047	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.4	-177.5	-59	-88.4	0	0	0	110.5	C67 Q69 Y80 F82 R85 D91 F92 L95 F96	C67-Y87 VanDerWaalsContact SG-CA 3.59Å; Q69-Y87 HydrophobicContact CB-CD1 4.16Å; Q69-Y87 HydrophobicContact CB-CE1 4.37Å; Y80-Y87 PolarHBondContact N-O 3.45Å; Y80-Y87 PolarHBondContact O-N 2.56Å; F82-Y87 HydrophobicContact CB-CD2 4.32Å; F82-Y87 HydrophobicContact CB-CE2 4Å; R85-Y87 HydrophobicContact CB-CE2 3.61Å; R85-Y87 WeakPolarHBondContact CD-OH 3.32Å; Y87-D91 HydrophobicContact CD1-CB 4.49Å; Y87-F92 HydrophobicContact CD2-CD2 4.5Å; Y87-L95 HydrophobicContact CD1-CD1 3.93Å; Y87-L95 HydrophobicContact CE1-CD1 3.74Å; Y87-F96 HydrophobicContact CD1-CE2 4.13Å; Y87-F96 AromaticContact CD2-CE2 3.97Å; Y87-F96 HydrophobicContact CD2-CE2 3.97Å; Y87-F96 AromaticContact CE1-CE2 3.91Å; Y87-F96 HydrophobicContact CE1-CE2 3.91Å; Y87-F96 HydrophobicContact CE1-CZ 4.17Å; Y87-F96 AromaticContact CE2-CE2 3.73Å; Y87-F96 HydrophobicContact CE2-CE2 3.73Å; Y87-F96 HydrophobicContact CE2-CZ 4.06Å; Y87-F96 HydrophobicContact CG-CE2 4.16Å; Y87-F96 AromaticContact CZ-CE2 3.7Å; Y87-F96 AromaticContact CZ-CZ 3.74Å
88	C	85.8	Confident	82.4	Confident	28 Å²	28	53.5 Å²	53.5	19%	0.189	27%	0.267	C	S	.	.			trans	-67.8	159.5	163.6	80	0	0	0	0	108.9	C67 L74 Y90 D91 F92	C67-C88 HydrophobicContact CB-CB 4.12Å; C67-C88 PolarHBondContact SG-N 3.46Å; L74-C88 HydrophobicContact CD2-CB 3.86Å; C88-Y90 PolarHBondContact O-N 3.49Å; C88-D91 PolarHBondContact O-N 3.16Å; C88-D91 PolarHBondContact SG-N 2.91Å; C88-D91 PolarHBondContact SG-OD2 2.85Å; C88-F92 WeakPolarHBondContact O-CB 3.49Å; C88-F92 PolarHBondContact O-N 2.84Å
89	K	85.6	Confident	82.5	Confident	100 Å²	100	55.6 Å²	55.6	44%	0.435	28%	0.279	S	S	.	.	H	α-helix	trans	-52.2	-42.7	179.9	-177.8	173.4	-178.4	168.7	0	113	Y80 Q93	Y80-K89 HydrophobicContact CD2-CB 4.35Å; Y80-K89 HydrophobicContact CE2-CB 3.81Å; Y80-K89 HydrophobicContact CE2-CG 3.89Å; K89-Q93 WeakPolarHBondContact O-CB 3.48Å; K89-Q93 VanDerWaalsContact O-CG 3.23Å; K89-Q93 WeakPolarHBondContact O-CG 3.23Å; K89-Q93 PolarHBondContact O-N 3Å
90	Y	84.5	Confident	82.5	Confident	158 Å²	158	55.7 Å²	55.7	62%	0.62	28%	0.28	S	S	*	.	H	α-helix	trans	-66.5	-51.3	-178.6	179	-97	0	0	0	112.2	C88 F92 Q93 V94	C88-Y90 PolarHBondContact O-N 3.49Å; Y90-F92 VanDerWaalsContact C-N 3.3Å; Y90-F92 PolarHBondContact O-N 3.02Å; Y90-Q93 WeakPolarHBondContact O-CB 3.25Å; Y90-Q93 PolarHBondContact O-N 2.93Å; Y90-V94 HydrophobicContact CD1-CG2 4.4Å; Y90-V94 HydrophobicContact CE1-CG2 4.01Å; Y90-V94 HydrophobicContact CE2-CG2 4.22Å; Y90-V94 WeakPolarHBondContact O-CG2 3.46Å; Y90-V94 PolarHBondContact O-N 3.21Å
91	D	83.5	Confident	82.6	Confident	17 Å²	17	59.5 Å²	59.5	9%	0.091	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-39	179.7	-69.3	-36.8	0	0	0	111.4	C67 Q69 C70 Y87 C88 Q93 V94 L95	C67-D91 PolarHBondContact SG-OD2 3.39Å; Q69-D91 HydrophobicContact CB-CB 3.81Å; Q69-D91 HydrophobicContact CG-CB 4Å; C70-D91 VanDerWaalsContact CB-OD2 3.23Å; C70-D91 WeakPolarHBondContact CB-OD2 3.09Å; C70-D91 PolarHBondContact N-OD2 2.89Å; C70-D91 PolarHBondContact SG-OD2 3.19Å; Y87-D91 HydrophobicContact CD1-CB 4.49Å; C88-D91 PolarHBondContact O-N 3.16Å; C88-D91 PolarHBondContact SG-N 2.91Å; C88-D91 PolarHBondContact SG-OD2 2.85Å; D91-Q93 VanDerWaalsContact C-N 3.33Å; D91-Q93 PolarHBondContact O-N 3.32Å; D91-V94 PolarHBondContact O-N 3.45Å; D91-L95 VanDerWaalsContact O-CB 3.28Å; D91-L95 WeakPolarHBondContact O-CB 3.48Å; D91-L95 WeakPolarHBondContact O-CG 3.18Å; D91-L95 PolarHBondContact O-N 3.35Å
92	F	85.1	Confident	82.7	Confident	9 Å²	9	63.3 Å²	63.3	4%	0.039	31%	0.313	C	S	.	.	H	α-helix	trans	-60.6	-44.5	175.4	-178.1	-90.2	0	0	0	111.7	V16 Y80 F82 Y87 C88 Y90 F96 A97 M108	V16-F92 HydrophobicContact CB-CE2 4.41Å; V16-F92 HydrophobicContact CB-CZ 4.24Å; V16-F92 HydrophobicContact CG1-CE1 4.46Å; V16-F92 HydrophobicContact CG1-CE2 3.75Å; V16-F92 HydrophobicContact CG1-CZ 3.57Å; V16-F92 HydrophobicContact CG2-CE2 3.65Å; V16-F92 HydrophobicContact CG2-CZ 3.68Å; Y80-F92 VanDerWaalsContact CB-CD2 3.44Å; Y80-F92 HydrophobicContact CD1-CB 4.33Å; Y80-F92 AromaticContact CD1-CD1 3.39Å; Y80-F92 HydrophobicContact CD1-CD1 3.39Å; Y80-F92 HydrophobicContact CD1-CD2 4.01Å; Y80-F92 AromaticContact CD1-CE1 3.61Å; Y80-F92 HydrophobicContact CD1-CE1 3.61Å; Y80-F92 HydrophobicContact CD1-CE2 4.2Å; Y80-F92 AromaticContact CD1-CG 3.61Å; Y80-F92 HydrophobicContact CD1-CG 3.61Å; Y80-F92 HydrophobicContact CD1-CZ 4.02Å; Y80-F92 HydrophobicContact CD2-CB 4.25Å; Y80-F92 HydrophobicContact CD2-CG 4.38Å; Y80-F92 AromaticContact CE1-CD1 3.84Å; Y80-F92 HydrophobicContact CE1-CD1 3.84Å; Y80-F92 HydrophobicContact CE1-CE1 4.02Å; Y80-F92 HydrophobicContact CE1-CG 4.44Å; Y80-F92 HydrophobicContact CG-CB 3.87Å; Y80-F92 AromaticContact CG-CD1 3.83Å; Y80-F92 HydrophobicContact CG-CD1 3.83Å; Y80-F92 AromaticContact CG-CD2 3.97Å; Y80-F92 HydrophobicContact CG-CD2 3.97Å; Y80-F92 HydrophobicContact CG-CE1 4.43Å; Y80-F92 AromaticContact CG-CG 3.58Å; Y80-F92 HydrophobicContact CG-CG 3.58Å; F82-F92 HydrophobicContact CB-CE2 4.18Å; Y87-F92 HydrophobicContact CD2-CD2 4.5Å; C88-F92 WeakPolarHBondContact O-CB 3.49Å; C88-F92 PolarHBondContact O-N 2.84Å; Y90-F92 VanDerWaalsContact C-N 3.3Å; Y90-F92 PolarHBondContact O-N 3.02Å; F92-F96 AromaticContact CD2-CD2 3.5Å; F92-F96 HydrophobicContact CD2-CD2 3.5Å; F92-F96 HydrophobicContact CD2-CE2 4.18Å; F92-F96 HydrophobicContact CD2-CG 4.4Å; F92-F96 HydrophobicContact CE2-CB 4.13Å; F92-F96 AromaticContact CE2-CD2 3.72Å; F92-F96 HydrophobicContact CE2-CD2 3.72Å; F92-F96 HydrophobicContact CE2-CG 4.22Å; F92-F96 HydrophobicContact CG-CD2 4.14Å; F92-F96 HydrophobicContact CZ-CB 4.12Å; F92-F96 WeakPolarHBondContact O-CB 3.4Å; F92-F96 PolarHBondContact O-N 3.37Å; F92-A97 PolarHBondContact O-N 3.26Å; F92-M108 HydrophobicContact CD1-CE 3.82Å; F92-M108 HydrophobicContact CE1-CE 3.97Å
93	Q	82.9	Confident	83.3	Confident	35 Å²	35	65 Å²	65	16%	0.164	33%	0.327	C	S	.	.	H	α-helix	trans	-57.8	-52.8	176.4	-83.3	171.5	-20.5	0	0	111.7	K89 Y90 D91 L95 A97 F106 M108	K89-Q93 WeakPolarHBondContact O-CB 3.48Å; K89-Q93 VanDerWaalsContact O-CG 3.23Å; K89-Q93 WeakPolarHBondContact O-CG 3.23Å; K89-Q93 PolarHBondContact O-N 3Å; Y90-Q93 WeakPolarHBondContact O-CB 3.25Å; Y90-Q93 PolarHBondContact O-N 2.93Å; D91-Q93 VanDerWaalsContact C-N 3.33Å; D91-Q93 PolarHBondContact O-N 3.32Å; Q93-L95 VanDerWaalsContact C-N 3.33Å; Q93-L95 PolarHBondContact O-N 3.4Å; Q93-A97 HydrophobicContact CB-CB 4.44Å; Q93-A97 HydrophobicContact CG-CB 4.46Å; Q93-A97 VanDerWaalsContact O-CB 3.29Å; Q93-A97 WeakPolarHBondContact O-CB 3.14Å; Q93-A97 PolarHBondContact O-N 2.91Å; Q93-F106 HydrophobicContact CB-CB 4.42Å; Q93-F106 HydrophobicContact CB-CD1 4.22Å; Q93-F106 HydrophobicContact CB-CD2 3.85Å; Q93-F106 HydrophobicContact CB-CE1 4.46Å; Q93-F106 HydrophobicContact CB-CE2 4.11Å; Q93-F106 HydrophobicContact CB-CG 3.91Å; Q93-F106 HydrophobicContact CB-CZ 4.41Å; Q93-F106 HydrophobicContact CG-CB 4.22Å; Q93-F106 HydrophobicContact CG-CD2 4.28Å; Q93-F106 HydrophobicContact CG-CG 4.24Å; Q93-F106 VanDerWaalsContact O-CD1 3.32Å; Q93-F106 WeakPolarHBondContact O-CD1 3.14Å; Q93-F106 WeakPolarHBondContact O-CE1 3.18Å; Q93-M108 HydrophobicContact CG-CE 3.99Å; Q93-M108 HydrophobicContact CG-CG 4.21Å; Q93-M108 HydrophobicContact CG-SD 3.33Å; Q93-M108 WeakPolarHBondContact CG-SD 3.4Å
94	V	73.6	Confident	83.6	Confident	75 Å²	75	60.5 Å²	60.5	46%	0.455	32%	0.319	S	S	.	.	H	α-helix	trans	-63.6	-39.8	-176.5	173.3	0	0	0	0	111.8	Y90 D91 F106	Y90-V94 HydrophobicContact CD1-CG2 4.4Å; Y90-V94 HydrophobicContact CE1-CG2 4.01Å; Y90-V94 HydrophobicContact CE2-CG2 4.22Å; Y90-V94 WeakPolarHBondContact O-CG2 3.46Å; Y90-V94 PolarHBondContact O-N 3.21Å; D91-V94 PolarHBondContact O-N 3.45Å; V94-F106 HydrophobicContact CG2-CE2 4.45Å; V94-F106 HydrophobicContact CG2-CZ 3.96Å
95	L	74.4	Confident	83.8	Confident	77 Å²	77	63.3 Å²	63.3	40%	0.403	31%	0.314	S	S	.	.	H	α-helix	trans	-81.8	-36.6	-175.3	-67.3	172.7	0	0	0	113.3	Q69 Y87 D91 Q93	Q69-L95 HydrophobicContact CB-CD1 4.24Å; Q69-L95 HydrophobicContact CG-CD1 4.03Å; Y87-L95 HydrophobicContact CD1-CD1 3.93Å; Y87-L95 HydrophobicContact CE1-CD1 3.74Å; D91-L95 VanDerWaalsContact O-CB 3.28Å; D91-L95 WeakPolarHBondContact O-CB 3.48Å; D91-L95 WeakPolarHBondContact O-CG 3.18Å; D91-L95 PolarHBondContact O-N 3.35Å; Q93-L95 VanDerWaalsContact C-N 3.33Å; Q93-L95 PolarHBondContact O-N 3.4Å
96	F	80	Confident	83.9	Confident	60 Å²	60	59.3 Å²	59.3	26%	0.263	30%	0.301	S	S	.	.	H	α-helix	trans	-128.1	-24.2	-165.1	-50.9	-66.3	0	0	0	114.8	F82 Y87 F92	F82-F96 HydrophobicContact CB-CE2 4.5Å; F82-F96 AromaticContact CD1-CD1 3.81Å; F82-F96 HydrophobicContact CD1-CD1 3.81Å; F82-F96 HydrophobicContact CD1-CD2 4.37Å; F82-F96 AromaticContact CD1-CE1 3.39Å; F82-F96 HydrophobicContact CD1-CE1 3.39Å; F82-F96 HydrophobicContact CD1-CE2 4.01Å; F82-F96 HydrophobicContact CD1-CG 4.29Å; F82-F96 AromaticContact CD1-CZ 3.51Å; F82-F96 HydrophobicContact CD1-CZ 3.51Å; F82-F96 AromaticContact CE1-CD1 3.71Å; F82-F96 HydrophobicContact CE1-CD1 3.71Å; F82-F96 AromaticContact CE1-CE1 3.42Å; F82-F96 HydrophobicContact CE1-CE1 3.42Å; F82-F96 VanDerWaalsContact CE1-CE1 3.42Å; F82-F96 HydrophobicContact CE1-CZ 4.03Å; F82-F96 HydrophobicContact CG-CE1 4.48Å; F82-F96 HydrophobicContact CG-CZ 4.45Å; F82-F96 HydrophobicContact CZ-CD1 4.43Å; Y87-F96 HydrophobicContact CD1-CE2 4.13Å; Y87-F96 AromaticContact CD2-CE2 3.97Å; Y87-F96 HydrophobicContact CD2-CE2 3.97Å; Y87-F96 AromaticContact CE1-CE2 3.91Å; Y87-F96 HydrophobicContact CE1-CE2 3.91Å; Y87-F96 HydrophobicContact CE1-CZ 4.17Å; Y87-F96 AromaticContact CE2-CE2 3.73Å; Y87-F96 HydrophobicContact CE2-CE2 3.73Å; Y87-F96 HydrophobicContact CE2-CZ 4.06Å; Y87-F96 HydrophobicContact CG-CE2 4.16Å; Y87-F96 AromaticContact CZ-CE2 3.7Å; Y87-F96 AromaticContact CZ-CZ 3.74Å; F92-F96 AromaticContact CD2-CD2 3.5Å; F92-F96 HydrophobicContact CD2-CD2 3.5Å; F92-F96 HydrophobicContact CD2-CE2 4.18Å; F92-F96 HydrophobicContact CD2-CG 4.4Å; F92-F96 HydrophobicContact CE2-CB 4.13Å; F92-F96 AromaticContact CE2-CD2 3.72Å; F92-F96 HydrophobicContact CE2-CD2 3.72Å; F92-F96 HydrophobicContact CE2-CG 4.22Å; F92-F96 HydrophobicContact CG-CD2 4.14Å; F92-F96 HydrophobicContact CZ-CB 4.12Å; F92-F96 WeakPolarHBondContact O-CB 3.4Å; F92-F96 PolarHBondContact O-N 3.37Å
97	A	77.6	Confident	83.7	Confident	13 Å²	13	58.2 Å²	58.2	11%	0.107	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-79.5	131.6	-175.9	0	0	0	0	0	111.3	F92 Q93 F106 M108	F92-A97 PolarHBondContact O-N 3.26Å; Q93-A97 HydrophobicContact CB-CB 4.44Å; Q93-A97 HydrophobicContact CG-CB 4.46Å; Q93-A97 VanDerWaalsContact O-CB 3.29Å; Q93-A97 WeakPolarHBondContact O-CB 3.14Å; Q93-A97 PolarHBondContact O-N 2.91Å; A97-F106 HydrophobicContact CB-CB 4.02Å; A97-F106 HydrophobicContact CB-CD1 3.91Å; A97-F106 HydrophobicContact CB-CG 4.31Å; A97-M108 HydrophobicContact CB-SD 3.71Å
98	P	82.1	Confident	83.5	Confident	34 Å²	34	60.2 Å²	60.2	22%	0.221	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-72.5	142.7	176.6	27.5	-30.3	0	0	0	110.9	I107 V111	P98-I107 HydrophobicContact CG-CB 4.23Å; P98-I107 HydrophobicContact CG-CD1 4.36Å; P98-I107 WeakPolarHBondContact O-CG1 3.5Å; P98-I107 PolarHBondContact O-N 3Å; P98-V111 HydrophobicContact CG-CG1 4.28Å; P98-V111 HydrophobicContact CG-CG2 3.76Å
99	L	83.3	Confident	83.2	Confident	101 Å²	101	61.6 Å²	61.6	53%	0.529	32%	0.317	S	S	.	.	B	Isolated β-bridge	trans	-78.7	137.7	172.6	-64.7	167.5	0	0	0	111	G104 F106	L99-G104 VanDerWaalsContact CD2-O 3.31Å; L99-G104 WeakPolarHBondContact CD2-O 3.4Å; L99-F106 HydrophobicContact CD2-CD1 3.59Å; L99-F106 HydrophobicContact CD2-CE1 3.58Å; L99-F106 HydrophobicContact CD2-CG 4.13Å; L99-F106 HydrophobicContact CD2-CZ 4.11Å; L99-F106 HydrophobicContact CG-CD1 4.35Å; L99-F106 HydrophobicContact CG-CE1 4.29Å
100	C	87.9	Confident	83.2	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.014	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-74	129	171.8	177	0	0	0	0	111.1	K102 C103 G104 E105 I107 S118 H120 C123	C100-K102 VanDerWaalsContact C-N 3.25Å; C100-K102 PolarHBondContact O-N 3.18Å; C100-K102 PolarHBondContact SG-N 2.82Å; C100-K102 VanDerWaalsContact SG-N 3.37Å; C100-C103 VanDerWaalsContact CB-SG 3.52Å; C100-C103 VanDerWaalsContact SG-SG 3.7Å; C100-G104 VanDerWaalsContact O-CA 3.25Å; C100-G104 WeakPolarHBondContact O-CA 2.97Å; C100-G104 PolarHBondContact O-N 2.9Å; C100-E105 WeakPolarHBondContact CB-O 2.94Å; C100-E105 PolarHBondContact N-O 2.8Å; C100-I107 HydrophobicContact CB-CD1 3.99Å; C100-I107 HydrophobicContact CB-CG1 3.84Å; C100-S118 WeakPolarHBondContact CA-O 3.43Å; C100-H120 WeakPolarHBondContact CB-CE1 3.46Å; C100-H120 WeakPolarHBondContact CB-ND1 3.41Å; C100-H120 PolarHBondContact SG-N 3.47Å; C100-H120 PolarHBondContact SG-ND1 2.96Å; C100-H120 VanDerWaalsContact SG-ND1 3.4Å; C100-C123 VanDerWaalsContact SG-CB 3.55Å
101	F	88.4	Confident	83.1	Confident	93 Å²	93	53.6 Å²	53.6	41%	0.408	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-24.7	179.5	-172	-96.6	0	0	0	114.4	R117 S118 W119	F101-R117 HydrophobicContact CB-CB 3.96Å; F101-R117 HydrophobicContact CB-CG 4.36Å; F101-R117 HydrophobicContact CD2-CB 4.24Å; F101-R117 VanDerWaalsContact CD2-CD 3.49Å; F101-R117 HydrophobicContact CD2-CG 3.71Å; F101-R117 HydrophobicContact CE2-CG 4.13Å; F101-R117 VanDerWaalsContact CE2-CZ 3.48Å; F101-R117 HydrophobicContact CG-CB 4.13Å; F101-R117 HydrophobicContact CG-CG 3.99Å; F101-S118 PolarHBondContact N-O 2.92Å; F101-W119 HydrophobicContact CB-CD2 4.14Å; F101-W119 HydrophobicContact CB-CE3 4.23Å; F101-W119 HydrophobicContact CB-CH2 4.12Å; F101-W119 HydrophobicContact CB-CZ2 3.95Å; F101-W119 HydrophobicContact CB-CZ3 4.23Å; F101-W119 AromaticContact CD1-CH2 3.22Å; F101-W119 HydrophobicContact CD1-CH2 3.22Å; F101-W119 AromaticContact CD1-CZ2 3.51Å; F101-W119 HydrophobicContact CD1-CZ2 3.51Å; F101-W119 AromaticContact CD1-CZ3 3.85Å; F101-W119 HydrophobicContact CD1-CZ3 3.85Å; F101-W119 AromaticContact CE1-CH2 3.98Å; F101-W119 HydrophobicContact CE1-CH2 3.98Å; F101-W119 HydrophobicContact CE1-CZ2 4.3Å; F101-W119 HydrophobicContact CG-CH2 4.06Å; F101-W119 AromaticContact CG-CZ2 3.99Å; F101-W119 HydrophobicContact CG-CZ2 3.99Å
102	K	88	Confident	83.3	Confident	120 Å²	120	52.8 Å²	52.8	52%	0.522	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-54.6	-179.8	-176.5	170.2	173.9	-107.3	0	113	C100 W119 C123 V125	C100-K102 VanDerWaalsContact C-N 3.25Å; C100-K102 PolarHBondContact O-N 3.18Å; C100-K102 PolarHBondContact SG-N 2.82Å; C100-K102 VanDerWaalsContact SG-N 3.37Å; K102-W119 HydrophobicContact CB-CE3 4Å; K102-W119 HydrophobicContact CB-CZ3 3.91Å; K102-C123 HydrophobicContact CB-CB 3.82Å; K102-C123 HydrophobicContact CD-CB 3.94Å; K102-C123 WeakPolarHBondContact CD-O 3.33Å; K102-C123 HydrophobicContact CG-CB 4.38Å; K102-V125 HydrophobicContact CD-CG2 4.15Å
103	C	90.3	Very high	83.3	Confident	61 Å²	61	56.1 Å²	56.1	41%	0.412	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-15.2	-173.8	61.2	0	0	0	0	113.7	C100 E105 H120	C100-C103 VanDerWaalsContact CB-SG 3.52Å; C100-C103 VanDerWaalsContact SG-SG 3.7Å; C103-E105 HydrophobicContact CB-CG 4.47Å; C103-E105 PolarHBondContact O-N 3.31Å; C103-H120 PolarHBondContact SG-CE1 3.33Å; C103-H120 PolarHBondContact SG-ND1 2.76Å
104	G	85.9	Confident	83.3	Confident	46 Å²	46	54.8 Å²	54.8	47%	0.474	29%	0.29	S	S	.	.			trans	79.5	-2.7	-176.3	0	0	0	0	0	114.6	L99 C100	L99-G104 VanDerWaalsContact CD2-O 3.31Å; L99-G104 WeakPolarHBondContact CD2-O 3.4Å; C100-G104 VanDerWaalsContact O-CA 3.25Å; C100-G104 WeakPolarHBondContact O-CA 2.97Å; C100-G104 PolarHBondContact O-N 2.9Å
105	E	85.6	Confident	83.5	Confident	125 Å²	125	53.7 Å²	53.7	58%	0.584	28%	0.281	S	S	*	.			trans	-85.5	155.6	-178	-63.1	-60.9	150.7	0	0	112.9	C100 C103	C100-E105 WeakPolarHBondContact CB-O 2.94Å; C100-E105 PolarHBondContact N-O 2.8Å; C103-E105 HydrophobicContact CB-CG 4.47Å; C103-E105 PolarHBondContact O-N 3.31Å
106	F	83.9	Confident	83.7	Confident	56 Å²	56	58.3 Å²	58.3	25%	0.246	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-63.6	137.2	175	-64	-72.4	0	0	0	111.9	Q93 V94 A97 L99 H120	Q93-F106 HydrophobicContact CB-CB 4.42Å; Q93-F106 HydrophobicContact CB-CD1 4.22Å; Q93-F106 HydrophobicContact CB-CD2 3.85Å; Q93-F106 HydrophobicContact CB-CE1 4.46Å; Q93-F106 HydrophobicContact CB-CE2 4.11Å; Q93-F106 HydrophobicContact CB-CG 3.91Å; Q93-F106 HydrophobicContact CB-CZ 4.41Å; Q93-F106 HydrophobicContact CG-CB 4.22Å; Q93-F106 HydrophobicContact CG-CD2 4.28Å; Q93-F106 HydrophobicContact CG-CG 4.24Å; Q93-F106 VanDerWaalsContact O-CD1 3.32Å; Q93-F106 WeakPolarHBondContact O-CD1 3.14Å; Q93-F106 WeakPolarHBondContact O-CE1 3.18Å; V94-F106 HydrophobicContact CG2-CE2 4.45Å; V94-F106 HydrophobicContact CG2-CZ 3.96Å; A97-F106 HydrophobicContact CB-CB 4.02Å; A97-F106 HydrophobicContact CB-CD1 3.91Å; A97-F106 HydrophobicContact CB-CG 4.31Å; L99-F106 HydrophobicContact CD2-CD1 3.59Å; L99-F106 HydrophobicContact CD2-CE1 3.58Å; L99-F106 HydrophobicContact CD2-CG 4.13Å; L99-F106 HydrophobicContact CD2-CZ 4.11Å; L99-F106 HydrophobicContact CG-CD1 4.35Å; L99-F106 HydrophobicContact CG-CE1 4.29Å; F106-H120 PolarHBondContact O-NE2 3.01Å
107	I	85.2	Confident	84.1	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.318	C	S	.	.			trans	-95.4	100	176	-50.6	161.4	0	0	0	109	P98 C100 S109 V111 W119	P98-I107 HydrophobicContact CG-CB 4.23Å; P98-I107 HydrophobicContact CG-CD1 4.36Å; P98-I107 WeakPolarHBondContact O-CG1 3.5Å; P98-I107 PolarHBondContact O-N 3Å; C100-I107 HydrophobicContact CB-CD1 3.99Å; C100-I107 HydrophobicContact CB-CG1 3.84Å; I107-S109 WeakPolarHBondContact CG2-O 3.27Å; I107-V111 HydrophobicContact CB-CG2 4.06Å; I107-V111 HydrophobicContact CD1-CG1 4.21Å; I107-V111 HydrophobicContact CG2-CB 4.36Å; I107-V111 HydrophobicContact CG2-CG2 3.58Å; I107-W119 VanDerWaalsContact CD1-C 3.44Å
108	M	79.5	Confident	84.6	Confident	54 Å²	54	62.1 Å²	62.1	27%	0.266	32%	0.318	S	S	.	.			trans	-91.9	-10.8	178.1	-63	-54.3	-68.6	0	0	113.9	L11 Y80 F92 Q93 A97	L11-M108 WeakPolarHBondContact CD2-O 3.33Å; Y80-M108 HydrophobicContact CD1-CE 4.31Å; Y80-M108 HydrophobicContact CE1-CE 3.36Å; Y80-M108 WeakPolarHBondContact OH-CE 3.4Å; F92-M108 HydrophobicContact CD1-CE 3.82Å; F92-M108 HydrophobicContact CE1-CE 3.97Å; Q93-M108 HydrophobicContact CG-CE 3.99Å; Q93-M108 HydrophobicContact CG-CG 4.21Å; Q93-M108 HydrophobicContact CG-SD 3.33Å; Q93-M108 WeakPolarHBondContact CG-SD 3.4Å; A97-M108 HydrophobicContact CB-SD 3.71Å
109	S	80.4	Confident	85	Confident	58 Å²	58	61.2 Å²	61.2	41%	0.406	31%	0.311	S	S	.	.	S	Bend	trans	-115.2	-161.8	-179.7	75	0	0	0	0	109.5	L11 I107 V111	L11-S109 WeakPolarHBondContact CD1-O 3.39Å; L11-S109 WeakPolarHBondContact CD2-O 3.45Å; L11-S109 WeakPolarHBondContact CG-O 3.02Å; I107-S109 WeakPolarHBondContact CG2-O 3.27Å; S109-V111 PolarHBondContact O-N 3.27Å
110	K	84.1	Confident	85.3	Confident	89 Å²	89	57.3 Å²	57.3	39%	0.387	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-47.8	124.4	-177.2	-167.8	-174.2	-141.1	-171.7	0	111.6	N7 P121	N7-K110 WeakPolarHBondContact ND2-CE 3.27Å; N7-K110 PolarHBondContact ND2-NZ 3.16Å; N7-K110 WeakPolarHBondContact OD1-CD 3Å; N7-K110 WeakPolarHBondContact OD1-CE 3.32Å; N7-K110 WeakPolarHBondContact OD1-CG 3.38Å; K110-P121 HydrophobicContact CB-CG 3.99Å; K110-P121 HydrophobicContact CD-CG 4.24Å; K110-P121 HydrophobicContact CG-CG 4.38Å; K110-P121 WeakPolarHBondContact O-CD 3.19Å; K110-P121 WeakPolarHBondContact O-CG 3.33Å
111	V	84.3	Confident	85.4	Confident	1 Å²	1	58 Å²	58	1%	0.006	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	125.7	178.3	-179.4	0	0	0	0	109.7	L11 P98 I107 S109 K113	L11-V111 HydrophobicContact CD2-CG2 4.28Å; L11-V111 HydrophobicContact CG-CG2 4.34Å; P98-V111 HydrophobicContact CG-CG1 4.28Å; P98-V111 HydrophobicContact CG-CG2 3.76Å; I107-V111 HydrophobicContact CB-CG2 4.06Å; I107-V111 HydrophobicContact CD1-CG1 4.21Å; I107-V111 HydrophobicContact CG2-CB 4.36Å; I107-V111 HydrophobicContact CG2-CG2 3.58Å; S109-V111 PolarHBondContact O-N 3.27Å; V111-K113 HydrophobicContact CG1-CD 4.16Å; V111-K113 HydrophobicContact CG1-CG 4.48Å
112	V	86.9	Confident	85.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	125.7	169.2	-173.5	0	0	0	0	109.2	A5 W119 P121 L124 I134	A5-V112 HydrophobicContact CB-CG1 3.77Å; V112-W119 HydrophobicContact CB-CB 4.45Å; V112-W119 PolarHBondContact N-O 3.11Å; V112-W119 PolarHBondContact O-N 3.28Å; V112-P121 HydrophobicContact CG2-CB 4.3Å; V112-P121 HydrophobicContact CG2-CG 4.12Å; V112-L124 HydrophobicContact CG1-CD2 3.62Å; V112-I134 HydrophobicContact CG2-CG2 4.15Å
113	K	84.9	Confident	85.7	Confident	79 Å²	79	53.3 Å²	53.3	34%	0.343	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	115.4	174.9	-64.6	-68.2	-174.6	176.5	0	109	R6 V111 S118	R6-K113 PolarHBondContact N-O 3.34Å; R6-K113 PolarHBondContact O-N 3.2Å; V111-K113 HydrophobicContact CG1-CD 4.16Å; V111-K113 HydrophobicContact CG1-CG 4.48Å; K113-S118 PolarHBondContact NZ-OG 2.94Å
114	A	82.2	Confident	85.7	Confident	6 Å²	6	50.4 Å²	50.4	5%	0.05	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	138.9	178.1	0	0	0	0	0	109.4	N116 R117 W119 L124 F138	A114-N116 VanDerWaalsContact C-N 3.29Å; A114-N116 PolarHBondContact O-N 2.94Å; A114-R117 PolarHBondContact N-O 3Å; A114-R117 VanDerWaalsContact N-O 3.11Å; A114-R117 PolarHBondContact O-N 3.31Å; A114-R117 VanDerWaalsContact O-O 3.09Å; A114-W119 PolarHBondContact O-NE1 3.31Å; A114-L124 HydrophobicContact CB-CD1 4Å; A114-L124 HydrophobicContact CB-CD2 4.16Å; A114-F138 HydrophobicContact CB-CE1 4.02Å; A114-F138 HydrophobicContact CB-CZ 3.86Å
115	M	77.9	Confident	85.9	Confident	52 Å²	52	49.3 Å²	49.3	26%	0.256	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	38.1	179.4	-63	178	43.3	0	0	114.5	R117 F138 R140 I145	M115-R117 PolarHBondContact O-N 2.95Å; M115-R117 VanDerWaalsContact O-N 3.13Å; M115-F138 HydrophobicContact CG-CE2 3.91Å; M115-F138 HydrophobicContact CG-CZ 4.19Å; M115-F138 HydrophobicContact SD-CE2 4.09Å; M115-R140 HydrophobicContact CE-CG 3.85Å; M115-R140 HydrophobicContact SD-CB 4.38Å; M115-R140 HydrophobicContact SD-CG 3.81Å; M115-I145 HydrophobicContact SD-CD1 3.8Å; M115-I145 HydrophobicContact SD-CG1 3.57Å; M115-I145 VanDerWaalsContact SD-CG1 3.57Å
116	N	80.2	Confident	86.2	Confident	174 Å²	174	43.5 Å²	43.5	93%	0.93	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.9	24.2	-173.7	-62.4	-12.7	0	0	0	114	A114	A114-N116 VanDerWaalsContact C-N 3.29Å; A114-N116 PolarHBondContact O-N 2.94Å
117	R	87.4	Confident	86.5	Confident	136 Å²	136	45.2 Å²	45.2	51%	0.513	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	161.1	176.3	-58.8	-67.2	-174.3	159.5	-0.4	110.4	F101 A114 M115 W119	F101-R117 HydrophobicContact CB-CB 3.96Å; F101-R117 HydrophobicContact CB-CG 4.36Å; F101-R117 HydrophobicContact CD2-CB 4.24Å; F101-R117 VanDerWaalsContact CD2-CD 3.49Å; F101-R117 HydrophobicContact CD2-CG 3.71Å; F101-R117 HydrophobicContact CE2-CG 4.13Å; F101-R117 VanDerWaalsContact CE2-CZ 3.48Å; F101-R117 HydrophobicContact CG-CB 4.13Å; F101-R117 HydrophobicContact CG-CG 3.99Å; A114-R117 PolarHBondContact N-O 3Å; A114-R117 VanDerWaalsContact N-O 3.11Å; A114-R117 PolarHBondContact O-N 3.31Å; A114-R117 VanDerWaalsContact O-O 3.09Å; M115-R117 PolarHBondContact O-N 2.95Å; M115-R117 VanDerWaalsContact O-N 3.13Å; R117-W119 HydrophobicContact CB-CZ2 4.31Å
118	S	87.7	Confident	86.6	Confident	17 Å²	17	49.6 Å²	49.6	12%	0.119	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	141.6	175.8	-48.9	0	0	0	0	110	C100 F101 K113	C100-S118 WeakPolarHBondContact CA-O 3.43Å; F101-S118 PolarHBondContact N-O 2.92Å; K113-S118 PolarHBondContact NZ-OG 2.94Å
119	W	90.3	Very high	87.1	Confident	15 Å²	15	50.5 Å²	50.5	6%	0.057	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	144.3	-176.4	-52.3	78	0	0	0	110.5	F101 K102 I107 V112 A114 R117 L124 I145	F101-W119 HydrophobicContact CB-CD2 4.14Å; F101-W119 HydrophobicContact CB-CE3 4.23Å; F101-W119 HydrophobicContact CB-CH2 4.12Å; F101-W119 HydrophobicContact CB-CZ2 3.95Å; F101-W119 HydrophobicContact CB-CZ3 4.23Å; F101-W119 AromaticContact CD1-CH2 3.22Å; F101-W119 HydrophobicContact CD1-CH2 3.22Å; F101-W119 AromaticContact CD1-CZ2 3.51Å; F101-W119 HydrophobicContact CD1-CZ2 3.51Å; F101-W119 AromaticContact CD1-CZ3 3.85Å; F101-W119 HydrophobicContact CD1-CZ3 3.85Å; F101-W119 AromaticContact CE1-CH2 3.98Å; F101-W119 HydrophobicContact CE1-CH2 3.98Å; F101-W119 HydrophobicContact CE1-CZ2 4.3Å; F101-W119 HydrophobicContact CG-CH2 4.06Å; F101-W119 AromaticContact CG-CZ2 3.99Å; F101-W119 HydrophobicContact CG-CZ2 3.99Å; K102-W119 HydrophobicContact CB-CE3 4Å; K102-W119 HydrophobicContact CB-CZ3 3.91Å; I107-W119 VanDerWaalsContact CD1-C 3.44Å; V112-W119 HydrophobicContact CB-CB 4.45Å; V112-W119 PolarHBondContact N-O 3.11Å; V112-W119 PolarHBondContact O-N 3.28Å; A114-W119 PolarHBondContact O-NE1 3.31Å; R117-W119 HydrophobicContact CB-CZ2 4.31Å; W119-L124 HydrophobicContact CB-CB 4.31Å; W119-L124 HydrophobicContact CD2-CD1 3.83Å; W119-L124 HydrophobicContact CE3-CD1 4.15Å; W119-L124 HydrophobicContact CG-CD1 3.99Å; W119-I145 HydrophobicContact CH2-CD1 3.59Å; W119-I145 HydrophobicContact CZ2-CD1 3.64Å; W119-I145 HydrophobicContact CZ3-CD1 4.27Å
120	H	89.7	Confident	87.6	Confident	20 Å²	20	49.8 Å²	49.8	9%	0.093	26%	0.259	C	S	.	.			trans	-62.8	146.2	157.1	-58.1	97.8	0	0	0	109.2	C100 C103 F106 E122 C123 L124	C100-H120 WeakPolarHBondContact CB-CE1 3.46Å; C100-H120 WeakPolarHBondContact CB-ND1 3.41Å; C100-H120 PolarHBondContact SG-N 3.47Å; C100-H120 PolarHBondContact SG-ND1 2.96Å; C100-H120 VanDerWaalsContact SG-ND1 3.4Å; C103-H120 PolarHBondContact SG-CE1 3.33Å; C103-H120 PolarHBondContact SG-ND1 2.76Å; F106-H120 PolarHBondContact O-NE2 3.01Å; H120-E122 VanDerWaalsContact C-N 3.28Å; H120-E122 HydrophobicContact CB-CG 4.13Å; H120-E122 WeakPolarHBondContact CB-OE1 3.01Å; H120-E122 IonicContact CD2-OE1 3.59Å; H120-E122 IonicContact CG-OE1 3.59Å; H120-E122 PolarHBondContact O-N 2.87Å; H120-C123 HydrophobicContact CB-CB 3.86Å; H120-C123 WeakPolarHBondContact O-CA 2.95Å; H120-C123 WeakPolarHBondContact O-CB 3.18Å; H120-C123 PolarHBondContact O-N 3.34Å; H120-L124 PolarHBondContact O-N 2.66Å
121	P	89.7	Confident	87.8	Confident	17 Å²	17	48.6 Å²	48.6	11%	0.11	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-48.4	-50.6	175.1	-29.5	37.3	0	0	0	112.2	K110 V112 C123 L124 I134	K110-P121 HydrophobicContact CB-CG 3.99Å; K110-P121 HydrophobicContact CD-CG 4.24Å; K110-P121 HydrophobicContact CG-CG 4.38Å; K110-P121 WeakPolarHBondContact O-CD 3.19Å; K110-P121 WeakPolarHBondContact O-CG 3.33Å; V112-P121 HydrophobicContact CG2-CB 4.3Å; V112-P121 HydrophobicContact CG2-CG 4.12Å; P121-C123 PolarHBondContact O-N 2.91Å; P121-L124 PolarHBondContact O-N 2.85Å; P121-I134 HydrophobicContact CB-CD1 3.52Å; P121-I134 WeakPolarHBondContact O-CD1 3.43Å; P121-I134 WeakPolarHBondContact O-CG1 3.3Å
122	E	91.2	Very high	88.1	Confident	100 Å²	100	53.5 Å²	53.5	47%	0.467	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-69.2	-18.5	178.4	60.8	-86	-165.7	0	0	113.9	H120 V125	H120-E122 VanDerWaalsContact C-N 3.28Å; H120-E122 HydrophobicContact CB-CG 4.13Å; H120-E122 WeakPolarHBondContact CB-OE1 3.01Å; H120-E122 IonicContact CD2-OE1 3.59Å; H120-E122 IonicContact CG-OE1 3.59Å; H120-E122 PolarHBondContact O-N 2.87Å; E122-V125 VanDerWaalsContact O-CG1 3.3Å; E122-V125 WeakPolarHBondContact O-CG1 3.44Å
123	C	91.5	Very high	88	Confident	13 Å²	13	53.5 Å²	53.5	9%	0.088	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-86.1	-18.6	176.6	-81.4	0	0	0	0	112.9	C100 K102 H120 P121 V125	C100-C123 VanDerWaalsContact SG-CB 3.55Å; K102-C123 HydrophobicContact CB-CB 3.82Å; K102-C123 HydrophobicContact CD-CB 3.94Å; K102-C123 WeakPolarHBondContact CD-O 3.33Å; K102-C123 HydrophobicContact CG-CB 4.38Å; H120-C123 HydrophobicContact CB-CB 3.86Å; H120-C123 WeakPolarHBondContact O-CA 2.95Å; H120-C123 WeakPolarHBondContact O-CB 3.18Å; H120-C123 PolarHBondContact O-N 3.34Å; P121-C123 PolarHBondContact O-N 2.91Å; C123-V125 VanDerWaalsContact C-N 3.31Å; C123-V125 PolarHBondContact O-N 3.13Å
124	L	90.3	Very high	87.8	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.271	C	S	.	.			trans	-82.9	79	177.4	-168.3	69.2	0	0	0	110.7	A5 V112 A114 W119 H120 P121 I133 I145	A5-L124 HydrophobicContact CB-CD2 3.54Å; V112-L124 HydrophobicContact CG1-CD2 3.62Å; A114-L124 HydrophobicContact CB-CD1 4Å; A114-L124 HydrophobicContact CB-CD2 4.16Å; W119-L124 HydrophobicContact CB-CB 4.31Å; W119-L124 HydrophobicContact CD2-CD1 3.83Å; W119-L124 HydrophobicContact CE3-CD1 4.15Å; W119-L124 HydrophobicContact CG-CD1 3.99Å; H120-L124 PolarHBondContact O-N 2.66Å; P121-L124 PolarHBondContact O-N 2.85Å; L124-I133 PolarHBondContact O-N 3.31Å; L124-I145 HydrophobicContact CD1-CD1 3.52Å
125	V	91.5	Very high	87.3	Confident	24 Å²	24	56.4 Å²	56.4	15%	0.145	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-114.7	156.3	-175	-64.5	0	0	0	0	112.9	K102 E122 C123 N127 G130 I131 Q132	K102-V125 HydrophobicContact CD-CG2 4.15Å; E122-V125 VanDerWaalsContact O-CG1 3.3Å; E122-V125 WeakPolarHBondContact O-CG1 3.44Å; C123-V125 VanDerWaalsContact C-N 3.31Å; C123-V125 PolarHBondContact O-N 3.13Å; V125-N127 PolarHBondContact O-N 3.24Å; V125-G130 WeakPolarHBondContact CB-O 3.28Å; V125-G130 WeakPolarHBondContact CG1-O 3.39Å; V125-I131 CarbonylContact C-O 3.34Å; V125-I131 VanDerWaalsContact CA-O 3.23Å; V125-I131 WeakPolarHBondContact CA-O 3.24Å; V125-Q132 HydrophobicContact CG1-CG 4.05Å
126	C	90.8	Very high	86.9	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.014	32%	0.315	C	S	.	.			trans	-63.8	129	170.1	-174.1	0	0	0	0	109.8	E128 C129 G130 I131 I133 I145 C147	C126-E128 PolarHBondContact O-N 3.01Å; C126-C129 WeakPolarHBondContact CB-SG 3.27Å; C126-G130 WeakPolarHBondContact O-CA 3.49Å; C126-G130 PolarHBondContact O-N 3.12Å; C126-I131 HydrophobicContact CB-CG2 3.97Å; C126-I131 PolarHBondContact N-O 2.9Å; C126-I133 HydrophobicContact CB-CD1 3.7Å; C126-I133 HydrophobicContact CB-CG1 4.18Å; C126-I145 CarbonylContact C-O 3.59Å; C126-I145 WeakPolarHBondContact CA-O 3.41Å; C126-C147 HydrophobicContact CB-CB 4.08Å; C126-C147 PolarHBondContact SG-N 2.78Å
127	N	89.9	Confident	86.6	Confident	92 Å²	92	50.8 Å²	50.8	49%	0.492	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-14.9	177.4	-76.9	107.1	0	0	0	114.1	V125 R144 I145	V125-N127 PolarHBondContact O-N 3.24Å; N127-R144 HydrophobicContact CB-CB 4.16Å; N127-R144 HydrophobicContact CB-CG 4.41Å; N127-R144 WeakPolarHBondContact OD1-CA 3.35Å; N127-I145 PolarHBondContact N-O 3.32Å; N127-I145 PolarHBondContact OD1-N 3.49Å; N127-I145 PolarHBondContact OD1-O 3.12Å
128	E	87.9	Confident	86.4	Confident	93 Å²	93	44.4 Å²	44.4	44%	0.435	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-48.7	-178.9	-58.1	-61.9	147.8	0	0	112.3	C126 R144 L146 C150 I154	C126-E128 PolarHBondContact O-N 3.01Å; E128-R144 IonicContact OE1-NH1 3.27Å; E128-R144 PolarHBondContact OE1-NH1 2.85Å; E128-L146 HydrophobicContact CB-CD2 4.39Å; E128-L146 HydrophobicContact CG-CD2 3.33Å; E128-C150 HydrophobicContact CB-CB 4.1Å; E128-C150 HydrophobicContact CG-CB 4.35Å; E128-I154 HydrophobicContact CG-CD1 3.51Å
129	C	90.5	Very high	85.9	Confident	72 Å²	72	44.7 Å²	44.7	49%	0.486	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-6.3	-176.8	69.3	0	0	0	0	114.7	C126 I131 C150	C126-C129 WeakPolarHBondContact CB-SG 3.27Å; C129-I131 PolarHBondContact O-N 3.35Å; C129-I131 WeakPolarHBondContact SG-CG2 3.45Å; C129-C150 VanDerWaalsContact SG-SG 3.66Å
130	G	90.5	Very high	85.2	Confident	44 Å²	44	50.5 Å²	50.5	45%	0.454	27%	0.271	S	S	.	.			trans	74	0	178.9	0	0	0	0	0	116	V125 C126	V125-G130 WeakPolarHBondContact CB-O 3.28Å; V125-G130 WeakPolarHBondContact CG1-O 3.39Å; C126-G130 WeakPolarHBondContact O-CA 3.49Å; C126-G130 PolarHBondContact O-N 3.12Å
131	I	89.5	Confident	84.3	Confident	63 Å²	63	50.4 Å²	50.4	32%	0.323	27%	0.271	S	S	.	.			trans	-66.7	141.9	-179.9	-158.6	170	0	0	0	111.6	V125 C126 C129 I133 C147	V125-I131 CarbonylContact C-O 3.34Å; V125-I131 VanDerWaalsContact CA-O 3.23Å; V125-I131 WeakPolarHBondContact CA-O 3.24Å; C126-I131 HydrophobicContact CB-CG2 3.97Å; C126-I131 PolarHBondContact N-O 2.9Å; C129-I131 PolarHBondContact O-N 3.35Å; C129-I131 WeakPolarHBondContact SG-CG2 3.45Å; I131-I133 HydrophobicContact CG2-CG1 4.38Å; I131-I133 VanDerWaalsContact O-CG1 3.32Å; I131-I133 WeakPolarHBondContact O-CG1 3.48Å; I131-C147 HydrophobicContact CG2-CB 3.93Å
132	Q	89.8	Confident	83.4	Confident	104 Å²	104	51.4 Å²	51.4	49%	0.486	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-68.2	130.8	173.6	-63.4	-180	19.2	0	0	111	V125	V125-Q132 HydrophobicContact CG1-CG 4.05Å
133	I	85.6	Confident	82.5	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	28%	0.283	C	S	.	.			trans	-111.7	13	-170.1	-40.3	168.2	0	0	0	113.6	L124 C126 I131 S135 K136 G137 F138 I145 C147	L124-I133 PolarHBondContact O-N 3.31Å; C126-I133 HydrophobicContact CB-CD1 3.7Å; C126-I133 HydrophobicContact CB-CG1 4.18Å; I131-I133 HydrophobicContact CG2-CG1 4.38Å; I131-I133 VanDerWaalsContact O-CG1 3.32Å; I131-I133 WeakPolarHBondContact O-CG1 3.48Å; I133-S135 PolarHBondContact O-N 2.87Å; I133-S135 VanDerWaalsContact O-N 3.11Å; I133-K136 HydrophobicContact CG2-CB 4.32Å; I133-K136 PolarHBondContact O-N 3.07Å; I133-G137 VanDerWaalsContact CG2-C 3.47Å; I133-G137 WeakPolarHBondContact CG2-O 3.38Å; I133-F138 HydrophobicContact CB-CB 4.41Å; I133-F138 HydrophobicContact CD1-CB 4.12Å; I133-F138 HydrophobicContact CG2-CB 3.67Å; I133-I145 HydrophobicContact CD1-CG2 3.62Å; I133-C147 HydrophobicContact CD1-CB 4.16Å; I133-C147 HydrophobicContact CG1-CB 4.23Å
134	I	78.9	Confident	82	Confident	33 Å²	33	57 Å²	57	17%	0.169	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-40.3	-174	-49.7	163.8	0	0	0	112.6	N7 V112 P121	N7-I134 HydrophobicContact CB-CG2 4.5Å; N7-I134 WeakPolarHBondContact ND2-CG2 3.45Å; V112-I134 HydrophobicContact CG2-CG2 4.15Å; P121-I134 HydrophobicContact CB-CD1 3.52Å; P121-I134 WeakPolarHBondContact O-CD1 3.43Å; P121-I134 WeakPolarHBondContact O-CG1 3.3Å
135	S	72.4	Confident	81.8	Confident	112 Å²	112	57.1 Å²	57.1	78%	0.783	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-18.2	-175.8	53.9	0	0	0	0	114.2	I133	I133-S135 PolarHBondContact O-N 2.87Å; I133-S135 VanDerWaalsContact O-N 3.11Å
136	K	69.8	Low	81.3	Confident	103 Å²	103	56 Å²	56	45%	0.448	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-10.5	-172.4	-66	-172.9	177.9	-174.4	0	113.2	I133 K148	I133-K136 HydrophobicContact CG2-CB 4.32Å; I133-K136 PolarHBondContact O-N 3.07Å; K136-K148 WeakPolarHBondContact O-CD 3.36Å; K136-K148 WeakPolarHBondContact O-CE 3.49Å; K136-K148 PolarHBondContact O-NZ 2.87Å
137	G	73.8	Confident	81.2	Confident	6 Å²	6	56 Å²	56	6%	0.062	30%	0.295	C	S	.	.			trans	71.1	150.2	-171.8	0	0	0	0	0	111.4	I133	I133-G137 VanDerWaalsContact CG2-C 3.47Å; I133-G137 WeakPolarHBondContact CG2-O 3.38Å
138	F	82.6	Confident	80.8	Confident	1 Å²	1	56.4 Å²	56.4	0%	0.004	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	164.2	-174.7	62.2	-88.8	0	0	0	111.7	H3 A5 A114 M115 I133 I145 L146	H3-F138 HydrophobicContact CB-CD1 4.5Å; H3-F138 HydrophobicContact CB-CD2 4.01Å; H3-F138 HydrophobicContact CB-CE1 4.02Å; H3-F138 HydrophobicContact CB-CE2 3.5Å; H3-F138 HydrophobicContact CB-CG 4.49Å; H3-F138 HydrophobicContact CB-CZ 3.49Å; H3-F138 VanDerWaalsContact CB-CZ 3.49Å; H3-F138 PolarHBondContact N-O 3.23Å; H3-F138 WeakPolarHBondContact O-CD1 3.45Å; H3-F138 PolarHBondContact O-N 3.44Å; A5-F138 HydrophobicContact CB-CE1 4.06Å; A114-F138 HydrophobicContact CB-CE1 4.02Å; A114-F138 HydrophobicContact CB-CZ 3.86Å; M115-F138 HydrophobicContact CG-CE2 3.91Å; M115-F138 HydrophobicContact CG-CZ 4.19Å; M115-F138 HydrophobicContact SD-CE2 4.09Å; I133-F138 HydrophobicContact CB-CB 4.41Å; I133-F138 HydrophobicContact CD1-CB 4.12Å; I133-F138 HydrophobicContact CG2-CB 3.67Å; F138-I145 HydrophobicContact CB-CG2 3.61Å; F138-I145 HydrophobicContact CD1-CG2 4.33Å; F138-I145 HydrophobicContact CD2-CB 4.49Å; F138-I145 HydrophobicContact CD2-CG2 3.6Å; F138-I145 HydrophobicContact CE2-CG2 4.31Å; F138-I145 HydrophobicContact CG-CG2 3.6Å; F138-L146 CarbonylContact C-O 3.6Å; F138-L146 WeakPolarHBondContact CA-O 3.39Å; F138-L146 VanDerWaalsContact CB-O 3.31Å; F138-L146 WeakPolarHBondContact CB-O 3.27Å
139	Q	77.8	Confident	80.5	Confident	24 Å²	24	57.3 Å²	57.3	11%	0.112	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	132.8	170.9	-66.7	-80.3	24.6	0	0	108.5	M1 L2 L146 W151	M1-Q139 VanDerWaalsContact C-OE1 3.27Å; M1-Q139 PolarHBondContact O-OE1 2.82Å; L2-Q139 HydrophobicContact CD2-CG 4.08Å; Q139-L146 PolarHBondContact N-O 3.23Å; Q139-L146 PolarHBondContact O-N 3.33Å; Q139-W151 HydrophobicContact CB-CB 3.82Å; Q139-W151 HydrophobicContact CB-CD2 3.55Å; Q139-W151 HydrophobicContact CB-CE3 4.04Å; Q139-W151 HydrophobicContact CB-CG 3.51Å; Q139-W151 HydrophobicContact CG-CB 3.79Å; Q139-W151 VanDerWaalsContact CG-CD1 3.49Å; Q139-W151 HydrophobicContact CG-CD2 3.9Å; Q139-W151 HydrophobicContact CG-CG 3.41Å; Q139-W151 VanDerWaalsContact CG-CG 3.41Å
140	R	76.5	Confident	80.3	Confident	136 Å²	136	55 Å²	55	51%	0.513	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	120.1	175.4	-175.1	178.1	81	112.5	-5.6	108.5	M115 N142	M115-R140 HydrophobicContact CE-CG 3.85Å; M115-R140 HydrophobicContact SD-CB 4.38Å; M115-R140 HydrophobicContact SD-CG 3.81Å; R140-N142 WeakPolarHBondContact CG-O 3.23Å; R140-N142 PolarHBondContact NH1-O 2.9Å
141	H	69.8	Low	79.9	Confident	19 Å²	19	55.6 Å²	55.6	9%	0.088	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	101.1	169.8	-173.7	-119.7	0	0	0	108.4	T143 R144 L146 W151 L158 I163	H141-T143 PolarHBondContact O-N 2.86Å; H141-R144 PolarHBondContact N-O 2.78Å; H141-R144 WeakPolarHBondContact O-CA 3.37Å; H141-R144 WeakPolarHBondContact O-CB 3.46Å; H141-R144 PolarHBondContact O-N 3.33Å; H141-L146 HydrophobicContact CB-CD1 3.68Å; H141-W151 HydrophobicContact CB-CE3 4.39Å; H141-W151 HydrophobicContact CB-CH2 4.4Å; H141-W151 HydrophobicContact CB-CZ3 3.64Å; H141-W151 AromaticContact CD2-CZ3 3.81Å; H141-W151 AromaticContact CG-CZ3 3.82Å; H141-L158 WeakPolarHBondContact NE2-CD1 3.21Å; H141-I163 VanDerWaalsContact NE2-CD1 3.32Å; H141-I163 WeakPolarHBondContact NE2-CD1 3.22Å
142	N	70.6	Confident	79.2	Confident	37 Å²	37	55.5 Å²	55.5	20%	0.198	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	-112.4	-171.2	-53.5	-41.8	0	0	0	112	R140 H168	R140-N142 WeakPolarHBondContact CG-O 3.23Å; R140-N142 PolarHBondContact NH1-O 2.9Å; N142-H168 HydrophobicContact CB-CB 3.94Å; N142-H168 PolarHBondContact ND2-O 2.63Å
143	T	73.5	Confident	78.7	Confident	103 Å²	103	54.4 Å²	54.4	63%	0.632	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-2.6	174.4	53.8	0	0	0	0	113	H141	H141-T143 PolarHBondContact O-N 2.86Å
144	R	80.8	Confident	78.1	Confident	128 Å²	128	55.4 Å²	55.4	48%	0.483	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	145.2	180	-57.4	-173.4	-175	-175.5	4.4	111.6	N127 E128 H141	N127-R144 HydrophobicContact CB-CB 4.16Å; N127-R144 HydrophobicContact CB-CG 4.41Å; N127-R144 WeakPolarHBondContact OD1-CA 3.35Å; E128-R144 IonicContact OE1-NH1 3.27Å; E128-R144 PolarHBondContact OE1-NH1 2.85Å; H141-R144 PolarHBondContact N-O 2.78Å; H141-R144 WeakPolarHBondContact O-CA 3.37Å; H141-R144 WeakPolarHBondContact O-CB 3.46Å; H141-R144 PolarHBondContact O-N 3.33Å
145	I	84.6	Confident	77.7	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	118.7	175.7	-58.7	-176.3	0	0	0	107.1	M115 W119 L124 C126 N127 I133 F138	M115-I145 HydrophobicContact SD-CD1 3.8Å; M115-I145 HydrophobicContact SD-CG1 3.57Å; M115-I145 VanDerWaalsContact SD-CG1 3.57Å; W119-I145 HydrophobicContact CH2-CD1 3.59Å; W119-I145 HydrophobicContact CZ2-CD1 3.64Å; W119-I145 HydrophobicContact CZ3-CD1 4.27Å; L124-I145 HydrophobicContact CD1-CD1 3.52Å; C126-I145 CarbonylContact C-O 3.59Å; C126-I145 WeakPolarHBondContact CA-O 3.41Å; N127-I145 PolarHBondContact N-O 3.32Å; N127-I145 PolarHBondContact OD1-N 3.49Å; N127-I145 PolarHBondContact OD1-O 3.12Å; I133-I145 HydrophobicContact CD1-CG2 3.62Å; F138-I145 HydrophobicContact CB-CG2 3.61Å; F138-I145 HydrophobicContact CD1-CG2 4.33Å; F138-I145 HydrophobicContact CD2-CB 4.49Å; F138-I145 HydrophobicContact CD2-CG2 3.6Å; F138-I145 HydrophobicContact CE2-CG2 4.31Å; F138-I145 HydrophobicContact CG-CG2 3.6Å
146	L	82.9	Confident	77.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	137	-175.7	-60.8	173.8	0	0	0	109.9	E128 F138 Q139 H141 W151 I154	E128-L146 HydrophobicContact CB-CD2 4.39Å; E128-L146 HydrophobicContact CG-CD2 3.33Å; F138-L146 CarbonylContact C-O 3.6Å; F138-L146 WeakPolarHBondContact CA-O 3.39Å; F138-L146 VanDerWaalsContact CB-O 3.31Å; F138-L146 WeakPolarHBondContact CB-O 3.27Å; Q139-L146 PolarHBondContact N-O 3.23Å; Q139-L146 PolarHBondContact O-N 3.33Å; H141-L146 HydrophobicContact CB-CD1 3.68Å; L146-W151 HydrophobicContact CB-CB 4.32Å; L146-W151 HydrophobicContact CD1-CE3 3.53Å; L146-W151 HydrophobicContact CD1-CZ3 4.02Å; L146-I154 HydrophobicContact CD1-CB 4.45Å; L146-I154 HydrophobicContact CD1-CD1 3.55Å; L146-I154 HydrophobicContact CD1-CG2 4.43Å; L146-I154 HydrophobicContact CD2-CD1 3.65Å; L146-I154 HydrophobicContact CG-CD1 4.25Å
147	C	86.8	Confident	77.3	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.014	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	164.6	172.4	72.3	0	0	0	0	110.5	C126 I131 I133 D149 C150 W151	C126-C147 HydrophobicContact CB-CB 4.08Å; C126-C147 PolarHBondContact SG-N 2.78Å; I131-C147 HydrophobicContact CG2-CB 3.93Å; I133-C147 HydrophobicContact CD1-CB 4.16Å; I133-C147 HydrophobicContact CG1-CB 4.23Å; C147-D149 PolarHBondContact O-N 2.78Å; C147-D149 VanDerWaalsContact O-N 3.11Å; C147-C150 PolarHBondContact O-N 2.76Å; C147-C150 PolarHBondContact SG-N 3.18Å; C147-C150 PolarHBondContact SG-SG 2.96Å; C147-W151 PolarHBondContact O-N 3.39Å
148	K	81.4	Confident	76.7	Confident	101 Å²	101	60.6 Å²	60.6	44%	0.439	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-24.4	177.2	-73.1	-178.7	174.2	159.9	0	113.8	L2 K136 P152	L2-K148 HydrophobicContact CD2-CD 4.43Å; L2-K148 HydrophobicContact CD2-CG 4.05Å; K136-K148 WeakPolarHBondContact O-CD 3.36Å; K136-K148 WeakPolarHBondContact O-CE 3.49Å; K136-K148 PolarHBondContact O-NZ 2.87Å; K148-P152 WeakPolarHBondContact O-CD 3.02Å; K148-P152 WeakPolarHBondContact O-CG 3.35Å
149	D	83.6	Confident	75.6	Confident	113 Å²	113	66.3 Å²	66.3	60%	0.604	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-37.5	-178.1	-49.2	-45.7	0	0	0	112.3	C147 P152	C147-D149 PolarHBondContact O-N 2.78Å; C147-D149 VanDerWaalsContact O-N 3.11Å; D149-P152 WeakPolarHBondContact O-CD 3.06Å
150	C	84.6	Confident	75	Confident	22 Å²	22	67.2 Å²	67.2	15%	0.149	35%	0.349	C	S	.	.	H	α-helix	trans	-78.2	-29.2	178.3	-66.4	0	0	0	0	112.7	E128 C129 C147 V153 I154	E128-C150 HydrophobicContact CB-CB 4.1Å; E128-C150 HydrophobicContact CG-CB 4.35Å; C129-C150 VanDerWaalsContact SG-SG 3.66Å; C147-C150 PolarHBondContact O-N 2.76Å; C147-C150 PolarHBondContact SG-N 3.18Å; C147-C150 PolarHBondContact SG-SG 2.96Å; C150-V153 PolarHBondContact O-N 3.46Å; C150-I154 PolarHBondContact O-N 3.2Å; C150-I154 VanDerWaalsContact O-N 3.13Å
151	W	82.7	Confident	74.6	Confident	58 Å²	58	62.7 Å²	62.7	22%	0.22	34%	0.338	C	S	.	.	H	α-helix	trans	-60	-48.1	-178.2	173.3	-110	0	0	0	113.9	Q139 H141 L146 C147 V153 I154 C155	Q139-W151 HydrophobicContact CB-CB 3.82Å; Q139-W151 HydrophobicContact CB-CD2 3.55Å; Q139-W151 HydrophobicContact CB-CE3 4.04Å; Q139-W151 HydrophobicContact CB-CG 3.51Å; Q139-W151 HydrophobicContact CG-CB 3.79Å; Q139-W151 VanDerWaalsContact CG-CD1 3.49Å; Q139-W151 HydrophobicContact CG-CD2 3.9Å; Q139-W151 HydrophobicContact CG-CG 3.41Å; Q139-W151 VanDerWaalsContact CG-CG 3.41Å; H141-W151 HydrophobicContact CB-CE3 4.39Å; H141-W151 HydrophobicContact CB-CH2 4.4Å; H141-W151 HydrophobicContact CB-CZ3 3.64Å; H141-W151 AromaticContact CD2-CZ3 3.81Å; H141-W151 AromaticContact CG-CZ3 3.82Å; L146-W151 HydrophobicContact CB-CB 4.32Å; L146-W151 HydrophobicContact CD1-CE3 3.53Å; L146-W151 HydrophobicContact CD1-CZ3 4.02Å; C147-W151 PolarHBondContact O-N 3.39Å; W151-V153 VanDerWaalsContact C-N 3.26Å; W151-V153 PolarHBondContact O-N 3.25Å; W151-I154 PolarHBondContact O-N 3.37Å; W151-C155 VanDerWaalsContact CD2-SG 3.56Å; W151-C155 WeakPolarHBondContact CZ2-SG 3.45Å; W151-C155 PolarHBondContact NE1-SG 3.4Å; W151-C155 VanDerWaalsContact NE1-SG 3.37Å; W151-C155 WeakPolarHBondContact O-CB 3.48Å; W151-C155 PolarHBondContact O-N 3.39Å
152	P	75.6	Confident	75.2	Confident	60 Å²	60	64.1 Å²	64.1	39%	0.39	34%	0.344	S	S	.	.	H	α-helix	trans	-57.4	-37.3	176.2	-26.3	34.6	0	0	0	113.5	K148 D149 C155 Q156	K148-P152 WeakPolarHBondContact O-CD 3.02Å; K148-P152 WeakPolarHBondContact O-CG 3.35Å; D149-P152 WeakPolarHBondContact O-CD 3.06Å; P152-C155 WeakPolarHBondContact O-CB 3.2Å; P152-C155 PolarHBondContact O-N 3.37Å; P152-Q156 VanDerWaalsContact O-CG 3.31Å; P152-Q156 WeakPolarHBondContact O-CG 3.46Å; P152-Q156 PolarHBondContact O-N 2.82Å
153	V	79.6	Confident	75.7	Confident	82 Å²	82	65.1 Å²	65.1	50%	0.497	35%	0.349	S	S	.	.	H	α-helix	trans	-64.7	-50.1	179.2	-177	0	0	0	0	110.3	C150 W151 C155 Q156 E157	C150-V153 PolarHBondContact O-N 3.46Å; W151-V153 VanDerWaalsContact C-N 3.26Å; W151-V153 PolarHBondContact O-N 3.25Å; V153-C155 VanDerWaalsContact C-N 3.33Å; V153-C155 PolarHBondContact O-N 3.43Å; V153-Q156 WeakPolarHBondContact O-CB 3.39Å; V153-Q156 PolarHBondContact O-N 3.34Å; V153-E157 PolarHBondContact O-N 3.1Å
154	I	72.5	Confident	76.4	Confident	22 Å²	22	60.2 Å²	60.2	11%	0.113	32%	0.319	C	S	.	.	H	α-helix	trans	-64.6	-38.7	175.8	-71.1	173	0	0	0	111.2	E128 L146 C150 W151 Q156 E157 L158	E128-I154 HydrophobicContact CG-CD1 3.51Å; L146-I154 HydrophobicContact CD1-CB 4.45Å; L146-I154 HydrophobicContact CD1-CD1 3.55Å; L146-I154 HydrophobicContact CD1-CG2 4.43Å; L146-I154 HydrophobicContact CD2-CD1 3.65Å; L146-I154 HydrophobicContact CG-CD1 4.25Å; C150-I154 PolarHBondContact O-N 3.2Å; C150-I154 VanDerWaalsContact O-N 3.13Å; W151-I154 PolarHBondContact O-N 3.37Å; I154-Q156 VanDerWaalsContact C-N 3.29Å; I154-Q156 PolarHBondContact O-N 3.45Å; I154-E157 PolarHBondContact O-N 3.31Å; I154-L158 HydrophobicContact CG2-CD1 3.77Å; I154-L158 HydrophobicContact CG2-CG 4.32Å; I154-L158 VanDerWaalsContact O-CG 3.31Å; I154-L158 WeakPolarHBondContact O-CG 3.43Å; I154-L158 PolarHBondContact O-N 3.42Å
155	C	70.8	Confident	76.8	Confident	40 Å²	40	58.7 Å²	58.7	27%	0.27	32%	0.317	S	S	.	.	H	α-helix	trans	-59	-41.4	175	-87.9	0	0	0	0	112.1	W151 P152 V153 E157 L158 V159	W151-C155 VanDerWaalsContact CD2-SG 3.56Å; W151-C155 WeakPolarHBondContact CZ2-SG 3.45Å; W151-C155 PolarHBondContact NE1-SG 3.4Å; W151-C155 VanDerWaalsContact NE1-SG 3.37Å; W151-C155 WeakPolarHBondContact O-CB 3.48Å; W151-C155 PolarHBondContact O-N 3.39Å; P152-C155 WeakPolarHBondContact O-CB 3.2Å; P152-C155 PolarHBondContact O-N 3.37Å; V153-C155 VanDerWaalsContact C-N 3.33Å; V153-C155 PolarHBondContact O-N 3.43Å; C155-E157 VanDerWaalsContact C-N 3.32Å; C155-L158 CarbonylContact O-C 3.19Å; C155-L158 WeakPolarHBondContact O-CA 3.46Å; C155-L158 PolarHBondContact O-N 2.91Å; C155-V159 WeakPolarHBondContact O-CG2 3.29Å; C155-V159 PolarHBondContact O-N 3.45Å
156	Q	67.8	Low	77	Confident	143 Å²	143	61.9 Å²	61.9	67%	0.668	34%	0.337	S	S	*	.	H	α-helix	trans	-62	-40.5	177.5	-77	173.6	4.2	0	0	111.7	P152 V153 I154 L158 V159	P152-Q156 VanDerWaalsContact O-CG 3.31Å; P152-Q156 WeakPolarHBondContact O-CG 3.46Å; P152-Q156 PolarHBondContact O-N 2.82Å; V153-Q156 WeakPolarHBondContact O-CB 3.39Å; V153-Q156 PolarHBondContact O-N 3.34Å; I154-Q156 VanDerWaalsContact C-N 3.29Å; I154-Q156 PolarHBondContact O-N 3.45Å; Q156-L158 PolarHBondContact O-N 2.93Å; Q156-V159 WeakPolarHBondContact O-CB 3.46Å; Q156-V159 PolarHBondContact O-N 3.32Å
157	E	65.7	Low	77.4	Confident	150 Å²	150	63.8 Å²	63.8	70%	0.701	35%	0.35	S	S	*	.	H	α-helix	trans	-66.1	-27.8	172.4	-65.1	-179	168.6	0	0	112.5	V153 I154 C155	V153-E157 PolarHBondContact O-N 3.1Å; I154-E157 PolarHBondContact O-N 3.31Å; C155-E157 VanDerWaalsContact C-N 3.32Å
158	L	60.6	Low	77.2	Confident	30 Å²	30	67.5 Å²	67.5	16%	0.157	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-5.2	175.9	-66.2	171	0	0	0	114.2	H141 I154 C155 Q156 G160 C161 P170	H141-L158 WeakPolarHBondContact NE2-CD1 3.21Å; I154-L158 HydrophobicContact CG2-CD1 3.77Å; I154-L158 HydrophobicContact CG2-CG 4.32Å; I154-L158 VanDerWaalsContact O-CG 3.31Å; I154-L158 WeakPolarHBondContact O-CG 3.43Å; I154-L158 PolarHBondContact O-N 3.42Å; C155-L158 CarbonylContact O-C 3.19Å; C155-L158 WeakPolarHBondContact O-CA 3.46Å; C155-L158 PolarHBondContact O-N 2.91Å; Q156-L158 PolarHBondContact O-N 2.93Å; L158-G160 PolarHBondContact O-N 3.01Å; L158-C161 VanDerWaalsContact C-SG 3.56Å; L158-C161 WeakPolarHBondContact CA-SG 3.32Å; L158-C161 PolarHBondContact O-N 3.04Å; L158-C161 PolarHBondContact O-SG 3.12Å; L158-C161 VanDerWaalsContact O-SG 3.34Å; L158-P170 HydrophobicContact CD2-CB 4.1Å; L158-P170 HydrophobicContact CD2-CG 3.92Å
159	V	59.3	Low	77.3	Confident	120 Å²	120	69.2 Å²	69.2	73%	0.727	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	109.6	177.9	173	0	0	0	0	108.1	C155 Q156	C155-V159 WeakPolarHBondContact O-CG2 3.29Å; C155-V159 PolarHBondContact O-N 3.45Å; Q156-V159 WeakPolarHBondContact O-CB 3.46Å; Q156-V159 PolarHBondContact O-N 3.32Å
160	G	65.7	Low	77.3	Confident	44 Å²	44	67.4 Å²	67.4	45%	0.454	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.9	3.7	-178.5	0	0	0	0	0	115	L158 L173	L158-G160 PolarHBondContact O-N 3.01Å; G160-L173 VanDerWaalsContact O-CB 3.26Å; G160-L173 WeakPolarHBondContact O-CB 3.29Å; G160-L173 WeakPolarHBondContact O-CD1 3.22Å
161	C	68.6	Low	77.3	Confident	41 Å²	41	66.5 Å²	66.5	28%	0.277	36%	0.362	S	S	.	.			trans	-116.6	150.5	172.7	9.3	0	0	0	0	112	L158 P170 I171	L158-C161 VanDerWaalsContact C-SG 3.56Å; L158-C161 WeakPolarHBondContact CA-SG 3.32Å; L158-C161 PolarHBondContact O-N 3.04Å; L158-C161 PolarHBondContact O-SG 3.12Å; L158-C161 VanDerWaalsContact O-SG 3.34Å; C161-P170 HydrophobicContact CB-CB 4.37Å; C161-I171 CarbonylContact C-O 3.54Å; C161-I171 VanDerWaalsContact CA-O 3.25Å; C161-I171 WeakPolarHBondContact CA-O 3.33Å; C161-I171 WeakPolarHBondContact CB-O 3.39Å
162	H	81.2	Confident	77.3	Confident	49 Å²	49	69.5 Å²	69.5	23%	0.227	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	162.5	167.7	-66.9	-73.5	0	0	0	109.6	P170 I171 H176 F183	H162-P170 CarbonylContact O-C 3.58Å; H162-P170 WeakPolarHBondContact O-CA 3.37Å; H162-I171 HydrophobicContact CB-CB 4.29Å; H162-I171 HydrophobicContact CB-CD1 4.24Å; H162-I171 PolarHBondContact N-O 2.9Å; H162-I171 PolarHBondContact O-N 3.33Å; H162-H176 AromaticContact CD2-CE1 3.42Å; H162-H176 PolarHBondContact CD2-CE1 2.73Å; H162-H176 VanDerWaalsContact CD2-CE1 3.42Å; H162-H176 AromaticContact CD2-CG 3.96Å; H162-H176 AromaticContact CD2-ND1 3.26Å; H162-H176 PolarHBondContact CD2-ND1 3.11Å; H162-H176 VanDerWaalsContact CD2-ND1 3.26Å; H162-H176 AromaticContact NE2-CE1 3.44Å; H162-H176 PolarHBondContact NE2-CE1 3.24Å; H162-H176 AromaticContact NE2-ND1 3.8Å; H162-F183 HydrophobicContact CB-CB 3.9Å; H162-F183 HydrophobicContact CB-CD1 4.22Å; H162-F183 HydrophobicContact CB-CD2 4.12Å; H162-F183 HydrophobicContact CB-CG 3.82Å; H162-F183 AromaticContact CE1-CE1 3.54Å; H162-F183 AromaticContact CE1-CE2 3.67Å; H162-F183 AromaticContact CE1-CZ 3.27Å; H162-F183 WeakPolarHBondContact CE1-CZ 3.31Å; H162-F183 AromaticContact CG-CD1 3.8Å; H162-F183 AromaticContact CG-CD2 3.95Å; H162-F183 AromaticContact CG-CE1 3.99Å; H162-F183 AromaticContact CG-CG 3.78Å; H162-F183 AromaticContact ND1-CD1 3.76Å; H162-F183 AromaticContact ND1-CD2 3.42Å; H162-F183 WeakPolarHBondContact ND1-CD2 3.46Å; H162-F183 AromaticContact ND1-CE1 3.58Å; H162-F183 AromaticContact ND1-CE2 3.22Å; H162-F183 WeakPolarHBondContact ND1-CE2 3.47Å; H162-F183 AromaticContact ND1-CG 3.68Å; H162-F183 AromaticContact ND1-CZ 3.3Å; H162-F183 VanDerWaalsContact ND1-CZ 3.3Å; H162-F183 WeakPolarHBondContact ND1-CZ 3.4Å; H162-F183 AromaticContact NE2-CE1 3.93Å
163	I	80.9	Confident	77.5	Confident	58 Å²	58	71.5 Å²	71.5	30%	0.297	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.6	172.4	-60.9	172.8	0	0	0	107.8	H141 Q165	H141-I163 VanDerWaalsContact NE2-CD1 3.32Å; H141-I163 WeakPolarHBondContact NE2-CD1 3.22Å; I163-Q165 PolarHBondContact O-N 3.35Å
164	C	88.3	Confident	77.6	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	39%	0.394	C	S	.	.			trans	-70.1	125.4	175.5	175.4	0	0	0	0	110.9	T166 C167 H168 K169 I171 F183 H185 H188	C164-T166 VanDerWaalsContact C-N 3.3Å; C164-T166 PolarHBondContact O-N 3.41Å; C164-T166 PolarHBondContact SG-N 3.29Å; C164-T166 VanDerWaalsContact SG-N 3.37Å; C164-C167 VanDerWaalsContact SG-SG 3.65Å; C164-H168 WeakPolarHBondContact O-CA 3.32Å; C164-H168 PolarHBondContact O-N 3.44Å; C164-K169 PolarHBondContact N-O 3.1Å; C164-I171 HydrophobicContact CB-CD1 3.8Å; C164-I171 HydrophobicContact CB-CG1 3.77Å; C164-F183 CarbonylContact C-O 3.59Å; C164-F183 WeakPolarHBondContact CA-O 2.99Å; C164-H185 WeakPolarHBondContact CB-CE1 3.11Å; C164-H185 WeakPolarHBondContact CB-ND1 3.34Å; C164-H185 PolarHBondContact SG-N 3.14Å; C164-H185 VanDerWaalsContact SG-N 3.39Å; C164-H185 PolarHBondContact SG-ND1 2.94Å; C164-H188 PolarHBondContact SG-CD2 3.35Å
165	Q	88.8	Confident	78.5	Confident	95 Å²	95	77.4 Å²	77.4	44%	0.444	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-20.4	-179.8	-173.6	69	-10.9	0	0	113.1	I163 H168 D182 F183	I163-Q165 PolarHBondContact O-N 3.35Å; Q165-H168 PolarHBondContact O-CE1 3.1Å; Q165-D182 HydrophobicContact CB-CB 3.96Å; Q165-D182 HydrophobicContact CG-CB 4.04Å; Q165-F183 PolarHBondContact N-O 2.86Å
166	T	90.3	Very high	79.5	Confident	70 Å²	70	77.8 Å²	77.8	43%	0.429	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-48.3	175.1	-45.3	0	0	0	0	112.7	C164 H184 H188	C164-T166 VanDerWaalsContact C-N 3.3Å; C164-T166 PolarHBondContact O-N 3.41Å; C164-T166 PolarHBondContact SG-N 3.29Å; C164-T166 VanDerWaalsContact SG-N 3.37Å; T166-H184 PolarHBondContact N-ND1 2.85Å; T166-H184 PolarHBondContact OG1-ND1 2.83Å; T166-H188 HydrophobicContact CG2-CB 4.05Å
167	C	90.9	Very high	80.7	Confident	40 Å²	40	71.3 Å²	71.3	27%	0.27	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-2.9	-172.4	71.2	0	0	0	0	114.9	C164 K169 H185 H188	C164-C167 VanDerWaalsContact SG-SG 3.65Å; C167-K169 PolarHBondContact O-N 3.16Å; C167-K169 VanDerWaalsContact O-N 3.12Å; C167-H185 PolarHBondContact SG-CE1 2.93Å; C167-H185 PolarHBondContact SG-ND1 3.2Å; C167-H188 WeakPolarHBondContact CB-NE2 3.46Å; C167-H188 PolarHBondContact SG-NE2 3.35Å
168	H	82.4	Confident	81.8	Confident	79 Å²	79	70.3 Å²	70.3	37%	0.366	37%	0.371	S	S	.	.			trans	62.6	15.2	177.8	-58.4	-47	0	0	0	115.2	N142 C164 Q165	N142-H168 HydrophobicContact CB-CB 3.94Å; N142-H168 PolarHBondContact ND2-O 2.63Å; C164-H168 WeakPolarHBondContact O-CA 3.32Å; C164-H168 PolarHBondContact O-N 3.44Å; Q165-H168 PolarHBondContact O-CE1 3.1Å
169	K	84.3	Confident	83.3	Confident	138 Å²	138	69.9 Å²	69.9	60%	0.6	37%	0.368	S	S	*	.			trans	-89.2	152.8	174.4	-63	178.4	-177.2	178.9	0	111.3	C164 C167	C164-K169 PolarHBondContact N-O 3.1Å; C167-K169 PolarHBondContact O-N 3.16Å; C167-K169 VanDerWaalsContact O-N 3.12Å
170	P	82	Confident	84.8	Confident	75 Å²	75	70.6 Å²	70.6	49%	0.487	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	138.1	172.7	-19.2	31.7	0	0	0	111.3	L158 C161 H162	L158-P170 HydrophobicContact CD2-CB 4.1Å; L158-P170 HydrophobicContact CD2-CG 3.92Å; C161-P170 HydrophobicContact CB-CB 4.37Å; H162-P170 CarbonylContact O-C 3.58Å; H162-P170 WeakPolarHBondContact O-CA 3.37Å
171	I	85.9	Confident	85.7	Confident	2 Å²	2	70.6 Å²	70.6	1%	0.01	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.5	171.6	-41.5	175.3	0	0	0	107.5	C161 H162 C164 K175 H176 F183	C161-I171 CarbonylContact C-O 3.54Å; C161-I171 VanDerWaalsContact CA-O 3.25Å; C161-I171 WeakPolarHBondContact CA-O 3.33Å; C161-I171 WeakPolarHBondContact CB-O 3.39Å; H162-I171 HydrophobicContact CB-CB 4.29Å; H162-I171 HydrophobicContact CB-CD1 4.24Å; H162-I171 PolarHBondContact N-O 2.9Å; H162-I171 PolarHBondContact O-N 3.33Å; C164-I171 HydrophobicContact CB-CD1 3.8Å; C164-I171 HydrophobicContact CB-CG1 3.77Å; I171-K175 VanDerWaalsContact CG2-C 3.48Å; I171-K175 HydrophobicContact CG2-CB 4.18Å; I171-K175 WeakPolarHBondContact CG2-O 3.48Å; I171-H176 HydrophobicContact CB-CB 4.5Å; I171-H176 HydrophobicContact CD1-CB 3.8Å; I171-H176 HydrophobicContact CG2-CB 3.89Å; I171-F183 HydrophobicContact CD1-CB 4.11Å
172	E	82.7	Confident	86.7	Confident	121 Å²	121	72.2 Å²	72.2	57%	0.565	37%	0.37	S	S	*	.			trans	-55.3	150.9	171.8	-62.6	175.1	-142.7	0	0	111.6	N174 K175	E172-N174 PolarHBondContact O-N 3.29Å; E172-K175 HydrophobicContact CB-CB 4.2Å; E172-K175 HydrophobicContact CB-CD 3.98Å; E172-K175 HydrophobicContact CB-CG 4.11Å; E172-K175 VanDerWaalsContact CD-NZ 3.28Å; E172-K175 HydrophobicContact CG-CD 4.45Å; E172-K175 PolarHBondContact O-N 2.9Å; E172-K175 IonicContact OE1-NZ 3.87Å; E172-K175 PolarHBondContact OE1-NZ 3.21Å; E172-K175 WeakPolarHBondContact OE2-CD 3.15Å; E172-K175 WeakPolarHBondContact OE2-CE 3.43Å; E172-K175 IonicContact OE2-NZ 2.78Å; E172-K175 PolarHBondContact OE2-NZ 3.43Å
173	L	78.9	Confident	87.1	Confident	102 Å²	102	73 Å²	73	53%	0.534	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	135.4	177.7	-160.7	66.1	0	0	0	110.7	G160 K175	G160-L173 VanDerWaalsContact O-CB 3.26Å; G160-L173 WeakPolarHBondContact O-CB 3.29Å; G160-L173 WeakPolarHBondContact O-CD1 3.22Å; L173-K175 PolarHBondContact O-N 2.82Å; L173-K175 VanDerWaalsContact O-N 3.11Å
174	N	82.2	Confident	87.7	Confident	126 Å²	126	71 Å²	71	67%	0.674	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	6.9	-177.6	-52.9	-45.3	0	0	0	116.4	E172	E172-N174 PolarHBondContact O-N 3.29Å
175	K	91.4	Very high	88	Confident	103 Å²	103	72.3 Å²	72.3	45%	0.448	37%	0.369	S	S	.	.			trans	-100.8	25.5	173.2	-64.4	-164	-176.6	165.8	0	113.9	I171 E172 L173 L200	I171-K175 VanDerWaalsContact CG2-C 3.48Å; I171-K175 HydrophobicContact CG2-CB 4.18Å; I171-K175 WeakPolarHBondContact CG2-O 3.48Å; E172-K175 HydrophobicContact CB-CB 4.2Å; E172-K175 HydrophobicContact CB-CD 3.98Å; E172-K175 HydrophobicContact CB-CG 4.11Å; E172-K175 VanDerWaalsContact CD-NZ 3.28Å; E172-K175 HydrophobicContact CG-CD 4.45Å; E172-K175 PolarHBondContact O-N 2.9Å; E172-K175 IonicContact OE1-NZ 3.87Å; E172-K175 PolarHBondContact OE1-NZ 3.21Å; E172-K175 WeakPolarHBondContact OE2-CD 3.15Å; E172-K175 WeakPolarHBondContact OE2-CE 3.43Å; E172-K175 IonicContact OE2-NZ 2.78Å; E172-K175 PolarHBondContact OE2-NZ 3.43Å; L173-K175 PolarHBondContact O-N 2.82Å; L173-K175 VanDerWaalsContact O-N 3.11Å; K175-L200 HydrophobicContact CB-CD2 4.29Å; K175-L200 WeakPolarHBondContact O-CD2 3.37Å
176	H	91.2	Very high	88.3	Confident	47 Å²	47	68.4 Å²	68.4	22%	0.218	35%	0.352	C	S	.	.			trans	-113.8	156.8	-178.8	61.9	-90.3	0	0	0	111.6	H162 I171 F183 H184	H162-H176 AromaticContact CD2-CE1 3.42Å; H162-H176 PolarHBondContact CD2-CE1 2.73Å; H162-H176 VanDerWaalsContact CD2-CE1 3.42Å; H162-H176 AromaticContact CD2-CG 3.96Å; H162-H176 AromaticContact CD2-ND1 3.26Å; H162-H176 PolarHBondContact CD2-ND1 3.11Å; H162-H176 VanDerWaalsContact CD2-ND1 3.26Å; H162-H176 AromaticContact NE2-CE1 3.44Å; H162-H176 PolarHBondContact NE2-CE1 3.24Å; H162-H176 AromaticContact NE2-ND1 3.8Å; I171-H176 HydrophobicContact CB-CB 4.5Å; I171-H176 HydrophobicContact CD1-CB 3.8Å; I171-H176 HydrophobicContact CG2-CB 3.89Å; H176-F183 HydrophobicContact CB-CD1 4.31Å; H176-F183 AromaticContact CD2-CD1 3.37Å; H176-F183 WeakPolarHBondContact CD2-CD1 3.3Å; H176-F183 AromaticContact CD2-CE1 3.66Å; H176-F183 AromaticContact CG-CD1 3.84Å; H176-F183 AromaticContact NE2-CD1 3.81Å; H176-F183 AromaticContact NE2-CE1 3.58Å; H176-H184 WeakPolarHBondContact CA-O 3.29Å
177	I	93.2	Very high	88.5	Confident	8 Å²	8	69.4 Å²	69.4	4%	0.041	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	156.4	156.9	57.6	163.9	0	0	0	108.8	H184 P186 F189 A202 L209	I177-H184 HydrophobicContact CG1-CB 4.29Å; I177-H184 PolarHBondContact N-O 3.27Å; I177-H184 PolarHBondContact O-N 2.71Å; I177-P186 HydrophobicContact CG2-CB 4.3Å; I177-P186 HydrophobicContact CG2-CG 3.96Å; I177-F189 HydrophobicContact CD1-CD2 3.65Å; I177-F189 HydrophobicContact CD1-CE2 4.03Å; I177-F189 HydrophobicContact CD1-CG 4.4Å; I177-A202 HydrophobicContact CD1-CB 4.35Å; I177-A202 HydrophobicContact CG2-CB 3.85Å; I177-L209 HydrophobicContact CD1-CD1 3.88Å
178	K	89.3	Confident	88.7	Confident	128 Å²	128	70.3 Å²	70.3	56%	0.557	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.7	171.3	-164	176	-175.1	-178.5	0	108.1	G181 D182	K178-G181 WeakPolarHBondContact CE-O 3.49Å; K178-D182 CarbonylContact C-O 3.48Å; K178-D182 VanDerWaalsContact CA-O 3.29Å; K178-D182 WeakPolarHBondContact CA-O 3.31Å
179	F	92.3	Very high	89.3	Confident	22 Å²	22	68.3 Å²	68.3	10%	0.096	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	126.4	179.1	179.3	-129.1	0	0	0	109.4	G181 D182 F189 E204 G207 L209	F179-G181 PolarHBondContact O-N 2.94Å; F179-D182 PolarHBondContact N-O 3.18Å; F179-D182 PolarHBondContact O-N 2.93Å; F179-F189 HydrophobicContact CD1-CD1 4.32Å; F179-F189 AromaticContact CD1-CE1 3.45Å; F179-F189 HydrophobicContact CD1-CE1 3.45Å; F179-F189 VanDerWaalsContact CD1-CE1 3.45Å; F179-F189 AromaticContact CD1-CZ 3.68Å; F179-F189 HydrophobicContact CD1-CZ 3.68Å; F179-F189 HydrophobicContact CE1-CD1 4.37Å; F179-F189 AromaticContact CE1-CE1 3.65Å; F179-F189 HydrophobicContact CE1-CE1 3.65Å; F179-F189 HydrophobicContact CE1-CZ 4.32Å; F179-F189 HydrophobicContact CG-CE1 4.36Å; F179-F189 HydrophobicContact CG-CZ 4.44Å; F179-E204 WeakPolarHBondContact CA-OE2 3.39Å; F179-E204 HydrophobicContact CD2-CG 4.13Å; F179-E204 HydrophobicContact CE2-CG 4.38Å; F179-G207 VanDerWaalsContact CE2-O 3.29Å; F179-G207 WeakPolarHBondContact CE2-O 3Å; F179-G207 WeakPolarHBondContact CZ-O 3.3Å; F179-L209 HydrophobicContact CB-CD1 4.09Å; F179-L209 HydrophobicContact CB-CD2 4.42Å; F179-L209 HydrophobicContact CD1-CD1 4.17Å; F179-L209 HydrophobicContact CD2-CD1 3.74Å; F179-L209 HydrophobicContact CD2-CD2 3.8Å; F179-L209 HydrophobicContact CD2-CG 3.52Å; F179-L209 HydrophobicContact CE2-CD1 4.17Å; F179-L209 HydrophobicContact CE2-CD2 4.45Å; F179-L209 HydrophobicContact CE2-CG 3.78Å; F179-L209 HydrophobicContact CG-CD1 3.74Å; F179-L209 HydrophobicContact CG-CD2 4.35Å; F179-L209 HydrophobicContact CG-CG 4.06Å
180	M	90.7	Very high	89.9	Confident	134 Å²	134	66.3 Å²	66.3	66%	0.66	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	31.6	-176.3	-65.3	-165	-85.4	0	0	113.8	E204	M180-E204 PolarHBondContact N-OE2 2.94Å
181	G	85	Confident	90.6	Very high	44 Å²	44	62.8 Å²	62.8	45%	0.454	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.7	-18.6	179.2	0	0	0	0	0	115.6	K178 F179	K178-G181 WeakPolarHBondContact CE-O 3.49Å; F179-G181 PolarHBondContact O-N 2.94Å
182	D	89	Confident	91	Very high	75 Å²	75	68.6 Å²	68.6	40%	0.401	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	159.3	-174.1	-73.7	-33.5	0	0	0	112.7	Q165 K178 F179 H184	Q165-D182 HydrophobicContact CB-CB 3.96Å; Q165-D182 HydrophobicContact CG-CB 4.04Å; K178-D182 CarbonylContact C-O 3.48Å; K178-D182 VanDerWaalsContact CA-O 3.29Å; K178-D182 WeakPolarHBondContact CA-O 3.31Å; F179-D182 PolarHBondContact N-O 3.18Å; F179-D182 PolarHBondContact O-N 2.93Å; D182-H184 PolarHBondContact O-CD2 3.1Å
183	F	89.9	Confident	91.5	Very high	65 Å²	65	67 Å²	67	29%	0.285	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	133.9	179	-63.5	-72.6	0	0	0	110.9	H162 C164 Q165 I171 H176	H162-F183 HydrophobicContact CB-CB 3.9Å; H162-F183 HydrophobicContact CB-CD1 4.22Å; H162-F183 HydrophobicContact CB-CD2 4.12Å; H162-F183 HydrophobicContact CB-CG 3.82Å; H162-F183 AromaticContact CE1-CE1 3.54Å; H162-F183 AromaticContact CE1-CE2 3.67Å; H162-F183 AromaticContact CE1-CZ 3.27Å; H162-F183 WeakPolarHBondContact CE1-CZ 3.31Å; H162-F183 AromaticContact CG-CD1 3.8Å; H162-F183 AromaticContact CG-CD2 3.95Å; H162-F183 AromaticContact CG-CE1 3.99Å; H162-F183 AromaticContact CG-CG 3.78Å; H162-F183 AromaticContact ND1-CD1 3.76Å; H162-F183 AromaticContact ND1-CD2 3.42Å; H162-F183 WeakPolarHBondContact ND1-CD2 3.46Å; H162-F183 AromaticContact ND1-CE1 3.58Å; H162-F183 AromaticContact ND1-CE2 3.22Å; H162-F183 WeakPolarHBondContact ND1-CE2 3.47Å; H162-F183 AromaticContact ND1-CG 3.68Å; H162-F183 AromaticContact ND1-CZ 3.3Å; H162-F183 VanDerWaalsContact ND1-CZ 3.3Å; H162-F183 WeakPolarHBondContact ND1-CZ 3.4Å; H162-F183 AromaticContact NE2-CE1 3.93Å; C164-F183 CarbonylContact C-O 3.59Å; C164-F183 WeakPolarHBondContact CA-O 2.99Å; Q165-F183 PolarHBondContact N-O 2.86Å; I171-F183 HydrophobicContact CD1-CB 4.11Å; H176-F183 HydrophobicContact CB-CD1 4.31Å; H176-F183 AromaticContact CD2-CD1 3.37Å; H176-F183 WeakPolarHBondContact CD2-CD1 3.3Å; H176-F183 AromaticContact CD2-CE1 3.66Å; H176-F183 AromaticContact CG-CD1 3.84Å; H176-F183 AromaticContact NE2-CD1 3.81Å; H176-F183 AromaticContact NE2-CE1 3.58Å
184	H	92.7	Very high	92.2	Very high	16 Å²	16	65 Å²	65	7%	0.074	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	158.8	176.5	-55.4	-107.5	0	0	0	112.8	T166 H176 I177 D182 F189	T166-H184 PolarHBondContact N-ND1 2.85Å; T166-H184 PolarHBondContact OG1-ND1 2.83Å; H176-H184 WeakPolarHBondContact CA-O 3.29Å; I177-H184 HydrophobicContact CG1-CB 4.29Å; I177-H184 PolarHBondContact N-O 3.27Å; I177-H184 PolarHBondContact O-N 2.71Å; D182-H184 PolarHBondContact O-CD2 3.1Å; H184-F189 HydrophobicContact CB-CE2 3.46Å; H184-F189 VanDerWaalsContact CB-CE2 3.46Å; H184-F189 HydrophobicContact CB-CZ 4.06Å; H184-F189 AromaticContact CE1-CZ 3.96Å; H184-F189 AromaticContact CG-CE2 3.71Å; H184-F189 AromaticContact CG-CZ 3.76Å; H184-F189 AromaticContact ND1-CE2 3.88Å; H184-F189 AromaticContact ND1-CZ 3.58Å
185	H	93.9	Very high	92.7	Very high	28 Å²	28	64.9 Å²	64.9	13%	0.13	33%	0.326	C	S	.	.			trans	-70.3	139.3	164.3	-59.7	104.4	0	0	0	109.9	C164 C167 H187 H188	C164-H185 WeakPolarHBondContact CB-CE1 3.11Å; C164-H185 WeakPolarHBondContact CB-ND1 3.34Å; C164-H185 PolarHBondContact SG-N 3.14Å; C164-H185 VanDerWaalsContact SG-N 3.39Å; C164-H185 PolarHBondContact SG-ND1 2.94Å; C167-H185 PolarHBondContact SG-CE1 2.93Å; C167-H185 PolarHBondContact SG-ND1 3.2Å; H185-H187 VanDerWaalsContact C-N 3.33Å; H185-H187 VanDerWaalsContact CB-NE2 3.27Å; H185-H187 WeakPolarHBondContact CB-NE2 3.05Å; H185-H187 AromaticContact CG-NE2 3.51Å; H185-H187 AromaticContact ND1-NE2 3.97Å; H185-H187 PolarHBondContact O-N 2.95Å; H185-H188 AromaticContact ND1-CD2 3.92Å; H185-H188 AromaticContact ND1-NE2 3.58Å; H185-H188 PolarHBondContact O-N 3.35Å
186	P	95.2	Very high	92.9	Very high	14 Å²	14	65.1 Å²	65.1	9%	0.091	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-55.5	-43.9	176.6	-25.7	32.5	0	0	0	114.4	I177 H188 F189 L198 G199 L200	I177-P186 HydrophobicContact CG2-CB 4.3Å; I177-P186 HydrophobicContact CG2-CG 3.96Å; P186-H188 PolarHBondContact O-N 3.2Å; P186-F189 PolarHBondContact O-N 2.96Å; P186-L198 CarbonylContact C-O 3.55Å; P186-L198 WeakPolarHBondContact CB-O 3.22Å; P186-G199 VanDerWaalsContact CB-C 3.45Å; P186-G199 WeakPolarHBondContact CB-O 2.87Å; P186-L200 HydrophobicContact CG-CD2 3.51Å; P186-L200 HydrophobicContact CG-CG 4.13Å
187	H	94.4	Very high	93.1	Very high	91 Å²	91	68.5 Å²	68.5	42%	0.421	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-64.9	-2.8	-175.3	70.3	68.6	0	0	0	114.6	H185 F189 E197	H185-H187 VanDerWaalsContact C-N 3.33Å; H185-H187 VanDerWaalsContact CB-NE2 3.27Å; H185-H187 WeakPolarHBondContact CB-NE2 3.05Å; H185-H187 AromaticContact CG-NE2 3.51Å; H185-H187 AromaticContact ND1-NE2 3.97Å; H185-H187 PolarHBondContact O-N 2.95Å; H187-F189 VanDerWaalsContact C-N 3.29Å; H187-E197 HydrophobicContact CB-CG 4.31Å; H187-E197 VanDerWaalsContact CB-OE1 3.27Å; H187-E197 WeakPolarHBondContact CB-OE1 3.3Å
188	H	95.6	Very high	93.2	Very high	59 Å²	59	68.2 Å²	68.2	27%	0.273	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-81.5	-12	172.3	-75.2	-50	0	0	0	113.1	C164 T166 C167 H185 P186	C164-H188 PolarHBondContact SG-CD2 3.35Å; T166-H188 HydrophobicContact CG2-CB 4.05Å; C167-H188 WeakPolarHBondContact CB-NE2 3.46Å; C167-H188 PolarHBondContact SG-NE2 3.35Å; H185-H188 AromaticContact ND1-CD2 3.92Å; H185-H188 AromaticContact ND1-NE2 3.58Å; H185-H188 PolarHBondContact O-N 3.35Å; P186-H188 PolarHBondContact O-N 3.2Å
189	F	96.5	Very high	93.4	Very high	36 Å²	36	63.5 Å²	63.5	16%	0.158	33%	0.331	C	S	.	.			trans	-126.2	151.5	-171.3	-58.5	-87.8	0	0	0	111.1	I177 F179 H184 P186 H187 L198 L209	I177-F189 HydrophobicContact CD1-CD2 3.65Å; I177-F189 HydrophobicContact CD1-CE2 4.03Å; I177-F189 HydrophobicContact CD1-CG 4.4Å; F179-F189 HydrophobicContact CD1-CD1 4.32Å; F179-F189 AromaticContact CD1-CE1 3.45Å; F179-F189 HydrophobicContact CD1-CE1 3.45Å; F179-F189 VanDerWaalsContact CD1-CE1 3.45Å; F179-F189 AromaticContact CD1-CZ 3.68Å; F179-F189 HydrophobicContact CD1-CZ 3.68Å; F179-F189 HydrophobicContact CE1-CD1 4.37Å; F179-F189 AromaticContact CE1-CE1 3.65Å; F179-F189 HydrophobicContact CE1-CE1 3.65Å; F179-F189 HydrophobicContact CE1-CZ 4.32Å; F179-F189 HydrophobicContact CG-CE1 4.36Å; F179-F189 HydrophobicContact CG-CZ 4.44Å; H184-F189 HydrophobicContact CB-CE2 3.46Å; H184-F189 VanDerWaalsContact CB-CE2 3.46Å; H184-F189 HydrophobicContact CB-CZ 4.06Å; H184-F189 AromaticContact CE1-CZ 3.96Å; H184-F189 AromaticContact CG-CE2 3.71Å; H184-F189 AromaticContact CG-CZ 3.76Å; H184-F189 AromaticContact ND1-CE2 3.88Å; H184-F189 AromaticContact ND1-CZ 3.58Å; P186-F189 PolarHBondContact O-N 2.96Å; H187-F189 VanDerWaalsContact C-N 3.29Å; F189-L198 HydrophobicContact CB-CB 4.44Å; F189-L198 HydrophobicContact CB-CD1 3.74Å; F189-L198 HydrophobicContact CB-CG 4.38Å; F189-L198 WeakPolarHBondContact O-CB 3.42Å; F189-L198 PolarHBondContact O-N 3.4Å; F189-L209 HydrophobicContact CB-CD1 3.76Å; F189-L209 HydrophobicContact CD1-CD1 3.55Å; F189-L209 HydrophobicContact CD2-CD1 4.01Å; F189-L209 HydrophobicContact CE1-CD1 4.1Å; F189-L209 HydrophobicContact CE2-CD1 4.5Å; F189-L209 HydrophobicContact CG-CD1 3.48Å; F189-L209 VanDerWaalsContact CG-CD1 3.48Å
190	H	96.4	Very high	93.5	Very high	97 Å²	97	67.1 Å²	67.1	45%	0.449	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-116.8	148.5	173.7	-61.3	83.3	0	0	0	108.4	F192 D195 Q196	H190-F192 PolarHBondContact O-N 3.31Å; H190-D195 WeakPolarHBondContact CB-OD1 3.05Å; H190-D195 PolarHBondContact CD2-O 3.4Å; H190-D195 VanDerWaalsContact CD2-O 3.31Å; H190-D195 IonicContact CG-OD1 3.16Å; H190-Q196 CarbonylContact C-O 3.33Å; H190-Q196 WeakPolarHBondContact CA-O 3.27Å
191	C	95.5	Very high	93.5	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.007	34%	0.338	C	S	.	.			trans	-62.6	126.2	178.2	177.1	0	0	0	0	110.2	D193 C194 D195 Q196 L198 C211	C191-D193 PolarHBondContact O-N 3.42Å; C191-D193 VanDerWaalsContact O-N 3.12Å; C191-C194 VanDerWaalsContact CB-SG 3.55Å; C191-C194 PolarHBondContact O-N 3.47Å; C191-D195 VanDerWaalsContact O-CA 3.27Å; C191-D195 WeakPolarHBondContact O-CA 3.25Å; C191-D195 PolarHBondContact O-N 2.97Å; C191-Q196 PolarHBondContact N-O 3.03Å; C191-L198 HydrophobicContact CB-CD2 3.68Å; C191-C211 HydrophobicContact CB-CB 4.08Å; C191-C211 PolarHBondContact SG-N 3.3Å
192	F	95.3	Very high	93.8	Very high	123 Å²	123	63 Å²	63	54%	0.539	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-38.8	179.8	-174.8	-98.1	0	0	0	113.6	H190 E208 L209 Y210	H190-F192 PolarHBondContact O-N 3.31Å; F192-E208 HydrophobicContact CB-CB 4.23Å; F192-E208 HydrophobicContact CD2-CB 4.22Å; F192-E208 HydrophobicContact CD2-CG 3.89Å; F192-E208 VanDerWaalsContact CD2-OE2 3.27Å; F192-E208 WeakPolarHBondContact CD2-OE2 3.25Å; F192-E208 HydrophobicContact CE2-CG 4.06Å; F192-E208 HydrophobicContact CG-CB 4.13Å; F192-E208 HydrophobicContact CG-CG 4.2Å; F192-L209 WeakPolarHBondContact CB-O 3.5Å; F192-L209 PolarHBondContact N-O 3.11Å; F192-Y210 HydrophobicContact CB-CD1 4.41Å; F192-Y210 HydrophobicContact CB-CE1 4.11Å; F192-Y210 HydrophobicContact CD1-CE1 4.05Å
193	D	92.2	Very high	93.9	Very high	89 Å²	89	60.8 Å²	60.8	48%	0.476	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-34.4	-177.5	-73.5	-16	0	0	0	115.9	C191 Y210 C214	C191-D193 PolarHBondContact O-N 3.42Å; C191-D193 VanDerWaalsContact O-N 3.12Å; D193-Y210 WeakPolarHBondContact OD2-CD1 3.48Å; D193-C214 HydrophobicContact CB-CB 3.89Å
194	C	93.5	Very high	93.9	Very high	60 Å²	60	61.7 Å²	61.7	41%	0.405	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.7	0.6	-169.8	71.8	0	0	0	0	114.4	C191 Q196 C214	C191-C194 VanDerWaalsContact CB-SG 3.55Å; C191-C194 PolarHBondContact O-N 3.47Å; C194-Q196 PolarHBondContact O-N 3.26Å; C194-C214 VanDerWaalsContact SG-SG 3.64Å
195	D	94.4	Very high	93.6	Very high	123 Å²	123	65.8 Å²	65.8	66%	0.658	33%	0.33	S	S	*	.			trans	57.3	14.6	179.4	-154.2	34.8	0	0	0	115.1	H190 C191	H190-D195 WeakPolarHBondContact CB-OD1 3.05Å; H190-D195 PolarHBondContact CD2-O 3.4Å; H190-D195 VanDerWaalsContact CD2-O 3.31Å; H190-D195 IonicContact CG-OD1 3.16Å; C191-D195 VanDerWaalsContact O-CA 3.27Å; C191-D195 WeakPolarHBondContact O-CA 3.25Å; C191-D195 PolarHBondContact O-N 2.97Å
196	Q	94.3	Very high	93.2	Very high	108 Å²	108	68.4 Å²	68.4	51%	0.505	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-73	134.4	176	-171.9	-178.3	-19	0	0	110.3	H190 C191 C194 L198	H190-Q196 CarbonylContact C-O 3.33Å; H190-Q196 WeakPolarHBondContact CA-O 3.27Å; C191-Q196 PolarHBondContact N-O 3.03Å; C194-Q196 PolarHBondContact O-N 3.26Å; Q196-L198 PolarHBondContact O-N 3.24Å
197	E	96.7	Very high	92.9	Very high	117 Å²	117	69.2 Å²	69.2	55%	0.547	38%	0.375	S	S	.	.	B	Isolated β-bridge	trans	-50.9	129.3	171.1	-172.3	-175.3	122.9	0	0	110.2	H187	H187-E197 HydrophobicContact CB-CG 4.31Å; H187-E197 VanDerWaalsContact CB-OE1 3.27Å; H187-E197 WeakPolarHBondContact CB-OE1 3.3Å
198	L	95.4	Very high	92.9	Very high	3 Å²	3	68.8 Å²	68.8	2%	0.016	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-81.8	140.5	-173.2	-69.4	-178.2	0	0	0	112.2	P186 F189 C191 Q196 A202 L209 C211	P186-L198 CarbonylContact C-O 3.55Å; P186-L198 WeakPolarHBondContact CB-O 3.22Å; F189-L198 HydrophobicContact CB-CB 4.44Å; F189-L198 HydrophobicContact CB-CD1 3.74Å; F189-L198 HydrophobicContact CB-CG 4.38Å; F189-L198 WeakPolarHBondContact O-CB 3.42Å; F189-L198 PolarHBondContact O-N 3.4Å; C191-L198 HydrophobicContact CB-CD2 3.68Å; Q196-L198 PolarHBondContact O-N 3.24Å; L198-A202 HydrophobicContact CB-CB 4.03Å; L198-A202 HydrophobicContact CD1-CB 3.98Å; L198-A202 HydrophobicContact CD2-CB 4.35Å; L198-A202 HydrophobicContact CG-CB 4.36Å; L198-L209 HydrophobicContact CD1-CB 3.45Å; L198-L209 VanDerWaalsContact CD1-CB 3.45Å; L198-L209 HydrophobicContact CD1-CD1 4.11Å; L198-L209 HydrophobicContact CD1-CG 4.34Å; L198-C211 HydrophobicContact CD2-CB 3.77Å
199	G	93.3	Very high	92.8	Very high	29 Å²	29	66.3 Å²	66.3	30%	0.299	36%	0.362	S	S	.	.			trans	-98.7	-170.8	172.2	0	0	0	0	0	112.8	P186 D201 A202	P186-G199 VanDerWaalsContact CB-C 3.45Å; P186-G199 WeakPolarHBondContact CB-O 2.87Å; G199-D201 PolarHBondContact O-N 3.44Å; G199-D201 VanDerWaalsContact O-N 3.1Å; G199-A202 WeakPolarHBondContact O-CB 3.42Å; G199-A202 PolarHBondContact O-N 2.8Å; G199-A202 VanDerWaalsContact O-N 3.14Å
200	L	93.5	Very high	92.6	Very high	98 Å²	98	65.5 Å²	65.5	51%	0.513	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-11.9	176.9	-64.4	172	0	0	0	113.7	K175 P186 A202	K175-L200 HydrophobicContact CB-CD2 4.29Å; K175-L200 WeakPolarHBondContact O-CD2 3.37Å; P186-L200 HydrophobicContact CG-CD2 3.51Å; P186-L200 HydrophobicContact CG-CG 4.13Å; L200-A202 VanDerWaalsContact C-N 3.35Å
201	D	90.1	Very high	92.5	Very high	76 Å²	76	61.3 Å²	61.3	41%	0.406	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	14.5	177.2	66.4	-31.9	0	0	0	113.1	G199 H203 L212	G199-D201 PolarHBondContact O-N 3.44Å; G199-D201 VanDerWaalsContact O-N 3.1Å; D201-H203 PolarHBondContact O-CD2 3.38Å; D201-H203 PolarHBondContact O-NE2 3.31Å; D201-L212 HydrophobicContact CB-CB 4.27Å; D201-L212 VanDerWaalsContact OD2-CB 3.3Å; D201-L212 WeakPolarHBondContact OD2-CB 3.39Å
202	A	93	Very high	92.1	Very high	14 Å²	14	63.6 Å²	63.6	12%	0.116	35%	0.352	C	S	.	.			trans	-65	143.6	173.3	0	0	0	0	0	112	I177 L198 G199 L200 Y210	I177-A202 HydrophobicContact CD1-CB 4.35Å; I177-A202 HydrophobicContact CG2-CB 3.85Å; L198-A202 HydrophobicContact CB-CB 4.03Å; L198-A202 HydrophobicContact CD1-CB 3.98Å; L198-A202 HydrophobicContact CD2-CB 4.35Å; L198-A202 HydrophobicContact CG-CB 4.36Å; G199-A202 WeakPolarHBondContact O-CB 3.42Å; G199-A202 PolarHBondContact O-N 2.8Å; G199-A202 VanDerWaalsContact O-N 3.14Å; L200-A202 VanDerWaalsContact C-N 3.35Å; A202-Y210 WeakPolarHBondContact CA-O 3.48Å
203	H	89.4	Confident	91.7	Very high	29 Å²	29	65 Å²	65	13%	0.134	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	133	179.3	-66.7	-61.1	0	0	0	111.5	D201 L209 Y210 F215 P229	D201-H203 PolarHBondContact O-CD2 3.38Å; D201-H203 PolarHBondContact O-NE2 3.31Å; H203-L209 WeakPolarHBondContact O-CA 3.19Å; H203-Y210 PolarHBondContact N-O 2.83Å; H203-Y210 PolarHBondContact O-N 3.05Å; H203-F215 HydrophobicContact CB-CB 4.19Å; H203-F215 HydrophobicContact CB-CD1 4.3Å; H203-F215 HydrophobicContact CB-CD2 3.24Å; H203-F215 HydrophobicContact CB-CE2 3.54Å; H203-F215 HydrophobicContact CB-CG 3.65Å; H203-F215 HydrophobicContact CB-CZ 4.25Å; H203-P229 WeakPolarHBondContact CE1-CD 3.44Å
204	E	91.3	Very high	91.5	Very high	84 Å²	84	61.1 Å²	61.1	39%	0.393	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	134.6	173.8	-170.8	-175.8	148.6	0	0	110.5	F179 M180 E208 L209	F179-E204 WeakPolarHBondContact CA-OE2 3.39Å; F179-E204 HydrophobicContact CD2-CG 4.13Å; F179-E204 HydrophobicContact CE2-CG 4.38Å; M180-E204 PolarHBondContact N-OE2 2.94Å; E204-E208 CarbonylContact C-O 3.58Å; E204-E208 VanDerWaalsContact CA-O 3.29Å; E204-E208 WeakPolarHBondContact CA-O 3.24Å; E204-L209 HydrophobicContact CB-CD2 4Å
205	R	85.4	Confident	91.1	Very high	102 Å²	102	58.8 Å²	58.8	39%	0.385	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	121	169.7	-167	175.5	69.6	146.8	2.3	110.7	G207 E208 Y210 F215 S218	R205-G207 VanDerWaalsContact C-N 3.25Å; R205-G207 PolarHBondContact O-N 3.13Å; R205-E208 PolarHBondContact N-O 3.28Å; R205-E208 PolarHBondContact O-N 3.3Å; R205-Y210 HydrophobicContact CB-CD2 4.11Å; R205-Y210 HydrophobicContact CB-CE2 3.81Å; R205-F215 HydrophobicContact CB-CD2 4.45Å; R205-F215 HydrophobicContact CB-CE2 3.91Å; R205-F215 HydrophobicContact CG-CE2 4.49Å; R205-S218 VanDerWaalsContact CZ-CB 3.42Å; R205-S218 PolarHBondContact NH1-OG 3.27Å; R205-S218 VanDerWaalsContact NH1-OG 3.1Å
206	G	85.9	Confident	90.3	Very high	84 Å²	84	55.6 Å²	55.6	87%	0.866	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	32.7	177	0	0	0	0	0	113.7	E208	G206-E208 VanDerWaalsContact C-N 3.34Å
207	G	89.3	Confident	89.6	Confident	31 Å²	31	60.4 Å²	60.4	32%	0.32	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	1.2	-178.5	0	0	0	0	0	115.3	F179 R205	F179-G207 VanDerWaalsContact CE2-O 3.29Å; F179-G207 WeakPolarHBondContact CE2-O 3Å; F179-G207 WeakPolarHBondContact CZ-O 3.3Å; R205-G207 VanDerWaalsContact C-N 3.25Å; R205-G207 PolarHBondContact O-N 3.13Å
208	E	93.5	Very high	88.3	Confident	81 Å²	81	56.6 Å²	56.6	38%	0.379	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	153.1	179.3	-62.3	-61.2	163.5	0	0	111.6	F192 E204 R205 G206 Y210	F192-E208 HydrophobicContact CB-CB 4.23Å; F192-E208 HydrophobicContact CD2-CB 4.22Å; F192-E208 HydrophobicContact CD2-CG 3.89Å; F192-E208 VanDerWaalsContact CD2-OE2 3.27Å; F192-E208 WeakPolarHBondContact CD2-OE2 3.25Å; F192-E208 HydrophobicContact CE2-CG 4.06Å; F192-E208 HydrophobicContact CG-CB 4.13Å; F192-E208 HydrophobicContact CG-CG 4.2Å; E204-E208 CarbonylContact C-O 3.58Å; E204-E208 VanDerWaalsContact CA-O 3.29Å; E204-E208 WeakPolarHBondContact CA-O 3.24Å; R205-E208 PolarHBondContact N-O 3.28Å; R205-E208 PolarHBondContact O-N 3.3Å; G206-E208 VanDerWaalsContact C-N 3.34Å; E208-Y210 HydrophobicContact CB-CE2 3.67Å; E208-Y210 WeakPolarHBondContact O-CE2 3.33Å
209	L	94.4	Very high	87.2	Confident	7 Å²	7	59.8 Å²	59.8	4%	0.037	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	135.6	178.2	-71.8	169.7	0	0	0	112.4	I177 F179 F189 F192 L198 H203 E204	I177-L209 HydrophobicContact CD1-CD1 3.88Å; F179-L209 HydrophobicContact CB-CD1 4.09Å; F179-L209 HydrophobicContact CB-CD2 4.42Å; F179-L209 HydrophobicContact CD1-CD1 4.17Å; F179-L209 HydrophobicContact CD2-CD1 3.74Å; F179-L209 HydrophobicContact CD2-CD2 3.8Å; F179-L209 HydrophobicContact CD2-CG 3.52Å; F179-L209 HydrophobicContact CE2-CD1 4.17Å; F179-L209 HydrophobicContact CE2-CD2 4.45Å; F179-L209 HydrophobicContact CE2-CG 3.78Å; F179-L209 HydrophobicContact CG-CD1 3.74Å; F179-L209 HydrophobicContact CG-CD2 4.35Å; F179-L209 HydrophobicContact CG-CG 4.06Å; F189-L209 HydrophobicContact CB-CD1 3.76Å; F189-L209 HydrophobicContact CD1-CD1 3.55Å; F189-L209 HydrophobicContact CD2-CD1 4.01Å; F189-L209 HydrophobicContact CE1-CD1 4.1Å; F189-L209 HydrophobicContact CE2-CD1 4.5Å; F189-L209 HydrophobicContact CG-CD1 3.48Å; F189-L209 VanDerWaalsContact CG-CD1 3.48Å; F192-L209 WeakPolarHBondContact CB-O 3.5Å; F192-L209 PolarHBondContact N-O 3.11Å; L198-L209 HydrophobicContact CD1-CB 3.45Å; L198-L209 VanDerWaalsContact CD1-CB 3.45Å; L198-L209 HydrophobicContact CD1-CD1 4.11Å; L198-L209 HydrophobicContact CD1-CG 4.34Å; H203-L209 WeakPolarHBondContact O-CA 3.19Å; E204-L209 HydrophobicContact CB-CD2 4Å
210	Y	92.8	Very high	86	Confident	19 Å²	19	60.5 Å²	60.5	8%	0.075	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	144.8	-178.7	-57.4	-99.9	0	0	0	110.1	F192 D193 A202 H203 R205 E208 C214 F215	F192-Y210 HydrophobicContact CB-CD1 4.41Å; F192-Y210 HydrophobicContact CB-CE1 4.11Å; F192-Y210 HydrophobicContact CD1-CE1 4.05Å; D193-Y210 WeakPolarHBondContact OD2-CD1 3.48Å; A202-Y210 WeakPolarHBondContact CA-O 3.48Å; H203-Y210 PolarHBondContact N-O 2.83Å; H203-Y210 PolarHBondContact O-N 3.05Å; R205-Y210 HydrophobicContact CB-CD2 4.11Å; R205-Y210 HydrophobicContact CB-CE2 3.81Å; E208-Y210 HydrophobicContact CB-CE2 3.67Å; E208-Y210 WeakPolarHBondContact O-CE2 3.33Å; Y210-C214 HydrophobicContact CD1-CB 4.34Å; Y210-F215 HydrophobicContact CD2-CD2 4.48Å
211	C	92.4	Very high	85.4	Confident	10 Å²	10	58 Å²	58	7%	0.068	33%	0.33	C	S	.	.			trans	-68.4	159.3	165.9	74.2	0	0	0	0	109.8	C191 L198 K213 C214 F215	C191-C211 HydrophobicContact CB-CB 4.08Å; C191-C211 PolarHBondContact SG-N 3.3Å; L198-C211 HydrophobicContact CD2-CB 3.77Å; C211-K213 PolarHBondContact O-N 3.34Å; C211-K213 VanDerWaalsContact O-N 3.1Å; C211-C214 PolarHBondContact O-N 3.01Å; C211-C214 VanDerWaalsContact O-N 3.12Å; C211-C214 PolarHBondContact SG-N 2.65Å; C211-C214 VanDerWaalsContact SG-N 3.42Å; C211-F215 WeakPolarHBondContact O-CB 3.31Å; C211-F215 PolarHBondContact O-N 3.03Å
212	L	87.8	Confident	84.6	Confident	49 Å²	49	55.9 Å²	55.9	26%	0.257	32%	0.319	S	S	.	.	H	α-helix	trans	-51.6	-38.8	-179.9	-177	64.9	0	0	0	113	D201 S216 I222	D201-L212 HydrophobicContact CB-CB 4.27Å; D201-L212 VanDerWaalsContact OD2-CB 3.3Å; D201-L212 WeakPolarHBondContact OD2-CB 3.39Å; L212-S216 VanDerWaalsContact O-CB 3.3Å; L212-S216 WeakPolarHBondContact O-CB 3.49Å; L212-S216 PolarHBondContact O-N 2.99Å; L212-S216 PolarHBondContact O-OG 3.44Å; L212-I222 HydrophobicContact CD1-CD1 3.86Å
213	K	86.6	Confident	84.2	Confident	153 Å²	153	55.2 Å²	55.2	67%	0.665	31%	0.313	S	S	*	.	H	α-helix	trans	-64.9	-51.6	178.7	-64.9	-180	-176.4	173.6	0	111.8	C211 S216 R217	C211-K213 PolarHBondContact O-N 3.34Å; C211-K213 VanDerWaalsContact O-N 3.1Å; K213-S216 PolarHBondContact O-N 3.02Å; K213-S216 PolarHBondContact O-OG 2.96Å; K213-R217 PolarHBondContact O-N 3.37Å
214	C	88.4	Confident	84	Confident	7 Å²	7	54.9 Å²	54.9	5%	0.047	31%	0.314	C	S	.	.	H	α-helix	trans	-67	-38.9	179.7	-66.5	0	0	0	0	111.8	D193 C194 Y210 C211 S216 R217	D193-C214 HydrophobicContact CB-CB 3.89Å; C194-C214 VanDerWaalsContact SG-SG 3.64Å; Y210-C214 HydrophobicContact CD1-CB 4.34Å; C211-C214 PolarHBondContact O-N 3.01Å; C211-C214 VanDerWaalsContact O-N 3.12Å; C211-C214 PolarHBondContact SG-N 2.65Å; C211-C214 VanDerWaalsContact SG-N 3.42Å; C214-S216 VanDerWaalsContact C-N 3.34Å; C214-S216 PolarHBondContact O-N 3.26Å; C214-R217 PolarHBondContact O-N 3.11Å
215	F	85.4	Confident	83.4	Confident	10 Å²	10	53.5 Å²	53.5	4%	0.044	32%	0.317	C	S	.	.	H	α-helix	trans	-61.1	-42.6	174.9	-167.4	-84.9	0	0	0	111.9	H203 R205 Y210 C211 R217 S218 V220 P229	H203-F215 HydrophobicContact CB-CB 4.19Å; H203-F215 HydrophobicContact CB-CD1 4.3Å; H203-F215 HydrophobicContact CB-CD2 3.24Å; H203-F215 HydrophobicContact CB-CE2 3.54Å; H203-F215 HydrophobicContact CB-CG 3.65Å; H203-F215 HydrophobicContact CB-CZ 4.25Å; R205-F215 HydrophobicContact CB-CD2 4.45Å; R205-F215 HydrophobicContact CB-CE2 3.91Å; R205-F215 HydrophobicContact CG-CE2 4.49Å; Y210-F215 HydrophobicContact CD2-CD2 4.48Å; C211-F215 WeakPolarHBondContact O-CB 3.31Å; C211-F215 PolarHBondContact O-N 3.03Å; F215-R217 PolarHBondContact O-N 3.42Å; F215-S218 VanDerWaalsContact O-CB 3.22Å; F215-S218 WeakPolarHBondContact O-CB 2.99Å; F215-S218 PolarHBondContact O-N 2.88Å; F215-S218 VanDerWaalsContact O-N 3.16Å; F215-S218 PolarHBondContact O-OG 2.83Å; F215-V220 HydrophobicContact CD1-CB 4.4Å; F215-V220 HydrophobicContact CE1-CB 3.65Å; F215-V220 HydrophobicContact CE1-CG1 3.66Å; F215-V220 HydrophobicContact CE1-CG2 4.02Å; F215-V220 HydrophobicContact CZ-CB 4.27Å; F215-V220 HydrophobicContact CZ-CG1 4.14Å; F215-V220 HydrophobicContact CZ-CG2 4.19Å; F215-P229 HydrophobicContact CD1-CG 3.91Å; F215-P229 HydrophobicContact CE1-CB 3.59Å; F215-P229 HydrophobicContact CE1-CG 3.16Å; F215-P229 HydrophobicContact CE2-CG 4.4Å; F215-P229 HydrophobicContact CZ-CB 3.84Å; F215-P229 HydrophobicContact CZ-CG 3.44Å; F215-P229 VanDerWaalsContact CZ-CG 3.44Å
216	S	78	Confident	83.1	Confident	57 Å²	57	50.5 Å²	50.5	40%	0.399	31%	0.311	S	S	.	.	H	α-helix	trans	-64	-35.8	178.4	73.7	0	0	0	0	113.6	L212 K213 C214 S218 G219	L212-S216 VanDerWaalsContact O-CB 3.3Å; L212-S216 WeakPolarHBondContact O-CB 3.49Å; L212-S216 PolarHBondContact O-N 2.99Å; L212-S216 PolarHBondContact O-OG 3.44Å; K213-S216 PolarHBondContact O-N 3.02Å; K213-S216 PolarHBondContact O-OG 2.96Å; C214-S216 VanDerWaalsContact C-N 3.34Å; C214-S216 PolarHBondContact O-N 3.26Å; S216-S218 PolarHBondContact O-N 3.44Å; S216-S218 VanDerWaalsContact O-N 3.1Å; S216-G219 PolarHBondContact O-N 3.36Å
217	R	78.5	Confident	82.7	Confident	208 Å²	208	53.8 Å²	53.8	79%	0.785	30%	0.297	S	S	*	.	H	α-helix	trans	-63.3	-15.7	176.1	-74.5	174.1	63.2	-162.1	-0.9	113.4	K213 C214 F215 G219	K213-R217 PolarHBondContact O-N 3.37Å; C214-R217 PolarHBondContact O-N 3.11Å; F215-R217 PolarHBondContact O-N 3.42Å; R217-G219 PolarHBondContact O-N 3.4Å
218	S	70.7	Confident	81.8	Confident	37 Å²	37	60.4 Å²	60.4	26%	0.259	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	2.7	-175.1	87.6	0	0	0	0	114.8	R205 F215 S216	R205-S218 VanDerWaalsContact CZ-CB 3.42Å; R205-S218 PolarHBondContact NH1-OG 3.27Å; R205-S218 VanDerWaalsContact NH1-OG 3.1Å; F215-S218 VanDerWaalsContact O-CB 3.22Å; F215-S218 WeakPolarHBondContact O-CB 2.99Å; F215-S218 PolarHBondContact O-N 2.88Å; F215-S218 VanDerWaalsContact O-N 3.16Å; F215-S218 PolarHBondContact O-OG 2.83Å; S216-S218 PolarHBondContact O-N 3.44Å; S216-S218 VanDerWaalsContact O-N 3.1Å
219	G	71.5	Confident	80.8	Confident	70 Å²	70	58.1 Å²	58.1	72%	0.722	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.4	2.2	176.2	0	0	0	0	0	114.7	S216 R217	S216-G219 PolarHBondContact O-N 3.36Å; R217-G219 PolarHBondContact O-N 3.4Å
220	V	68.7	Low	79.9	Confident	45 Å²	45	58.4 Å²	58.4	27%	0.273	31%	0.307	S	S	.	.			trans	-79.3	130.3	178.7	-175.2	0	0	0	0	110.4	F215 P229	F215-V220 HydrophobicContact CD1-CB 4.4Å; F215-V220 HydrophobicContact CE1-CB 3.65Å; F215-V220 HydrophobicContact CE1-CG1 3.66Å; F215-V220 HydrophobicContact CE1-CG2 4.02Å; F215-V220 HydrophobicContact CZ-CB 4.27Å; F215-V220 HydrophobicContact CZ-CG1 4.14Å; F215-V220 HydrophobicContact CZ-CG2 4.19Å; V220-P229 HydrophobicContact CG1-CB 3.84Å
221	S	80	Confident	78.9	Confident	44 Å²	44	65.5 Å²	65.5	31%	0.308	35%	0.346	S	S	.	.			trans	-71.2	130.7	178.1	-69.2	0	0	0	0	111.2	I230	S221-I230 PolarHBondContact O-N 3.39Å
222	I	73.3	Confident	78.2	Confident	33 Å²	33	68 Å²	68	17%	0.169	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-108.7	126.4	-178.3	-61.7	176.4	0	0	0	109.9	L212 S224 R227 V241	L212-I222 HydrophobicContact CD1-CD1 3.86Å; I222-S224 PolarHBondContact O-N 3.25Å; I222-R227 WeakPolarHBondContact CG2-O 3.38Å; I222-V241 WeakPolarHBondContact O-CG2 3.42Å
223	C	84.6	Confident	77.9	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	40%	0.398	C	S	.	.			trans	-63.8	131.1	-179.9	174.1	0	0	0	0	112.2	A225 C226 R227 R228 I230 H243 H246	C223-A225 VanDerWaalsContact C-N 3.25Å; C223-A225 PolarHBondContact O-N 3.12Å; C223-A225 PolarHBondContact SG-N 2.93Å; C223-C226 VanDerWaalsContact CB-SG 3.58Å; C223-C226 VanDerWaalsContact SG-SG 3.69Å; C223-R227 VanDerWaalsContact O-CA 3.24Å; C223-R227 WeakPolarHBondContact O-CA 3.37Å; C223-R227 PolarHBondContact O-N 2.99Å; C223-R228 PolarHBondContact N-O 3.4Å; C223-I230 HydrophobicContact CB-CD1 4.02Å; C223-I230 HydrophobicContact CB-CG1 3.79Å; C223-H243 WeakPolarHBondContact CB-ND1 3.47Å; C223-H243 PolarHBondContact SG-N 3.23Å; C223-H243 VanDerWaalsContact SG-N 3.39Å; C223-H243 PolarHBondContact SG-ND1 3.05Å; C223-H243 VanDerWaalsContact SG-ND1 3.4Å; C223-H246 PolarHBondContact SG-ND1 2.91Å; C223-H246 VanDerWaalsContact SG-ND1 3.38Å
224	S	85.8	Confident	77.9	Confident	21 Å²	21	72.1 Å²	72.1	15%	0.147	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-15.9	-177.5	-64.1	0	0	0	0	114.8	I222 R227 K240 V241	I222-S224 PolarHBondContact O-N 3.25Å; S224-R227 VanDerWaalsContact O-CZ 3.31Å; S224-R227 PolarHBondContact O-NH1 2.83Å; S224-R227 VanDerWaalsContact O-NH1 3.12Å; S224-K240 WeakPolarHBondContact OG-CB 3.26Å; S224-V241 WeakPolarHBondContact CB-O 3.35Å; S224-V241 PolarHBondContact N-O 3.21Å; S224-V241 PolarHBondContact OG-O 2.92Å
225	A	79.2	Confident	78	Confident	55 Å²	55	73.5 Å²	73.5	46%	0.455	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-59.2	175.6	0	0	0	0	0	112.1	C223 W242 H246	C223-A225 VanDerWaalsContact C-N 3.25Å; C223-A225 PolarHBondContact O-N 3.12Å; C223-A225 PolarHBondContact SG-N 2.93Å; A225-W242 HydrophobicContact CB-CE3 3.94Å; A225-W242 HydrophobicContact CB-CZ3 3.94Å; A225-H246 HydrophobicContact CB-CB 3.75Å
226	C	79.1	Confident	78.2	Confident	39 Å²	39	81.8 Å²	81.8	26%	0.264	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-6.8	-172.2	67.8	0	0	0	0	114.7	C223 R228 H243 H246	C223-C226 VanDerWaalsContact CB-SG 3.58Å; C223-C226 VanDerWaalsContact SG-SG 3.69Å; C226-R228 HydrophobicContact CB-CG 4.43Å; C226-R228 PolarHBondContact O-N 3.14Å; C226-R228 VanDerWaalsContact O-N 3.14Å; C226-R228 PolarHBondContact SG-N 3.36Å; C226-R228 VanDerWaalsContact SG-N 3.44Å; C226-H243 VanDerWaalsContact SG-CE1 3.53Å; C226-H243 PolarHBondContact SG-ND1 3.25Å; C226-H243 VanDerWaalsContact SG-ND1 3.36Å; C226-H246 VanDerWaalsContact CB-CE1 3.45Å; C226-H246 WeakPolarHBondContact CB-CE1 3.45Å; C226-H246 PolarHBondContact SG-CE1 3.46Å; C226-H246 PolarHBondContact SG-ND1 3.29Å; C226-H246 VanDerWaalsContact SG-ND1 3.39Å
227	R	77.1	Confident	78.8	Confident	153 Å²	153	79.4 Å²	79.4	58%	0.577	41%	0.409	S	S	*	.			trans	59.1	17.8	-174.8	-51.1	-60.3	-178	-156.2	-5.9	114.9	I222 C223 S224	I222-R227 WeakPolarHBondContact CG2-O 3.38Å; C223-R227 VanDerWaalsContact O-CA 3.24Å; C223-R227 WeakPolarHBondContact O-CA 3.37Å; C223-R227 PolarHBondContact O-N 2.99Å; S224-R227 VanDerWaalsContact O-CZ 3.31Å; S224-R227 PolarHBondContact O-NH1 2.83Å; S224-R227 VanDerWaalsContact O-NH1 3.12Å
228	R	70.6	Confident	79.4	Confident	170 Å²	170	71.4 Å²	71.4	64%	0.642	38%	0.382	S	S	*	.			trans	-95.5	151.8	175.3	-60.2	-179.6	-178.8	165.9	-0.9	111.5	C223 C226	C223-R228 PolarHBondContact N-O 3.4Å; C226-R228 HydrophobicContact CB-CG 4.43Å; C226-R228 PolarHBondContact O-N 3.14Å; C226-R228 VanDerWaalsContact O-N 3.14Å; C226-R228 PolarHBondContact SG-N 3.36Å; C226-R228 VanDerWaalsContact SG-N 3.44Å
229	P	71.1	Confident	80.2	Confident	33 Å²	33	72.8 Å²	72.8	21%	0.214	40%	0.401	C	S	.	.	B	Isolated β-bridge	trans	-55.1	138.2	170.5	-25.6	36.4	0	0	0	111.1	H203 F215 V220 H243	H203-P229 WeakPolarHBondContact CE1-CD 3.44Å; F215-P229 HydrophobicContact CD1-CG 3.91Å; F215-P229 HydrophobicContact CE1-CB 3.59Å; F215-P229 HydrophobicContact CE1-CG 3.16Å; F215-P229 HydrophobicContact CE2-CG 4.4Å; F215-P229 HydrophobicContact CZ-CB 3.84Å; F215-P229 HydrophobicContact CZ-CG 3.44Å; F215-P229 VanDerWaalsContact CZ-CG 3.44Å; V220-P229 HydrophobicContact CG1-CB 3.84Å; P229-H243 PolarHBondContact O-NE2 3.25Å
230	I	75.3	Confident	81	Confident	14 Å²	14	74.7 Å²	74.7	7%	0.072	39%	0.39	C	S	.	.			trans	-92.7	112	173.7	-56.1	163.6	0	0	0	107.9	S221 C223 R233 I234 V241 W242 H243	S221-I230 PolarHBondContact O-N 3.39Å; C223-I230 HydrophobicContact CB-CD1 4.02Å; C223-I230 HydrophobicContact CB-CG1 3.79Å; I230-R233 WeakPolarHBondContact CG2-O 3.16Å; I230-I234 HydrophobicContact CB-CG2 4.18Å; I230-I234 HydrophobicContact CD1-CG2 4.1Å; I230-I234 HydrophobicContact CG2-CG2 3.78Å; I230-V241 HydrophobicContact CD1-CB 4.18Å; I230-W242 VanDerWaalsContact CD1-C 3.43Å; I230-W242 WeakPolarHBondContact CD1-O 3.47Å; I230-H243 WeakPolarHBondContact CA-NE2 3.48Å
231	D	73.3	Confident	82	Confident	167 Å²	167	73.7 Å²	73.7	89%	0.893	38%	0.384	S	S	*	.			trans	-92.3	123.7	168.7	-157.9	-0.3	0	0	0	109
232	G	77.9	Confident	82.5	Confident	62 Å²	62	73.3 Å²	73.3	64%	0.639	38%	0.375	S	S	*	.	S	Bend	trans	87.5	-130.5	-176.8	0	0	0	0	0	115.5
233	R	81.6	Confident	82.8	Confident	211 Å²	211	72.9 Å²	72.9	80%	0.796	37%	0.373	S	S	*	.			trans	-74.7	131.7	-168.3	-72.9	-173.1	-70.1	179.3	-2.6	111.9	I230 V244	I230-R233 WeakPolarHBondContact CG2-O 3.16Å; R233-V244 HydrophobicContact CB-CG2 4.09Å
234	I	86.7	Confident	82.9	Confident	79 Å²	79	74.6 Å²	74.6	41%	0.405	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	146.9	176.1	64	179.1	0	0	0	111.1	I230	I230-I234 HydrophobicContact CB-CG2 4.18Å; I230-I234 HydrophobicContact CD1-CG2 4.1Å; I230-I234 HydrophobicContact CG2-CG2 3.78Å
235	V	89.2	Confident	82.8	Confident	35 Å²	35	78.4 Å²	78.4	21%	0.212	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	123.2	162.5	176.8	0	0	0	0	108.5	A237 V241 W242 V244 F247	V235-A237 HydrophobicContact CG1-CB 4.19Å; V235-V241 CarbonylContact O-C 3.56Å; V235-V241 WeakPolarHBondContact O-CA 3.49Å; V235-W242 HydrophobicContact CB-CB 4.33Å; V235-W242 PolarHBondContact N-O 2.98Å; V235-W242 PolarHBondContact O-N 3.29Å; V235-V244 HydrophobicContact CG2-CB 4.36Å; V235-V244 HydrophobicContact CG2-CG2 4.02Å; V235-F247 HydrophobicContact CB-CB 4.42Å; V235-F247 HydrophobicContact CG1-CB 4.13Å; V235-F247 HydrophobicContact CG1-CD1 3.76Å; V235-F247 HydrophobicContact CG1-CE1 4.39Å; V235-F247 HydrophobicContact CG1-CG 3.94Å
236	W	90.6	Very high	83.1	Confident	185 Å²	185	78.8 Å²	78.8	70%	0.701	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	110.5	170.7	-108.4	82.5	0	0	0	109.2	K240 V241	W236-K240 WeakPolarHBondContact CA-O 3.42Å; W236-V241 VanDerWaalsContact CD1-CG1 3.41Å; W236-V241 HydrophobicContact CD2-CG1 4.39Å; W236-V241 HydrophobicContact CG-CG1 4.19Å; W236-V241 HydrophobicContact CZ2-CG1 4.43Å
237	A	90.6	Very high	83.7	Confident	7 Å²	7	77.4 Å²	77.4	6%	0.058	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	148.1	179.9	0	0	0	0	0	110.9	V235 G239 K240 W242 F247 F261	V235-A237 HydrophobicContact CG1-CB 4.19Å; A237-G239 PolarHBondContact O-N 3.38Å; A237-K240 PolarHBondContact N-O 3Å; A237-K240 PolarHBondContact O-N 3.39Å; A237-W242 PolarHBondContact O-NE1 3.36Å; A237-F247 HydrophobicContact CB-CD1 4.4Å; A237-F247 HydrophobicContact CB-CD2 4.14Å; A237-F247 HydrophobicContact CB-CE1 3.78Å; A237-F247 HydrophobicContact CB-CE2 3.49Å; A237-F247 VanDerWaalsContact CB-CE2 3.49Å; A237-F247 HydrophobicContact CB-CZ 3.28Å; A237-F261 HydrophobicContact CB-CE1 4.23Å; A237-F261 HydrophobicContact CB-CZ 3.86Å
238	L	89.6	Confident	84	Confident	40 Å²	40	72.2 Å²	72.2	21%	0.209	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	55	36.4	-179.1	-49.7	174.9	0	0	0	112.8	K240 F247 F261 E263 A268	L238-K240 PolarHBondContact O-N 3.24Å; L238-F247 HydrophobicContact CD1-CE2 4.12Å; L238-F247 HydrophobicContact CG-CE2 4.35Å; L238-F261 HydrophobicContact CD2-CE2 4.32Å; L238-E263 HydrophobicContact CD2-CB 3.98Å; L238-E263 HydrophobicContact CD2-CG 3.52Å; L238-E263 VanDerWaalsContact CD2-OE2 3.3Å; L238-E263 WeakPolarHBondContact CD2-OE2 3.43Å; L238-A268 HydrophobicContact CD1-CB 4.04Å
239	G	88.1	Confident	84.6	Confident	65 Å²	65	64.2 Å²	64.2	67%	0.67	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	17.3	-176.6	0	0	0	0	0	115	A237	A237-G239 PolarHBondContact O-N 3.38Å
240	K	89.6	Confident	85.5	Confident	110 Å²	110	67.4 Å²	67.4	48%	0.478	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	156.5	-170.7	-76.3	171.9	-171.5	171.5	0	111.2	S224 W236 A237 L238 W242	S224-K240 WeakPolarHBondContact OG-CB 3.26Å; W236-K240 WeakPolarHBondContact CA-O 3.42Å; A237-K240 PolarHBondContact N-O 3Å; A237-K240 PolarHBondContact O-N 3.39Å; L238-K240 PolarHBondContact O-N 3.24Å; K240-W242 HydrophobicContact CB-CZ2 3.79Å; K240-W242 HydrophobicContact CD-CH2 4.27Å; K240-W242 HydrophobicContact CD-CZ2 3.74Å; K240-W242 HydrophobicContact CG-CZ2 4.42Å; K240-W242 VanDerWaalsContact O-CD1 3.3Å; K240-W242 PolarHBondContact O-NE1 2.92Å
241	V	88.3	Confident	85.5	Confident	24 Å²	24	71.7 Å²	71.7	15%	0.145	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	140.1	172.6	-81.4	0	0	0	0	111.4	I222 S224 I230 V235 W236	I222-V241 WeakPolarHBondContact O-CG2 3.42Å; S224-V241 WeakPolarHBondContact CB-O 3.35Å; S224-V241 PolarHBondContact N-O 3.21Å; S224-V241 PolarHBondContact OG-O 2.92Å; I230-V241 HydrophobicContact CD1-CB 4.18Å; V235-V241 CarbonylContact O-C 3.56Å; V235-V241 WeakPolarHBondContact O-CA 3.49Å; W236-V241 VanDerWaalsContact CD1-CG1 3.41Å; W236-V241 HydrophobicContact CD2-CG1 4.39Å; W236-V241 HydrophobicContact CG-CG1 4.19Å; W236-V241 HydrophobicContact CZ2-CG1 4.43Å
242	W	90.1	Very high	85.6	Confident	36 Å²	36	65.7 Å²	65.7	14%	0.136	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	150.7	-176.3	-46.1	82.4	0	0	0	111.4	A225 I230 V235 A237 K240 F247	A225-W242 HydrophobicContact CB-CE3 3.94Å; A225-W242 HydrophobicContact CB-CZ3 3.94Å; I230-W242 VanDerWaalsContact CD1-C 3.43Å; I230-W242 WeakPolarHBondContact CD1-O 3.47Å; V235-W242 HydrophobicContact CB-CB 4.33Å; V235-W242 PolarHBondContact N-O 2.98Å; V235-W242 PolarHBondContact O-N 3.29Å; A237-W242 PolarHBondContact O-NE1 3.36Å; K240-W242 HydrophobicContact CB-CZ2 3.79Å; K240-W242 HydrophobicContact CD-CH2 4.27Å; K240-W242 HydrophobicContact CD-CZ2 3.74Å; K240-W242 HydrophobicContact CG-CZ2 4.42Å; K240-W242 VanDerWaalsContact O-CD1 3.3Å; K240-W242 PolarHBondContact O-NE1 2.92Å; W242-F247 HydrophobicContact CB-CB 3.97Å; W242-F247 AromaticContact CD1-CD2 3.87Å; W242-F247 AromaticContact CD2-CD2 3.97Å; W242-F247 HydrophobicContact CD2-CD2 3.97Å; W242-F247 HydrophobicContact CG-CB 4.21Å; W242-F247 AromaticContact CG-CD2 3.92Å; W242-F247 HydrophobicContact CG-CD2 3.92Å; W242-F247 HydrophobicContact CG-CG 4.4Å; W242-F247 AromaticContact NE1-CD2 3.93Å
243	H	81.2	Confident	85.9	Confident	24 Å²	24	70 Å²	70	11%	0.111	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	148.6	157.3	-70.8	109.6	0	0	0	109.2	C223 C226 P229 I230 E245 H246 F247	C223-H243 WeakPolarHBondContact CB-ND1 3.47Å; C223-H243 PolarHBondContact SG-N 3.23Å; C223-H243 VanDerWaalsContact SG-N 3.39Å; C223-H243 PolarHBondContact SG-ND1 3.05Å; C223-H243 VanDerWaalsContact SG-ND1 3.4Å; C226-H243 VanDerWaalsContact SG-CE1 3.53Å; C226-H243 PolarHBondContact SG-ND1 3.25Å; C226-H243 VanDerWaalsContact SG-ND1 3.36Å; P229-H243 PolarHBondContact O-NE2 3.25Å; I230-H243 WeakPolarHBondContact CA-NE2 3.48Å; H243-E245 HydrophobicContact CB-CG 4.36Å; H243-E245 WeakPolarHBondContact CB-OE1 3.49Å; H243-E245 IonicContact CD2-OE1 3.97Å; H243-E245 IonicContact CG-OE1 3.02Å; H243-E245 PolarHBondContact O-N 3.16Å; H243-H246 HydrophobicContact CB-CB 4.03Å; H243-H246 AromaticContact CG-ND1 3.78Å; H243-H246 AromaticContact ND1-CE1 3.61Å; H243-H246 AromaticContact ND1-ND1 3.25Å; H243-H246 PolarHBondContact ND1-ND1 2.92Å; H243-H246 PolarHBondContact O-N 3.27Å; H243-F247 PolarHBondContact O-N 3.3Å
244	V	86.9	Confident	85.4	Confident	37 Å²	37	65.2 Å²	65.2	22%	0.224	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-41.3	-179.6	178.1	0	0	0	0	111.1	R233 V235	R233-V244 HydrophobicContact CB-CG2 4.09Å; V235-V244 HydrophobicContact CG2-CB 4.36Å; V235-V244 HydrophobicContact CG2-CG2 4.02Å
245	E	83.3	Confident	84.9	Confident	101 Å²	101	63.2 Å²	63.2	47%	0.472	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-20	179.3	65.7	-82.2	-172.5	0	0	114.1	H243 V248 P255	H243-E245 HydrophobicContact CB-CG 4.36Å; H243-E245 WeakPolarHBondContact CB-OE1 3.49Å; H243-E245 IonicContact CD2-OE1 3.97Å; H243-E245 IonicContact CG-OE1 3.02Å; H243-E245 PolarHBondContact O-N 3.16Å; E245-V248 WeakPolarHBondContact O-CG1 3.39Å; E245-P255 WeakPolarHBondContact O-CG 3.45Å
246	H	84	Confident	84.5	Confident	62 Å²	62	62.1 Å²	62.1	29%	0.287	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-10.7	179.3	-67.5	161.6	0	0	0	113.8	C223 A225 C226 H243 V248	C223-H246 PolarHBondContact SG-ND1 2.91Å; C223-H246 VanDerWaalsContact SG-ND1 3.38Å; A225-H246 HydrophobicContact CB-CB 3.75Å; C226-H246 VanDerWaalsContact CB-CE1 3.45Å; C226-H246 WeakPolarHBondContact CB-CE1 3.45Å; C226-H246 PolarHBondContact SG-CE1 3.46Å; C226-H246 PolarHBondContact SG-ND1 3.29Å; C226-H246 VanDerWaalsContact SG-ND1 3.39Å; H243-H246 HydrophobicContact CB-CB 4.03Å; H243-H246 AromaticContact CG-ND1 3.78Å; H243-H246 AromaticContact ND1-CE1 3.61Å; H243-H246 AromaticContact ND1-ND1 3.25Å; H243-H246 PolarHBondContact ND1-ND1 2.92Å; H243-H246 PolarHBondContact O-N 3.27Å; H246-V248 PolarHBondContact O-N 2.98Å; H246-V248 VanDerWaalsContact O-N 3.16Å
247	F	92.4	Very high	84	Confident	11 Å²	11	60 Å²	60	5%	0.048	31%	0.314	C	S	.	.			trans	-82.7	92.3	170.5	-168.1	-118.6	0	0	0	109.3	V235 A237 L238 W242 H243 F256 F261 A268	V235-F247 HydrophobicContact CB-CB 4.42Å; V235-F247 HydrophobicContact CG1-CB 4.13Å; V235-F247 HydrophobicContact CG1-CD1 3.76Å; V235-F247 HydrophobicContact CG1-CE1 4.39Å; V235-F247 HydrophobicContact CG1-CG 3.94Å; A237-F247 HydrophobicContact CB-CD1 4.4Å; A237-F247 HydrophobicContact CB-CD2 4.14Å; A237-F247 HydrophobicContact CB-CE1 3.78Å; A237-F247 HydrophobicContact CB-CE2 3.49Å; A237-F247 VanDerWaalsContact CB-CE2 3.49Å; A237-F247 HydrophobicContact CB-CZ 3.28Å; L238-F247 HydrophobicContact CD1-CE2 4.12Å; L238-F247 HydrophobicContact CG-CE2 4.35Å; W242-F247 HydrophobicContact CB-CB 3.97Å; W242-F247 AromaticContact CD1-CD2 3.87Å; W242-F247 AromaticContact CD2-CD2 3.97Å; W242-F247 HydrophobicContact CD2-CD2 3.97Å; W242-F247 HydrophobicContact CG-CB 4.21Å; W242-F247 AromaticContact CG-CD2 3.92Å; W242-F247 HydrophobicContact CG-CD2 3.92Å; W242-F247 HydrophobicContact CG-CG 4.4Å; W242-F247 AromaticContact NE1-CD2 3.93Å; H243-F247 PolarHBondContact O-N 3.3Å; F247-F256 HydrophobicContact CD1-CB 4.33Å; F247-F256 AromaticContact CD1-CD2 3.45Å; F247-F256 HydrophobicContact CD1-CD2 3.45Å; F247-F256 VanDerWaalsContact CD1-CD2 3.45Å; F247-F256 HydrophobicContact CD1-CE2 4.19Å; F247-F256 HydrophobicContact CD1-CG 4.28Å; F247-F256 AromaticContact CE1-CD2 3.51Å; F247-F256 HydrophobicContact CE1-CD2 3.51Å; F247-F256 AromaticContact CE1-CE2 3.93Å; F247-F256 HydrophobicContact CE1-CE2 3.93Å; F247-F256 HydrophobicContact CE1-CG 4.34Å; F247-F256 HydrophobicContact CG-CD2 4.13Å; F247-F256 HydrophobicContact CZ-CD2 4.23Å; F247-F256 HydrophobicContact CZ-CE2 4.21Å; F247-F256 WeakPolarHBondContact O-CD2 3.35Å; F247-F256 PolarHBondContact O-N 3.43Å; F247-F261 HydrophobicContact CE1-CB 4.25Å; F247-F261 AromaticContact CE1-CD1 3.49Å; F247-F261 HydrophobicContact CE1-CD1 3.49Å; F247-F261 VanDerWaalsContact CE1-CD1 3.49Å; F247-F261 HydrophobicContact CE1-CD2 4.17Å; F247-F261 AromaticContact CE1-CE1 3.75Å; F247-F261 HydrophobicContact CE1-CE1 3.75Å; F247-F261 HydrophobicContact CE1-CE2 4.4Å; F247-F261 AromaticContact CE1-CG 3.7Å; F247-F261 HydrophobicContact CE1-CG 3.7Å; F247-F261 HydrophobicContact CE1-CZ 4.21Å; F247-F261 AromaticContact CZ-CD1 3.92Å; F247-F261 HydrophobicContact CZ-CD1 3.92Å; F247-F261 AromaticContact CZ-CD2 3.78Å; F247-F261 HydrophobicContact CZ-CD2 3.78Å; F247-F261 AromaticContact CZ-CE1 3.97Å; F247-F261 HydrophobicContact CZ-CE1 3.97Å; F247-F261 AromaticContact CZ-CE2 3.85Å; F247-F261 HydrophobicContact CZ-CE2 3.85Å; F247-F261 AromaticContact CZ-CG 3.81Å; F247-F261 HydrophobicContact CZ-CG 3.81Å; F247-F261 AromaticContact CZ-CZ 3.94Å; F247-F261 HydrophobicContact CZ-CZ 3.94Å; F247-A268 HydrophobicContact CE1-CB 4.48Å; F247-A268 HydrophobicContact CE2-CB 3.81Å; F247-A268 HydrophobicContact CZ-CB 3.58Å
248	V	83.5	Confident	83.3	Confident	44 Å²	44	63.4 Å²	63.4	27%	0.267	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-117.3	159.1	-170.7	-52.9	0	0	0	0	112.3	E245 H246 H250 E253 I254 P255 F256	E245-V248 WeakPolarHBondContact O-CG1 3.39Å; H246-V248 PolarHBondContact O-N 2.98Å; H246-V248 VanDerWaalsContact O-N 3.16Å; V248-H250 PolarHBondContact O-N 3.35Å; V248-E253 WeakPolarHBondContact CB-O 3.3Å; V248-E253 WeakPolarHBondContact CG1-O 3.21Å; V248-I254 WeakPolarHBondContact CA-O 3.35Å; V248-P255 HydrophobicContact CG1-CB 4.18Å; V248-P255 HydrophobicContact CG1-CG 3.96Å; V248-F256 VanDerWaalsContact O-CE2 3.32Å; V248-F256 WeakPolarHBondContact O-CE2 3.32Å
249	C	83.7	Confident	82.5	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.007	36%	0.364	C	S	.	.			trans	-63.8	128.9	167.3	173.3	0	0	0	0	110.1	H251 C252 E253 I254 F256 A268 C270 H273	C249-H251 PolarHBondContact O-N 2.88Å; C249-H251 VanDerWaalsContact O-N 3.1Å; C249-H251 PolarHBondContact SG-N 3.39Å; C249-C252 VanDerWaalsContact CB-SG 3.53Å; C249-C252 VanDerWaalsContact SG-SG 3.64Å; C249-E253 WeakPolarHBondContact O-CA 3.37Å; C249-E253 PolarHBondContact O-N 2.8Å; C249-I254 PolarHBondContact N-O 3.06Å; C249-F256 HydrophobicContact CB-CE1 4.25Å; C249-F256 HydrophobicContact CB-CZ 3.85Å; C249-A268 CarbonylContact C-O 3.51Å; C249-A268 WeakPolarHBondContact CA-O 3.22Å; C249-C270 HydrophobicContact CB-CB 4.28Å; C249-C270 PolarHBondContact SG-N 3.22Å; C249-H273 PolarHBondContact SG-ND1 3.44Å; C249-H273 VanDerWaalsContact SG-ND1 3.38Å
250	H	89.8	Confident	82.3	Confident	101 Å²	101	71.6 Å²	71.6	47%	0.468	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-20.8	-179.2	-172.7	65.2	0	0	0	114.1	V248 H267 A268 Y269	V248-H250 PolarHBondContact O-N 3.35Å; H250-H267 HydrophobicContact CB-CB 3.92Å; H250-H267 AromaticContact CD2-CG 3.93Å; H250-H267 AromaticContact CE1-CE1 3.81Å; H250-H267 AromaticContact CE1-ND1 3.7Å; H250-H267 AromaticContact CG-CG 3.9Å; H250-H267 AromaticContact CG-ND1 3.9Å; H250-H267 AromaticContact ND1-ND1 3.6Å; H250-A268 WeakPolarHBondContact CB-O 3.39Å; H250-A268 PolarHBondContact N-O 2.63Å; H250-Y269 HydrophobicContact CB-CD1 4.45Å; H250-Y269 HydrophobicContact CB-CE1 4.07Å; H250-Y269 AromaticContact CD2-CZ 3.96Å; H250-Y269 PolarHBondContact CD2-OH 3.26Å
251	H	75.7	Confident	82.3	Confident	104 Å²	104	70 Å²	70	48%	0.481	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-44	-179.4	-171.6	14.7	0	0	0	113.9	C249 Y269 H273	C249-H251 PolarHBondContact O-N 2.88Å; C249-H251 VanDerWaalsContact O-N 3.1Å; C249-H251 PolarHBondContact SG-N 3.39Å; H251-Y269 HydrophobicContact CB-CD1 4.1Å; H251-Y269 HydrophobicContact CB-CE1 4.11Å; H251-H273 HydrophobicContact CB-CB 3.88Å; H251-H273 AromaticContact CD2-CD2 3.2Å; H251-H273 PolarHBondContact CD2-CD2 3.17Å; H251-H273 AromaticContact CD2-CG 3.45Å; H251-H273 VanDerWaalsContact CD2-CG 3.45Å; H251-H273 AromaticContact CD2-NE2 3.78Å; H251-H273 AromaticContact CG-CD2 4Å; H251-H273 AromaticContact CG-CG 3.89Å
252	C	75.6	Confident	82.3	Confident	41 Å²	41	72 Å²	72	28%	0.277	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-3.7	-177.8	59.6	0	0	0	0	114.8	C249 I254 H273	C249-C252 VanDerWaalsContact CB-SG 3.53Å; C249-C252 VanDerWaalsContact SG-SG 3.64Å; C252-I254 HydrophobicContact CB-CD1 4.24Å; C252-I254 HydrophobicContact CB-CG1 4.15Å; C252-I254 PolarHBondContact O-N 2.99Å; C252-H273 WeakPolarHBondContact CB-CE1 3.29Å; C252-H273 PolarHBondContact SG-CE1 3.48Å; C252-H273 PolarHBondContact SG-ND1 3.38Å; C252-H273 VanDerWaalsContact SG-ND1 3.44Å
253	E	82.7	Confident	82.4	Confident	152 Å²	152	75.7 Å²	75.7	71%	0.71	39%	0.386	S	S	*	.			trans	60.2	12.7	178.6	-53.8	-177	166.8	0	0	114.4	V248 C249	V248-E253 WeakPolarHBondContact CB-O 3.3Å; V248-E253 WeakPolarHBondContact CG1-O 3.21Å; C249-E253 WeakPolarHBondContact O-CA 3.37Å; C249-E253 PolarHBondContact O-N 2.8Å
254	I	70.8	Confident	82.6	Confident	110 Å²	110	78.3 Å²	78.3	56%	0.564	40%	0.395	S	S	*	.			trans	-75.8	128.2	174.8	-59.1	175.6	0	0	0	109	V248 C249 C252	V248-I254 WeakPolarHBondContact CA-O 3.35Å; C249-I254 PolarHBondContact N-O 3.06Å; C252-I254 HydrophobicContact CB-CD1 4.24Å; C252-I254 HydrophobicContact CB-CG1 4.15Å; C252-I254 PolarHBondContact O-N 2.99Å
255	P	77.5	Confident	82.6	Confident	38 Å²	38	83.5 Å²	83.5	25%	0.247	42%	0.417	C	S	.	.	B	Isolated β-bridge	trans	-63.1	140.7	176.1	-20.3	31.5	0	0	0	113	E245 V248 M257	E245-P255 WeakPolarHBondContact O-CG 3.45Å; V248-P255 HydrophobicContact CG1-CB 4.18Å; V248-P255 HydrophobicContact CG1-CG 3.96Å; P255-M257 HydrophobicContact CB-CE 4Å; P255-M257 HydrophobicContact CB-CG 3.89Å; P255-M257 HydrophobicContact CG-CE 4.11Å
256	F	80.5	Confident	82.8	Confident	11 Å²	11	80.6 Å²	80.6	5%	0.048	42%	0.415	C	S	.	.			trans	-71.9	-32.1	177.7	-67.2	-70.2	0	0	0	112.3	F247 V248 C249 G258 S259 F261 A268 C270	F247-F256 HydrophobicContact CD1-CB 4.33Å; F247-F256 AromaticContact CD1-CD2 3.45Å; F247-F256 HydrophobicContact CD1-CD2 3.45Å; F247-F256 VanDerWaalsContact CD1-CD2 3.45Å; F247-F256 HydrophobicContact CD1-CE2 4.19Å; F247-F256 HydrophobicContact CD1-CG 4.28Å; F247-F256 AromaticContact CE1-CD2 3.51Å; F247-F256 HydrophobicContact CE1-CD2 3.51Å; F247-F256 AromaticContact CE1-CE2 3.93Å; F247-F256 HydrophobicContact CE1-CE2 3.93Å; F247-F256 HydrophobicContact CE1-CG 4.34Å; F247-F256 HydrophobicContact CG-CD2 4.13Å; F247-F256 HydrophobicContact CZ-CD2 4.23Å; F247-F256 HydrophobicContact CZ-CE2 4.21Å; F247-F256 WeakPolarHBondContact O-CD2 3.35Å; F247-F256 PolarHBondContact O-N 3.43Å; V248-F256 VanDerWaalsContact O-CE2 3.32Å; V248-F256 WeakPolarHBondContact O-CE2 3.32Å; C249-F256 HydrophobicContact CB-CE1 4.25Å; C249-F256 HydrophobicContact CB-CZ 3.85Å; F256-G258 PolarHBondContact O-N 3.1Å; F256-S259 WeakPolarHBondContact CA-OG 3.43Å; F256-S259 VanDerWaalsContact O-CB 3.22Å; F256-S259 WeakPolarHBondContact O-CB 3.21Å; F256-S259 PolarHBondContact O-N 3.45Å; F256-S259 PolarHBondContact O-OG 2.96Å; F256-F261 HydrophobicContact CD1-CB 3.76Å; F256-F261 HydrophobicContact CD2-CB 3.99Å; F256-F261 HydrophobicContact CE1-CB 3.44Å; F256-F261 VanDerWaalsContact CE1-CB 3.44Å; F256-F261 HydrophobicContact CE2-CB 3.69Å; F256-F261 HydrophobicContact CG-CB 4.03Å; F256-F261 HydrophobicContact CZ-CB 3.41Å; F256-F261 VanDerWaalsContact CZ-CB 3.41Å; F256-A268 HydrophobicContact CE2-CB 3.65Å; F256-A268 HydrophobicContact CZ-CB 3.99Å; F256-C270 HydrophobicContact CE1-CB 4.22Å
257	M	79.5	Confident	83.1	Confident	140 Å²	140	81.5 Å²	81.5	69%	0.69	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	37.1	-179.7	-52.4	-164	-162.8	0	0	114	P255	P255-M257 HydrophobicContact CB-CE 4Å; P255-M257 HydrophobicContact CB-CG 3.89Å; P255-M257 HydrophobicContact CG-CE 4.11Å
258	G	76.5	Confident	83	Confident	79 Å²	79	81.1 Å²	81.1	81%	0.814	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.2	-4.2	-177.5	0	0	0	0	0	115.5	F256	F256-G258 PolarHBondContact O-N 3.1Å
259	S	73.7	Confident	83.1	Confident	70 Å²	70	79.4 Å²	79.4	49%	0.49	41%	0.407	S	S	.	.	S	Bend	trans	-68.4	161.1	168.4	68.3	0	0	0	0	111.9	F256	F256-S259 WeakPolarHBondContact CA-OG 3.43Å; F256-S259 VanDerWaalsContact O-CB 3.22Å; F256-S259 WeakPolarHBondContact O-CB 3.21Å; F256-S259 PolarHBondContact O-N 3.45Å; F256-S259 PolarHBondContact O-OG 2.96Å
260	R	83.6	Confident	82.9	Confident	208 Å²	208	80.9 Å²	80.9	79%	0.785	42%	0.416	S	S	*	.			trans	-63.1	140.4	177.9	-68	-175.9	178.7	-178.3	-0.4	110.8	Y262	R260-Y262 HydrophobicContact CB-CE2 4.45Å
261	F	89.1	Confident	82.4	Confident	76 Å²	76	79.2 Å²	79.2	33%	0.333	41%	0.411	S	S	.	.			trans	-122.3	163	169	72.5	-84.1	0	0	0	109.8	A237 L238 F247 F256 A268	A237-F261 HydrophobicContact CB-CE1 4.23Å; A237-F261 HydrophobicContact CB-CZ 3.86Å; L238-F261 HydrophobicContact CD2-CE2 4.32Å; F247-F261 HydrophobicContact CE1-CB 4.25Å; F247-F261 AromaticContact CE1-CD1 3.49Å; F247-F261 HydrophobicContact CE1-CD1 3.49Å; F247-F261 VanDerWaalsContact CE1-CD1 3.49Å; F247-F261 HydrophobicContact CE1-CD2 4.17Å; F247-F261 AromaticContact CE1-CE1 3.75Å; F247-F261 HydrophobicContact CE1-CE1 3.75Å; F247-F261 HydrophobicContact CE1-CE2 4.4Å; F247-F261 AromaticContact CE1-CG 3.7Å; F247-F261 HydrophobicContact CE1-CG 3.7Å; F247-F261 HydrophobicContact CE1-CZ 4.21Å; F247-F261 AromaticContact CZ-CD1 3.92Å; F247-F261 HydrophobicContact CZ-CD1 3.92Å; F247-F261 AromaticContact CZ-CD2 3.78Å; F247-F261 HydrophobicContact CZ-CD2 3.78Å; F247-F261 AromaticContact CZ-CE1 3.97Å; F247-F261 HydrophobicContact CZ-CE1 3.97Å; F247-F261 AromaticContact CZ-CE2 3.85Å; F247-F261 HydrophobicContact CZ-CE2 3.85Å; F247-F261 AromaticContact CZ-CG 3.81Å; F247-F261 HydrophobicContact CZ-CG 3.81Å; F247-F261 AromaticContact CZ-CZ 3.94Å; F247-F261 HydrophobicContact CZ-CZ 3.94Å; F256-F261 HydrophobicContact CD1-CB 3.76Å; F256-F261 HydrophobicContact CD2-CB 3.99Å; F256-F261 HydrophobicContact CE1-CB 3.44Å; F256-F261 VanDerWaalsContact CE1-CB 3.44Å; F256-F261 HydrophobicContact CE2-CB 3.69Å; F256-F261 HydrophobicContact CG-CB 4.03Å; F256-F261 HydrophobicContact CZ-CB 3.41Å; F256-F261 VanDerWaalsContact CZ-CB 3.41Å; F261-A268 HydrophobicContact CB-CB 4.34Å; F261-A268 HydrophobicContact CD2-CB 3.75Å; F261-A268 HydrophobicContact CE2-CB 4.48Å; F261-A268 HydrophobicContact CG-CB 4.33Å
262	Y	88.7	Confident	82.2	Confident	67 Å²	67	79 Å²	79	26%	0.263	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	129.7	178.7	-61.1	-96.4	0	0	0	109	R260 A268 Y269 L271 Y274	R260-Y262 HydrophobicContact CB-CE2 4.45Å; Y262-A268 CarbonylContact O-C 3.58Å; Y262-Y269 PolarHBondContact N-O 3.06Å; Y262-Y269 PolarHBondContact O-N 2.81Å; Y262-L271 HydrophobicContact CD2-CB 4.21Å; Y262-L271 HydrophobicContact CD2-CD1 4.4Å; Y262-L271 HydrophobicContact CE1-CD1 4.28Å; Y262-L271 HydrophobicContact CE2-CB 3.67Å; Y262-L271 HydrophobicContact CE2-CD1 3.78Å; Y262-L271 HydrophobicContact CE2-CG 4.26Å; Y262-Y274 VanDerWaalsContact CB-CD2 3.45Å; Y262-Y274 AromaticContact CD1-CD1 3.89Å; Y262-Y274 HydrophobicContact CD1-CD1 3.89Å; Y262-Y274 AromaticContact CD1-CE1 3.94Å; Y262-Y274 HydrophobicContact CD1-CE1 3.94Å; Y262-Y274 HydrophobicContact CD1-CG 4.44Å; Y262-Y274 AromaticContact CG-CD1 3.82Å; Y262-Y274 HydrophobicContact CG-CD1 3.82Å; Y262-Y274 HydrophobicContact CG-CD2 4.48Å; Y262-Y274 HydrophobicContact CG-CE1 4.26Å; Y262-Y274 AromaticContact CG-CG 3.94Å; Y262-Y274 HydrophobicContact CG-CG 3.94Å
263	E	91	Very high	82.3	Confident	112 Å²	112	79 Å²	79	52%	0.523	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	130.2	-179.3	-178.2	179.3	165	0	0	111.1	L238 H267 Y274	L238-E263 HydrophobicContact CD2-CB 3.98Å; L238-E263 HydrophobicContact CD2-CG 3.52Å; L238-E263 VanDerWaalsContact CD2-OE2 3.3Å; L238-E263 WeakPolarHBondContact CD2-OE2 3.43Å; E263-H267 CarbonylContact C-O 3.52Å; E263-H267 WeakPolarHBondContact CA-O 3.36Å; E263-Y274 WeakPolarHBondContact O-CE2 3.48Å
264	W	86.1	Confident	82.3	Confident	79 Å²	79	74.8 Å²	74.8	30%	0.299	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	124.3	169.2	-174.9	78.4	0	0	0	109.8	G266 H267 Y269 Y274 K277	W264-G266 VanDerWaalsContact C-N 3.27Å; W264-G266 PolarHBondContact O-N 2.77Å; W264-H267 PolarHBondContact N-O 2.99Å; W264-H267 PolarHBondContact O-N 2.78Å; W264-Y269 HydrophobicContact CB-CD2 3.92Å; W264-Y269 HydrophobicContact CB-CE2 3.82Å; W264-Y269 AromaticContact CE3-CE2 3.95Å; W264-Y269 HydrophobicContact CE3-CE2 3.95Å; W264-Y274 HydrophobicContact CB-CD2 3.97Å; W264-Y274 HydrophobicContact CB-CE2 3.91Å; W264-K277 HydrophobicContact CD2-CB 4.24Å; W264-K277 HydrophobicContact CE3-CB 4.25Å; W264-K277 HydrophobicContact CE3-CD 4.44Å; W264-K277 HydrophobicContact CE3-CG 4.24Å; W264-K277 HydrophobicContact CH2-CD 4.45Å; W264-K277 HydrophobicContact CZ3-CB 4.48Å; W264-K277 HydrophobicContact CZ3-CD 4.05Å; W264-K277 HydrophobicContact CZ3-CG 4.35Å
265	Q	86.5	Confident	82.4	Confident	146 Å²	146	70.6 Å²	70.6	68%	0.682	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	42.6	-177	-62.7	-171.6	-20.4	0	0	113.7	H267	Q265-H267 VanDerWaalsContact C-N 3.27Å; Q265-H267 PolarHBondContact O-CD2 2.87Å; Q265-H267 VanDerWaalsContact O-CD2 3.3Å; Q265-H267 PolarHBondContact O-N 3.27Å
266	G	87.1	Confident	82	Confident	41 Å²	41	71.2 Å²	71.2	42%	0.423	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	10.3	178.9	0	0	0	0	0	115.1	W264	W264-G266 VanDerWaalsContact C-N 3.27Å; W264-G266 PolarHBondContact O-N 2.77Å
267	H	91	Very high	81.6	Confident	80 Å²	80	75.3 Å²	75.3	37%	0.37	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	143.9	176.7	-63.2	-68.7	0	0	0	111.3	H250 E263 W264 Q265 Y269	H250-H267 HydrophobicContact CB-CB 3.92Å; H250-H267 AromaticContact CD2-CG 3.93Å; H250-H267 AromaticContact CE1-CE1 3.81Å; H250-H267 AromaticContact CE1-ND1 3.7Å; H250-H267 AromaticContact CG-CG 3.9Å; H250-H267 AromaticContact CG-ND1 3.9Å; H250-H267 AromaticContact ND1-ND1 3.6Å; E263-H267 CarbonylContact C-O 3.52Å; E263-H267 WeakPolarHBondContact CA-O 3.36Å; W264-H267 PolarHBondContact N-O 2.99Å; W264-H267 PolarHBondContact O-N 2.78Å; Q265-H267 VanDerWaalsContact C-N 3.27Å; Q265-H267 PolarHBondContact O-CD2 2.87Å; Q265-H267 VanDerWaalsContact O-CD2 3.3Å; Q265-H267 PolarHBondContact O-N 3.27Å; H267-Y269 HydrophobicContact CB-CD2 4.41Å; H267-Y269 HydrophobicContact CB-CE2 3.63Å; H267-Y269 WeakPolarHBondContact O-CD2 3.47Å
268	A	89.9	Confident	81.3	Confident	4 Å²	4	72.5 Å²	72.5	3%	0.033	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	134.1	177	0	0	0	0	0	111.1	L238 F247 C249 H250 F256 F261 Y262	L238-A268 HydrophobicContact CD1-CB 4.04Å; F247-A268 HydrophobicContact CE1-CB 4.48Å; F247-A268 HydrophobicContact CE2-CB 3.81Å; F247-A268 HydrophobicContact CZ-CB 3.58Å; C249-A268 CarbonylContact C-O 3.51Å; C249-A268 WeakPolarHBondContact CA-O 3.22Å; H250-A268 WeakPolarHBondContact CB-O 3.39Å; H250-A268 PolarHBondContact N-O 2.63Å; F256-A268 HydrophobicContact CE2-CB 3.65Å; F256-A268 HydrophobicContact CZ-CB 3.99Å; F261-A268 HydrophobicContact CB-CB 4.34Å; F261-A268 HydrophobicContact CD2-CB 3.75Å; F261-A268 HydrophobicContact CE2-CB 4.48Å; F261-A268 HydrophobicContact CG-CB 4.33Å; Y262-A268 CarbonylContact O-C 3.58Å
269	Y	86.8	Confident	80.6	Confident	8 Å²	8	70.7 Å²	70.7	3%	0.031	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	149	178	-65.3	-92.8	0	0	0	110.9	H250 H251 Y262 W264 H267 H273 K277	H250-Y269 HydrophobicContact CB-CD1 4.45Å; H250-Y269 HydrophobicContact CB-CE1 4.07Å; H250-Y269 AromaticContact CD2-CZ 3.96Å; H250-Y269 PolarHBondContact CD2-OH 3.26Å; H251-Y269 HydrophobicContact CB-CD1 4.1Å; H251-Y269 HydrophobicContact CB-CE1 4.11Å; Y262-Y269 PolarHBondContact N-O 3.06Å; Y262-Y269 PolarHBondContact O-N 2.81Å; W264-Y269 HydrophobicContact CB-CD2 3.92Å; W264-Y269 HydrophobicContact CB-CE2 3.82Å; W264-Y269 AromaticContact CE3-CE2 3.95Å; W264-Y269 HydrophobicContact CE3-CE2 3.95Å; H267-Y269 HydrophobicContact CB-CD2 4.41Å; H267-Y269 HydrophobicContact CB-CE2 3.63Å; H267-Y269 WeakPolarHBondContact O-CD2 3.47Å; Y269-H273 HydrophobicContact CD1-CB 3.92Å; Y269-K277 HydrophobicContact CD1-CG 4.48Å; Y269-K277 HydrophobicContact CE1-CG 4.08Å
270	C	79.5	Confident	80.3	Confident	31 Å²	31	68.5 Å²	68.5	21%	0.209	34%	0.341	C	S	.	.			trans	-68.6	161.2	163	75.2	0	0	0	0	109.5	C249 F256 L272 H273 Y274	C249-C270 HydrophobicContact CB-CB 4.28Å; C249-C270 PolarHBondContact SG-N 3.22Å; F256-C270 HydrophobicContact CE1-CB 4.22Å; C270-L272 VanDerWaalsContact C-N 3.26Å; C270-L272 PolarHBondContact O-N 3.04Å; C270-H273 PolarHBondContact O-N 3.2Å; C270-H273 VanDerWaalsContact O-N 3.11Å; C270-H273 PolarHBondContact SG-ND1 3Å; C270-Y274 WeakPolarHBondContact O-CB 3.29Å; C270-Y274 PolarHBondContact O-N 2.96Å
271	L	78.1	Confident	79.7	Confident	67 Å²	67	61 Å²	61	35%	0.351	32%	0.318	S	S	.	.	H	α-helix	trans	-50.1	-47.1	-178.6	179.1	56.6	0	0	0	112.4	Y262 H273 Y274 Q275	Y262-L271 HydrophobicContact CD2-CB 4.21Å; Y262-L271 HydrophobicContact CD2-CD1 4.4Å; Y262-L271 HydrophobicContact CE1-CD1 4.28Å; Y262-L271 HydrophobicContact CE2-CB 3.67Å; Y262-L271 HydrophobicContact CE2-CD1 3.78Å; Y262-L271 HydrophobicContact CE2-CG 4.26Å; L271-H273 PolarHBondContact O-N 3.37Å; L271-Y274 PolarHBondContact O-N 3.48Å; L271-Q275 VanDerWaalsContact CD1-CD 3.46Å; L271-Q275 HydrophobicContact CD1-CG 4.05Å; L271-Q275 VanDerWaalsContact CG-OE1 3.29Å; L271-Q275 WeakPolarHBondContact O-CB 3.3Å; L271-Q275 WeakPolarHBondContact O-CG 3.35Å; L271-Q275 PolarHBondContact O-N 3.4Å; L271-Q275 PolarHBondContact O-OE1 3.11Å
272	L	71.4	Confident	79.2	Confident	100 Å²	100	57.5 Å²	57.5	52%	0.524	30%	0.302	S	S	.	.	H	α-helix	trans	-57.6	-49	179.8	-61	176.8	0	0	0	112.1	C270 Q275 S276 P288	C270-L272 VanDerWaalsContact C-N 3.26Å; C270-L272 PolarHBondContact O-N 3.04Å; L272-Q275 PolarHBondContact O-N 3.41Å; L272-S276 PolarHBondContact O-N 3.44Å; L272-P288 HydrophobicContact CB-CG 4.43Å; L272-P288 HydrophobicContact CD2-CG 3.42Å; L272-P288 VanDerWaalsContact CD2-CG 3.42Å; L272-P288 HydrophobicContact CG-CG 4.49Å
273	H	78.6	Confident	78.7	Confident	40 Å²	40	58.9 Å²	58.9	19%	0.185	31%	0.311	C	S	.	.	H	α-helix	trans	-77.8	-30.2	-177.2	-63	137.3	0	0	0	113.1	C249 H251 C252 Y269 C270 L271 Q275 S276 K277	C249-H273 PolarHBondContact SG-ND1 3.44Å; C249-H273 VanDerWaalsContact SG-ND1 3.38Å; H251-H273 HydrophobicContact CB-CB 3.88Å; H251-H273 AromaticContact CD2-CD2 3.2Å; H251-H273 PolarHBondContact CD2-CD2 3.17Å; H251-H273 AromaticContact CD2-CG 3.45Å; H251-H273 VanDerWaalsContact CD2-CG 3.45Å; H251-H273 AromaticContact CD2-NE2 3.78Å; H251-H273 AromaticContact CG-CD2 4Å; H251-H273 AromaticContact CG-CG 3.89Å; C252-H273 WeakPolarHBondContact CB-CE1 3.29Å; C252-H273 PolarHBondContact SG-CE1 3.48Å; C252-H273 PolarHBondContact SG-ND1 3.38Å; C252-H273 VanDerWaalsContact SG-ND1 3.44Å; Y269-H273 HydrophobicContact CD1-CB 3.92Å; C270-H273 PolarHBondContact O-N 3.2Å; C270-H273 VanDerWaalsContact O-N 3.11Å; C270-H273 PolarHBondContact SG-ND1 3Å; L271-H273 PolarHBondContact O-N 3.37Å; H273-Q275 VanDerWaalsContact C-N 3.34Å; H273-S276 WeakPolarHBondContact CA-OG 3.43Å; H273-S276 PolarHBondContact O-N 3.15Å; H273-S276 PolarHBondContact O-OG 3.46Å; H273-K277 VanDerWaalsContact O-CG 3.29Å; H273-K277 WeakPolarHBondContact O-CG 3.41Å; H273-K277 PolarHBondContact O-N 2.94Å
274	Y	82.2	Confident	78.4	Confident	63 Å²	63	58.3 Å²	58.3	25%	0.247	31%	0.311	C	S	.	.	H	α-helix	trans	-61.8	-46.4	170.9	-179.3	-110.9	0	0	0	110.5	Y262 E263 W264 C270 L271 S276 K277 I278	Y262-Y274 VanDerWaalsContact CB-CD2 3.45Å; Y262-Y274 AromaticContact CD1-CD1 3.89Å; Y262-Y274 HydrophobicContact CD1-CD1 3.89Å; Y262-Y274 AromaticContact CD1-CE1 3.94Å; Y262-Y274 HydrophobicContact CD1-CE1 3.94Å; Y262-Y274 HydrophobicContact CD1-CG 4.44Å; Y262-Y274 AromaticContact CG-CD1 3.82Å; Y262-Y274 HydrophobicContact CG-CD1 3.82Å; Y262-Y274 HydrophobicContact CG-CD2 4.48Å; Y262-Y274 HydrophobicContact CG-CE1 4.26Å; Y262-Y274 AromaticContact CG-CG 3.94Å; Y262-Y274 HydrophobicContact CG-CG 3.94Å; E263-Y274 WeakPolarHBondContact O-CE2 3.48Å; W264-Y274 HydrophobicContact CB-CD2 3.97Å; W264-Y274 HydrophobicContact CB-CE2 3.91Å; C270-Y274 WeakPolarHBondContact O-CB 3.29Å; C270-Y274 PolarHBondContact O-N 2.96Å; L271-Y274 PolarHBondContact O-N 3.48Å; Y274-S276 VanDerWaalsContact C-N 3.35Å; Y274-S276 PolarHBondContact O-N 2.84Å; Y274-K277 PolarHBondContact O-N 2.88Å; Y274-I278 HydrophobicContact CD1-CD1 3.76Å; Y274-I278 HydrophobicContact CD2-CD1 3.88Å; Y274-I278 HydrophobicContact CE1-CD1 3.25Å; Y274-I278 HydrophobicContact CE2-CD1 3.37Å; Y274-I278 HydrophobicContact CE2-CG1 4.48Å; Y274-I278 HydrophobicContact CG-CD1 4.05Å; Y274-I278 PolarHBondContact O-N 2.96Å; Y274-I278 VanDerWaalsContact OH-CD1 3.3Å; Y274-I278 WeakPolarHBondContact OH-CD1 3.33Å
275	Q	72.5	Confident	78.3	Confident	23 Å²	23	56.4 Å²	56.4	11%	0.107	31%	0.309	C	S	.	.	H	α-helix	trans	-69.1	-31.8	178	-72	169.8	-49.8	0	0	112.6	L271 L272 H273 K277 G279 S280 P288	L271-Q275 VanDerWaalsContact CD1-CD 3.46Å; L271-Q275 HydrophobicContact CD1-CG 4.05Å; L271-Q275 VanDerWaalsContact CG-OE1 3.29Å; L271-Q275 WeakPolarHBondContact O-CB 3.3Å; L271-Q275 WeakPolarHBondContact O-CG 3.35Å; L271-Q275 PolarHBondContact O-N 3.4Å; L271-Q275 PolarHBondContact O-OE1 3.11Å; L272-Q275 PolarHBondContact O-N 3.41Å; H273-Q275 VanDerWaalsContact C-N 3.34Å; Q275-K277 VanDerWaalsContact C-N 3.34Å; Q275-G279 PolarHBondContact O-N 2.97Å; Q275-S280 PolarHBondContact O-N 3.2Å; Q275-P288 HydrophobicContact CB-CB 3.84Å; Q275-P288 HydrophobicContact CB-CG 4.15Å; Q275-P288 HydrophobicContact CG-CB 4.15Å
276	S	70.3	Confident	77.7	Confident	50 Å²	50	53 Å²	53	35%	0.35	31%	0.306	S	S	.	.	H	α-helix	trans	-67.2	-35.4	172.4	76.8	0	0	0	0	112.2	L272 H273 Y274 G279	L272-S276 PolarHBondContact O-N 3.44Å; H273-S276 WeakPolarHBondContact CA-OG 3.43Å; H273-S276 PolarHBondContact O-N 3.15Å; H273-S276 PolarHBondContact O-OG 3.46Å; Y274-S276 VanDerWaalsContact C-N 3.35Å; Y274-S276 PolarHBondContact O-N 2.84Å; S276-G279 PolarHBondContact O-N 3.2Å
277	K	72	Confident	77	Confident	97 Å²	97	58 Å²	58	42%	0.422	32%	0.316	S	S	.	.	H	α-helix	trans	-71.3	-36.1	175.2	-69.3	-64.4	-177.2	-176.6	0	113.4	W264 Y269 H273 Y274 Q275 G279	W264-K277 HydrophobicContact CD2-CB 4.24Å; W264-K277 HydrophobicContact CE3-CB 4.25Å; W264-K277 HydrophobicContact CE3-CD 4.44Å; W264-K277 HydrophobicContact CE3-CG 4.24Å; W264-K277 HydrophobicContact CH2-CD 4.45Å; W264-K277 HydrophobicContact CZ3-CB 4.48Å; W264-K277 HydrophobicContact CZ3-CD 4.05Å; W264-K277 HydrophobicContact CZ3-CG 4.35Å; Y269-K277 HydrophobicContact CD1-CG 4.48Å; Y269-K277 HydrophobicContact CE1-CG 4.08Å; H273-K277 VanDerWaalsContact O-CG 3.29Å; H273-K277 WeakPolarHBondContact O-CG 3.41Å; H273-K277 PolarHBondContact O-N 2.94Å; Y274-K277 PolarHBondContact O-N 2.88Å; Q275-K277 VanDerWaalsContact C-N 3.34Å; K277-G279 VanDerWaalsContact C-N 3.28Å
278	I	71.9	Confident	75.9	Confident	81 Å²	81	55.3 Å²	55.3	42%	0.415	31%	0.305	S	S	.	.	H	α-helix	trans	-82.3	-12.3	177.9	-66.9	167.4	0	0	0	111.9	Y274	Y274-I278 HydrophobicContact CD1-CD1 3.76Å; Y274-I278 HydrophobicContact CD2-CD1 3.88Å; Y274-I278 HydrophobicContact CE1-CD1 3.25Å; Y274-I278 HydrophobicContact CE2-CD1 3.37Å; Y274-I278 HydrophobicContact CE2-CG1 4.48Å; Y274-I278 HydrophobicContact CG-CD1 4.05Å; Y274-I278 PolarHBondContact O-N 2.96Å; Y274-I278 VanDerWaalsContact OH-CD1 3.3Å; Y274-I278 WeakPolarHBondContact OH-CD1 3.33Å
279	G	61.9	Low	75	Confident	41 Å²	41	55.5 Å²	55.5	42%	0.423	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	44.1	173.1	0	0	0	0	0	113.7	Q275 S276 K277 I300	Q275-G279 PolarHBondContact O-N 2.97Å; S276-G279 PolarHBondContact O-N 3.2Å; K277-G279 VanDerWaalsContact C-N 3.28Å; G279-I300 WeakPolarHBondContact O-CD1 3.18Å
280	S	68.8	Low	73.9	Confident	25 Å²	25	59.7 Å²	59.7	18%	0.175	33%	0.333	C	S	.	.			trans	-122.2	43.9	-178.3	-59.3	0	0	0	0	113.8	Q275 P288 V289	Q275-S280 PolarHBondContact O-N 3.2Å; S280-P288 WeakPolarHBondContact O-CA 3.18Å; S280-V289 PolarHBondContact O-N 2.84Å
281	V	70.3	Confident	73	Confident	51 Å²	51	63.6 Å²	63.6	31%	0.309	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-106.5	141.3	177.3	-65.5	0	0	0	0	111.9	H283 P288 I300	V281-H283 PolarHBondContact O-N 3.48Å; V281-P288 HydrophobicContact CG1-CG 4.4Å; V281-I300 WeakPolarHBondContact O-CB 2.86Å
282	C	78.1	Confident	72	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.007	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-63.9	129.6	175.2	175.9	0	0	0	0	110.4	I284 C285 A286 K287 V289 I300 C302	C282-I284 PolarHBondContact O-N 3.23Å; C282-I284 PolarHBondContact SG-N 3.45Å; C282-I284 VanDerWaalsContact SG-N 3.43Å; C282-C285 VanDerWaalsContact CB-SG 3.53Å; C282-C285 VanDerWaalsContact SG-SG 3.64Å; C282-A286 WeakPolarHBondContact O-CA 3.38Å; C282-A286 PolarHBondContact O-N 2.77Å; C282-K287 WeakPolarHBondContact CB-O 3.42Å; C282-K287 PolarHBondContact N-O 2.92Å; C282-V289 HydrophobicContact CB-CG2 3.89Å; C282-I300 CarbonylContact C-O 3.47Å; C282-I300 VanDerWaalsContact CA-O 3.3Å; C282-I300 WeakPolarHBondContact CA-O 3.39Å; C282-C302 HydrophobicContact CB-CB 4.01Å; C282-C302 PolarHBondContact SG-N 2.91Å
283	H	79.8	Confident	71.3	Confident	97 Å²	97	64 Å²	64	45%	0.449	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-27	179.3	179.9	58.2	0	0	0	113.5	V281 K299 I300 Y301	V281-H283 PolarHBondContact O-N 3.48Å; H283-K299 HydrophobicContact CB-CB 4.09Å; H283-K299 HydrophobicContact CB-CG 4.43Å; H283-K299 WeakPolarHBondContact NE2-CE 3.33Å; H283-K299 PolarHBondContact NE2-NZ 3.43Å; H283-I300 WeakPolarHBondContact CB-O 3.48Å; H283-I300 PolarHBondContact N-O 3.43Å; H283-Y301 HydrophobicContact CB-CE1 4.3Å
284	I	82.9	Confident	70.5	Confident	100 Å²	100	63 Å²	63	51%	0.513	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-53.2	-176.1	-56	-57.5	0	0	0	111.6	C282 Y301 H305	C282-I284 PolarHBondContact O-N 3.23Å; C282-I284 PolarHBondContact SG-N 3.45Å; C282-I284 VanDerWaalsContact SG-N 3.43Å; I284-Y301 HydrophobicContact CD1-CE1 4.31Å; I284-Y301 HydrophobicContact CG1-CD1 4.08Å; I284-Y301 HydrophobicContact CG1-CE1 4.07Å; I284-H305 HydrophobicContact CB-CB 3.84Å; I284-H305 HydrophobicContact CG1-CB 3.93Å; I284-H305 HydrophobicContact CG2-CB 4.34Å
285	C	84.3	Confident	69.7	Low	38 Å²	38	67 Å²	67	26%	0.257	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-3	-175.1	64.4	0	0	0	0	115.2	C282 K287 H305	C282-C285 VanDerWaalsContact CB-SG 3.53Å; C282-C285 VanDerWaalsContact SG-SG 3.64Å; C285-K287 HydrophobicContact CB-CD 4.48Å; C285-K287 HydrophobicContact CB-CG 4.21Å; C285-K287 PolarHBondContact O-N 2.74Å; C285-K287 VanDerWaalsContact SG-CB 3.58Å; C285-H305 WeakPolarHBondContact CB-CE1 3.42Å; C285-H305 VanDerWaalsContact SG-CE1 3.58Å; C285-H305 PolarHBondContact SG-ND1 3.02Å; C285-H305 VanDerWaalsContact SG-ND1 3.39Å
286	A	74.3	Confident	69.7	Low	75 Å²	75	67.1 Å²	67.1	62%	0.62	37%	0.373	S	S	*	.			trans	55.9	8.6	-173.3	0	0	0	0	0	114.9	C282	C282-A286 WeakPolarHBondContact O-CA 3.38Å; C282-A286 PolarHBondContact O-N 2.77Å
287	K	72.6	Confident	69.7	Low	145 Å²	145	67 Å²	67	63%	0.63	37%	0.37	S	S	*	.			trans	-77.7	141.7	173.4	-60	-179.3	-178.4	179.2	0	109.1	C282 C285	C282-K287 WeakPolarHBondContact CB-O 3.42Å; C282-K287 PolarHBondContact N-O 2.92Å; C285-K287 HydrophobicContact CB-CD 4.48Å; C285-K287 HydrophobicContact CB-CG 4.21Å; C285-K287 PolarHBondContact O-N 2.74Å; C285-K287 VanDerWaalsContact SG-CB 3.58Å
288	P	68.4	Low	69.6	Low	24 Å²	24	70.3 Å²	70.3	16%	0.156	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-62.9	145.3	174.5	-21.5	32.5	0	0	0	112.7	L272 Q275 S280 V281	L272-P288 HydrophobicContact CB-CG 4.43Å; L272-P288 HydrophobicContact CD2-CG 3.42Å; L272-P288 VanDerWaalsContact CD2-CG 3.42Å; L272-P288 HydrophobicContact CG-CG 4.49Å; Q275-P288 HydrophobicContact CB-CB 3.84Å; Q275-P288 HydrophobicContact CB-CG 4.15Å; Q275-P288 HydrophobicContact CG-CB 4.15Å; S280-P288 WeakPolarHBondContact O-CA 3.18Å; V281-P288 HydrophobicContact CG1-CG 4.4Å
289	V	70.6	Confident	69.8	Low	9 Å²	9	69 Å²	69	6%	0.055	38%	0.384	C	S	.	.			trans	-99.4	106.7	176.1	-173.6	0	0	0	0	107.2	S280 C282 D291 I300 C302	S280-V289 PolarHBondContact O-N 2.84Å; C282-V289 HydrophobicContact CB-CG2 3.89Å; V289-D291 WeakPolarHBondContact CG1-O 3.39Å; V289-I300 HydrophobicContact CB-CG2 4.01Å; V289-I300 HydrophobicContact CG2-CG2 3.6Å; V289-C302 HydrophobicContact CG2-CB 3.83Å
290	T	64.1	Low	70.5	Confident	96 Å²	96	67.7 Å²	67.7	59%	0.589	37%	0.367	S	S	*	.			trans	-83.8	-30.3	179.6	50.7	0	0	0	0	112.5
291	D	59.9	Low	71.1	Confident	112 Å²	112	67 Å²	67	60%	0.599	36%	0.361	S	S	*	.	S	Bend	trans	-132.6	138.5	-171.3	-62.8	-69.2	0	0	0	111.2	V289	V289-D291 WeakPolarHBondContact CG1-O 3.39Å
292	T	57.4	Low	71.7	Confident	82 Å²	82	65.4 Å²	65.4	50%	0.503	35%	0.352	S	S	.	.			trans	56.1	91.1	178.5	-37	0	0	0	0	113.7	V294 E317	T292-V294 PolarHBondContact O-N 2.86Å; T292-E317 HydrophobicContact CG2-CG 4.27Å; T292-E317 WeakPolarHBondContact CG2-OE1 3.45Å
293	L	56.7	Low	71.9	Confident	95 Å²	95	68.7 Å²	68.7	50%	0.497	37%	0.373	S	S	.	.			trans	-70.3	92.4	178.5	-74.2	166.8	0	0	0	110.8	K295	L293-K295 PolarHBondContact O-N 3.39Å
294	V	61.1	Low	72.2	Confident	19 Å²	19	69.5 Å²	69.5	12%	0.115	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	94.6	163.4	-165.3	0	0	0	0	109.7	T292 Y301 F306 E317	T292-V294 PolarHBondContact O-N 2.86Å; V294-Y301 PolarHBondContact O-N 2.73Å; V294-F306 HydrophobicContact CB-CD1 4.08Å; V294-F306 HydrophobicContact CB-CD2 4.25Å; V294-F306 HydrophobicContact CB-CE1 4.37Å; V294-F306 HydrophobicContact CB-CE2 4.49Å; V294-F306 HydrophobicContact CB-CG 4.07Å; V294-F306 HydrophobicContact CG1-CD1 3.59Å; V294-F306 HydrophobicContact CG1-CD2 3.7Å; V294-F306 HydrophobicContact CG1-CE1 3.4Å; V294-F306 HydrophobicContact CG1-CE2 3.48Å; V294-F306 VanDerWaalsContact CG1-CE2 3.48Å; V294-F306 HydrophobicContact CG1-CG 3.78Å; V294-F306 HydrophobicContact CG1-CZ 3.34Å; V294-F306 HydrophobicContact CG2-CD1 4.03Å; V294-F306 HydrophobicContact CG2-CE1 4.46Å; V294-F306 HydrophobicContact CG2-CG 4.37Å; V294-E317 HydrophobicContact CG2-CG 4.39Å
295	K	65.1	Low	72.4	Confident	145 Å²	145	67.7 Å²	67.7	63%	0.63	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	124.3	168	-74.8	-177.8	179.9	-175.8	0	109.1	L293 K299 I300	L293-K295 PolarHBondContact O-N 3.39Å; K295-K299 WeakPolarHBondContact CA-O 3.47Å; K295-I300 HydrophobicContact CG-CD1 4.44Å; K295-I300 HydrophobicContact CG-CG1 3.8Å
296	F	73.2	Confident	72.7	Confident	26 Å²	26	66 Å²	66	11%	0.114	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	125.3	171.6	-171.6	-97.3	0	0	0	109	N298 K299 Y301 F306 L321 E323 K327 P328	F296-N298 PolarHBondContact O-N 2.88Å; F296-K299 PolarHBondContact N-O 3.43Å; F296-K299 PolarHBondContact O-N 3.2Å; F296-Y301 HydrophobicContact CB-CD2 4.48Å; F296-Y301 HydrophobicContact CB-CE2 4.09Å; F296-F306 HydrophobicContact CB-CE2 4.17Å; F296-L321 HydrophobicContact CE2-CB 4.27Å; F296-E323 HydrophobicContact CE1-CB 4.16Å; F296-E323 HydrophobicContact CE1-CG 3.98Å; F296-E323 HydrophobicContact CZ-CB 3.65Å; F296-E323 HydrophobicContact CZ-CG 4Å; F296-K327 WeakPolarHBondContact CE1-O 3.45Å; F296-P328 HydrophobicContact CD1-CB 3.93Å; F296-P328 HydrophobicContact CD1-CG 4.26Å; F296-P328 HydrophobicContact CD2-CB 4.22Å; F296-P328 HydrophobicContact CE1-CB 3.94Å; F296-P328 VanDerWaalsContact CE1-N 3.31Å; F296-P328 HydrophobicContact CE2-CB 4.22Å; F296-P328 HydrophobicContact CG-CB 4.07Å; F296-P328 HydrophobicContact CZ-CB 4.07Å
297	T	71.5	Confident	73.6	Confident	48 Å²	48	64.5 Å²	64.5	29%	0.294	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	-30.6	-177.5	60.5	0	0	0	0	118.5	E323 L326	T297-E323 HydrophobicContact CG2-CG 3.75Å; T297-E323 VanDerWaalsContact CG2-OE2 3.28Å; T297-E323 WeakPolarHBondContact CG2-OE2 3.35Å; T297-L326 HydrophobicContact CG2-CD2 4.34Å; T297-L326 PolarHBondContact OG1-O 3.2Å
298	N	68.3	Low	74.6	Confident	166 Å²	166	57.6 Å²	57.6	89%	0.888	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	156.2	5.3	173.8	-84.2	-24.7	0	0	0	110.6	F296	F296-N298 PolarHBondContact O-N 2.88Å
299	K	75.9	Confident	75.6	Confident	54 Å²	54	59 Å²	59	24%	0.235	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	143.2	176.7	-65.7	170.6	176.1	-166.9	0	109.6	H283 K295 F296 Y301	H283-K299 HydrophobicContact CB-CB 4.09Å; H283-K299 HydrophobicContact CB-CG 4.43Å; H283-K299 WeakPolarHBondContact NE2-CE 3.33Å; H283-K299 PolarHBondContact NE2-NZ 3.43Å; K295-K299 WeakPolarHBondContact CA-O 3.47Å; F296-K299 PolarHBondContact N-O 3.43Å; F296-K299 PolarHBondContact O-N 3.2Å; K299-Y301 HydrophobicContact CB-CD2 4.39Å; K299-Y301 HydrophobicContact CB-CE2 3.52Å; K299-Y301 WeakPolarHBondContact CD-OH 3.3Å
300	I	78.3	Confident	76.6	Confident	14 Å²	14	63.2 Å²	63.2	7%	0.072	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	140.5	174.8	-70.1	170.1	0	0	0	108.1	G279 V281 C282 H283 V289 K295	G279-I300 WeakPolarHBondContact O-CD1 3.18Å; V281-I300 WeakPolarHBondContact O-CB 2.86Å; C282-I300 CarbonylContact C-O 3.47Å; C282-I300 VanDerWaalsContact CA-O 3.3Å; C282-I300 WeakPolarHBondContact CA-O 3.39Å; H283-I300 WeakPolarHBondContact CB-O 3.48Å; H283-I300 PolarHBondContact N-O 3.43Å; V289-I300 HydrophobicContact CB-CG2 4.01Å; V289-I300 HydrophobicContact CG2-CG2 3.6Å; K295-I300 HydrophobicContact CG-CD1 4.44Å; K295-I300 HydrophobicContact CG-CG1 3.8Å
301	Y	81.3	Confident	78.1	Confident	10 Å²	10	61.3 Å²	61.3	4%	0.039	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	139.9	178.3	-62	-96.6	0	0	0	108.6	H283 I284 V294 F296 K299 H305 F306	H283-Y301 HydrophobicContact CB-CE1 4.3Å; I284-Y301 HydrophobicContact CD1-CE1 4.31Å; I284-Y301 HydrophobicContact CG1-CD1 4.08Å; I284-Y301 HydrophobicContact CG1-CE1 4.07Å; V294-Y301 PolarHBondContact O-N 2.73Å; F296-Y301 HydrophobicContact CB-CD2 4.48Å; F296-Y301 HydrophobicContact CB-CE2 4.09Å; K299-Y301 HydrophobicContact CB-CD2 4.39Å; K299-Y301 HydrophobicContact CB-CE2 3.52Å; K299-Y301 WeakPolarHBondContact CD-OH 3.3Å; Y301-H305 WeakPolarHBondContact CD1-O 3.41Å; Y301-F306 AromaticContact CD2-CD2 3.95Å; Y301-F306 HydrophobicContact CD2-CD2 3.95Å; Y301-F306 HydrophobicContact CD2-CE2 4.43Å; Y301-F306 AromaticContact CG-CD2 3.9Å; Y301-F306 HydrophobicContact CG-CD2 3.9Å
302	C	82.5	Confident	79.6	Confident	18 Å²	18	61.7 Å²	61.7	12%	0.122	33%	0.33	C	S	.	.			trans	-75.3	162.5	167.7	74	0	0	0	0	109.2	C282 V289 E304 H305 F306	C282-C302 HydrophobicContact CB-CB 4.01Å; C282-C302 PolarHBondContact SG-N 2.91Å; V289-C302 HydrophobicContact CG2-CB 3.83Å; C302-E304 PolarHBondContact O-N 2.94Å; C302-H305 PolarHBondContact O-N 3.05Å; C302-H305 PolarHBondContact SG-ND1 3.25Å; C302-F306 PolarHBondContact O-N 2.96Å
303	P	82.7	Confident	81.3	Confident	70 Å²	70	64.1 Å²	64.1	46%	0.455	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-30.3	179.4	-29.6	36.2	0	0	0	114.5
304	E	85.6	Confident	82.9	Confident	113 Å²	113	65.3 Å²	65.3	53%	0.528	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-23.6	178.5	-64.6	-55	115.1	0	0	114.2	C302 K314	C302-E304 PolarHBondContact O-N 2.94Å; E304-K314 IonicContact OE1-NZ 3.82Å; E304-K314 PolarHBondContact OE1-NZ 3.25Å; E304-K314 IonicContact OE2-NZ 2.88Å; E304-K314 PolarHBondContact OE2-NZ 3.34Å
305	H	87.9	Confident	84.2	Confident	63 Å²	63	65 Å²	65	29%	0.292	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	2	-176.5	-66.1	117.7	0	0	0	113.7	I284 C285 Y301 C302 L307	I284-H305 HydrophobicContact CB-CB 3.84Å; I284-H305 HydrophobicContact CG1-CB 3.93Å; I284-H305 HydrophobicContact CG2-CB 4.34Å; C285-H305 WeakPolarHBondContact CB-CE1 3.42Å; C285-H305 VanDerWaalsContact SG-CE1 3.58Å; C285-H305 PolarHBondContact SG-ND1 3.02Å; C285-H305 VanDerWaalsContact SG-ND1 3.39Å; Y301-H305 WeakPolarHBondContact CD1-O 3.41Å; C302-H305 PolarHBondContact O-N 3.05Å; C302-H305 PolarHBondContact SG-ND1 3.25Å; H305-L307 VanDerWaalsContact C-N 3.28Å; H305-L307 PolarHBondContact O-N 3.39Å
306	F	90.5	Very high	85.2	Confident	1 Å²	1	61.9 Å²	61.9	0%	0.004	32%	0.319	C	S	.	.			trans	-82.8	78	171.7	-166.8	-122.6	0	0	0	110	V294 F296 Y301 C302 L315 L321 P328	V294-F306 HydrophobicContact CB-CD1 4.08Å; V294-F306 HydrophobicContact CB-CD2 4.25Å; V294-F306 HydrophobicContact CB-CE1 4.37Å; V294-F306 HydrophobicContact CB-CE2 4.49Å; V294-F306 HydrophobicContact CB-CG 4.07Å; V294-F306 HydrophobicContact CG1-CD1 3.59Å; V294-F306 HydrophobicContact CG1-CD2 3.7Å; V294-F306 HydrophobicContact CG1-CE1 3.4Å; V294-F306 HydrophobicContact CG1-CE2 3.48Å; V294-F306 VanDerWaalsContact CG1-CE2 3.48Å; V294-F306 HydrophobicContact CG1-CG 3.78Å; V294-F306 HydrophobicContact CG1-CZ 3.34Å; V294-F306 HydrophobicContact CG2-CD1 4.03Å; V294-F306 HydrophobicContact CG2-CE1 4.46Å; V294-F306 HydrophobicContact CG2-CG 4.37Å; F296-F306 HydrophobicContact CB-CE2 4.17Å; Y301-F306 AromaticContact CD2-CD2 3.95Å; Y301-F306 HydrophobicContact CD2-CD2 3.95Å; Y301-F306 HydrophobicContact CD2-CE2 4.43Å; Y301-F306 AromaticContact CG-CD2 3.9Å; Y301-F306 HydrophobicContact CG-CD2 3.9Å; C302-F306 PolarHBondContact O-N 2.96Å; F306-L315 VanDerWaalsContact CD1-C 3.49Å; F306-L315 HydrophobicContact CD1-CB 3.38Å; F306-L315 WeakPolarHBondContact CD1-O 3.46Å; F306-L315 HydrophobicContact CE1-CB 3.24Å; F306-L315 HydrophobicContact CE1-CD1 4.21Å; F306-L315 HydrophobicContact CE1-CG 4.36Å; F306-L315 HydrophobicContact CE2-CD1 4.43Å; F306-L315 HydrophobicContact CG-CB 4.17Å; F306-L315 HydrophobicContact CZ-CB 4.01Å; F306-L315 HydrophobicContact CZ-CD1 4.13Å; F306-L315 WeakPolarHBondContact O-CB 3.28Å; F306-L315 PolarHBondContact O-N 3.27Å; F306-L321 HydrophobicContact CE1-CD1 4.14Å; F306-L321 HydrophobicContact CE1-CD2 4.25Å; F306-L321 HydrophobicContact CZ-CD1 3.67Å; F306-L321 HydrophobicContact CZ-CD2 3.93Å; F306-L321 HydrophobicContact CZ-CG 4.46Å; F306-P328 HydrophobicContact CD2-CG 4.29Å; F306-P328 HydrophobicContact CE2-CB 3.86Å; F306-P328 HydrophobicContact CE2-CG 3.84Å; F306-P328 HydrophobicContact CZ-CB 4.24Å
307	L	91.9	Very high	85.3	Confident	45 Å²	45	67.1 Å²	67.1	24%	0.236	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-117.6	152.7	-173.2	-51.8	-178.6	0	0	0	111.7	H305 S309 R313 K314	H305-L307 VanDerWaalsContact C-N 3.28Å; H305-L307 PolarHBondContact O-N 3.39Å; L307-S309 PolarHBondContact O-N 3.48Å; L307-R313 CarbonylContact C-O 3.59Å; L307-R313 WeakPolarHBondContact CA-O 3.38Å; L307-K314 HydrophobicContact CD2-CB 4.19Å; L307-K314 HydrophobicContact CD2-CG 3.56Å
308	C	93.4	Very high	85.9	Confident	0 Å²	0	74 Å²	74	0%	0	37%	0.369	C	S	.	.			trans	-63.5	123.5	170.3	179.4	0	0	0	0	110	L310 C311 D312 R313 L315 C330	C308-L310 PolarHBondContact O-N 3.12Å; C308-C311 VanDerWaalsContact CB-SG 3.51Å; C308-C311 PolarHBondContact O-N 3.01Å; C308-C311 PolarHBondContact SG-SG 3Å; C308-D312 VanDerWaalsContact O-CA 3.31Å; C308-D312 WeakPolarHBondContact O-CA 3.36Å; C308-D312 PolarHBondContact O-N 3.49Å; C308-R313 HydrophobicContact CB-CB 4.3Å; C308-R313 PolarHBondContact N-O 3.34Å; C308-L315 HydrophobicContact CB-CD1 4.38Å; C308-L315 HydrophobicContact CB-CD2 4.2Å; C308-L315 HydrophobicContact CB-CG 4.46Å; C308-C330 HydrophobicContact CB-CB 4.17Å; C308-C330 PolarHBondContact SG-N 3.07Å; C308-C330 VanDerWaalsContact SG-SG 3.64Å
309	S	90.8	Very high	86.6	Confident	53 Å²	53	68 Å²	68	37%	0.371	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-4.1	-177.5	-62.2	0	0	0	0	115.1	L307 K327 P328	L307-S309 PolarHBondContact O-N 3.48Å; S309-K327 WeakPolarHBondContact OG-CB 3.48Å; S309-P328 PolarHBondContact N-O 3.48Å; S309-P328 PolarHBondContact OG-O 2.9Å
310	L	91.5	Very high	87.1	Confident	97 Å²	97	72.5 Å²	72.5	51%	0.508	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-18	178	-63.2	-175.7	0	0	0	113.9	C308 V329 C333	C308-L310 PolarHBondContact O-N 3.12Å; L310-V329 HydrophobicContact CD1-CG1 3.67Å; L310-V329 HydrophobicContact CD1-CG2 4.31Å; L310-V329 HydrophobicContact CG-CG1 4.1Å; L310-V329 HydrophobicContact CG-CG2 4.12Å; L310-C333 HydrophobicContact CB-CB 3.89Å; L310-C333 HydrophobicContact CD1-CB 3.86Å; L310-C333 HydrophobicContact CG-CB 4.43Å
311	C	93.9	Very high	87.5	Confident	57 Å²	57	74.4 Å²	74.4	39%	0.385	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.6	4.8	-176.7	70.3	0	0	0	0	114.8	C308 R313 C333	C308-C311 VanDerWaalsContact CB-SG 3.51Å; C308-C311 PolarHBondContact O-N 3.01Å; C308-C311 PolarHBondContact SG-SG 3Å; C311-R313 PolarHBondContact O-N 3.01Å; C311-R313 VanDerWaalsContact SG-CB 3.52Å; C311-C333 PolarHBondContact SG-SG 3.34Å
312	D	92.5	Very high	87.9	Confident	119 Å²	119	77.6 Å²	77.6	64%	0.636	38%	0.382	S	S	*	.			trans	56.8	11.8	179.8	-55.4	-41.1	0	0	0	115.4	C308 K314	C308-D312 VanDerWaalsContact O-CA 3.31Å; C308-D312 WeakPolarHBondContact O-CA 3.36Å; C308-D312 PolarHBondContact O-N 3.49Å; D312-K314 PolarHBondContact O-N 3.38Å
313	R	92.2	Very high	88	Confident	133 Å²	133	79.4 Å²	79.4	50%	0.502	39%	0.389	S	S	.	.			trans	-61.3	129.9	174.3	-175.7	177.1	-176.8	176.4	-0.3	109.6	L307 C308 C311 L315 E332	L307-R313 CarbonylContact C-O 3.59Å; L307-R313 WeakPolarHBondContact CA-O 3.38Å; C308-R313 HydrophobicContact CB-CB 4.3Å; C308-R313 PolarHBondContact N-O 3.34Å; C311-R313 PolarHBondContact O-N 3.01Å; C311-R313 VanDerWaalsContact SG-CB 3.52Å; R313-L315 PolarHBondContact O-N 3.23Å; R313-E332 IonicContact CZ-OE1 3.93Å; R313-E332 IonicContact NH1-OE1 2.74Å; R313-E332 PolarHBondContact NH1-OE1 2.89Å; R313-E332 IonicContact NH1-OE2 2.95Å; R313-E332 PolarHBondContact NH1-OE2 3.28Å
314	K	90.8	Very high	88.2	Confident	120 Å²	120	77.2 Å²	77.2	52%	0.522	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-55.4	130.5	171	-73.6	-169.9	174.6	-164	0	110.5	E304 L307 D312	E304-K314 IonicContact OE1-NZ 3.82Å; E304-K314 PolarHBondContact OE1-NZ 3.25Å; E304-K314 IonicContact OE2-NZ 2.88Å; E304-K314 PolarHBondContact OE2-NZ 3.34Å; L307-K314 HydrophobicContact CD2-CB 4.19Å; L307-K314 HydrophobicContact CD2-CG 3.56Å; D312-K314 PolarHBondContact O-N 3.38Å
315	L	89.3	Confident	87.9	Confident	14 Å²	14	78 Å²	78	7%	0.073	38%	0.381	C	S	.	.			trans	-108.8	159.3	178	-56	171.9	0	0	0	108.9	F306 C308 R313 L321 P328 C330	F306-L315 VanDerWaalsContact CD1-C 3.49Å; F306-L315 HydrophobicContact CD1-CB 3.38Å; F306-L315 WeakPolarHBondContact CD1-O 3.46Å; F306-L315 HydrophobicContact CE1-CB 3.24Å; F306-L315 HydrophobicContact CE1-CD1 4.21Å; F306-L315 HydrophobicContact CE1-CG 4.36Å; F306-L315 HydrophobicContact CE2-CD1 4.43Å; F306-L315 HydrophobicContact CG-CB 4.17Å; F306-L315 HydrophobicContact CZ-CB 4.01Å; F306-L315 HydrophobicContact CZ-CD1 4.13Å; F306-L315 WeakPolarHBondContact O-CB 3.28Å; F306-L315 PolarHBondContact O-N 3.27Å; C308-L315 HydrophobicContact CB-CD1 4.38Å; C308-L315 HydrophobicContact CB-CD2 4.2Å; C308-L315 HydrophobicContact CB-CG 4.46Å; R313-L315 PolarHBondContact O-N 3.23Å; L315-L321 HydrophobicContact CB-CD2 4.07Å; L315-L321 HydrophobicContact CD1-CD2 3.53Å; L315-L321 HydrophobicContact CD2-CD2 3.91Å; L315-L321 HydrophobicContact CG-CD2 4.03Å; L315-P328 HydrophobicContact CD1-CB 3.82Å; L315-P328 HydrophobicContact CD1-CG 4.18Å; L315-C330 HydrophobicContact CD2-CB 3.89Å
316	D	84.6	Confident	87.5	Confident	79 Å²	79	79.4 Å²	79.4	42%	0.422	39%	0.391	S	S	.	.			trans	-142.4	178.5	176.5	64.6	10.4	0	0	0	110.9	K318 S319	D316-K318 PolarHBondContact O-N 3.29Å; D316-K318 PolarHBondContact OD1-N 3.2Å; D316-K318 VanDerWaalsContact OD1-N 3.09Å; D316-S319 PolarHBondContact N-OG 2.92Å; D316-S319 VanDerWaalsContact N-OG 3.11Å; D316-S319 VanDerWaalsContact O-CB 3.29Å; D316-S319 WeakPolarHBondContact O-CB 3.47Å; D316-S319 PolarHBondContact O-N 3.06Å; D316-S319 VanDerWaalsContact O-N 3.15Å; D316-S319 WeakPolarHBondContact OD1-CB 3.47Å; D316-S319 PolarHBondContact OD1-N 3.06Å; D316-S319 PolarHBondContact OD1-OG 3.03Å
317	E	76.2	Confident	87.1	Confident	136 Å²	136	84.4 Å²	84.4	64%	0.636	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.8	178.5	-63.1	-178.4	169	0	0	113.6	T292 V294	T292-E317 HydrophobicContact CG2-CG 4.27Å; T292-E317 WeakPolarHBondContact CG2-OE1 3.45Å; V294-E317 HydrophobicContact CG2-CG 4.39Å
318	K	83.1	Confident	87	Confident	192 Å²	192	82.4 Å²	82.4	84%	0.835	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-13.5	-179.8	-62.6	-179	-177.7	176.5	0	112.3	D316	D316-K318 PolarHBondContact O-N 3.29Å; D316-K318 PolarHBondContact OD1-N 3.2Å; D316-K318 VanDerWaalsContact OD1-N 3.09Å
319	S	83.2	Confident	86.9	Confident	39 Å²	39	82.5 Å²	82.5	27%	0.273	40%	0.402	S	S	.	.	S	Bend	trans	-67.4	137.1	-177.5	-67.6	0	0	0	0	110.5	D316 L321	D316-S319 PolarHBondContact N-OG 2.92Å; D316-S319 VanDerWaalsContact N-OG 3.11Å; D316-S319 VanDerWaalsContact O-CB 3.29Å; D316-S319 WeakPolarHBondContact O-CB 3.47Å; D316-S319 PolarHBondContact O-N 3.06Å; D316-S319 VanDerWaalsContact O-N 3.15Å; D316-S319 WeakPolarHBondContact OD1-CB 3.47Å; D316-S319 PolarHBondContact OD1-N 3.06Å; D316-S319 PolarHBondContact OD1-OG 3.03Å; S319-L321 WeakPolarHBondContact O-CG 3.37Å; S319-L321 PolarHBondContact O-N 2.76Å
320	K	87.1	Confident	87	Confident	150 Å²	150	80.3 Å²	80.3	65%	0.652	39%	0.387	S	S	*	.			trans	-77	113.9	167.5	-74.8	-175	178.1	-178.8	0	109	K331	K320-K331 HydrophobicContact CB-CB 4.06Å; K320-K331 HydrophobicContact CB-CD 4.39Å; K320-K331 HydrophobicContact CD-CD 4.12Å; K320-K331 PolarHBondContact O-N 2.92Å; K320-K331 VanDerWaalsContact O-N 3.09Å
321	L	87.5	Confident	87.1	Confident	54 Å²	54	80 Å²	80	28%	0.283	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	145.3	-171.7	-57.6	160.5	0	0	0	110.4	F296 F306 L315 S319 P328 V329	F296-L321 HydrophobicContact CE2-CB 4.27Å; F306-L321 HydrophobicContact CE1-CD1 4.14Å; F306-L321 HydrophobicContact CE1-CD2 4.25Å; F306-L321 HydrophobicContact CZ-CD1 3.67Å; F306-L321 HydrophobicContact CZ-CD2 3.93Å; F306-L321 HydrophobicContact CZ-CG 4.46Å; L315-L321 HydrophobicContact CB-CD2 4.07Å; L315-L321 HydrophobicContact CD1-CD2 3.53Å; L315-L321 HydrophobicContact CD2-CD2 3.91Å; L315-L321 HydrophobicContact CG-CD2 4.03Å; S319-L321 WeakPolarHBondContact O-CG 3.37Å; S319-L321 PolarHBondContact O-N 2.76Å; L321-P328 HydrophobicContact CD2-CB 4.44Å; L321-V329 CarbonylContact C-O 3.58Å; L321-V329 WeakPolarHBondContact CA-O 3.45Å
322	Y	88.7	Confident	87.1	Confident	76 Å²	76	82.2 Å²	82.2	30%	0.298	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.9	170.9	-67.6	-91.5	0	0	0	109.5	V329 K331 Y334	Y322-V329 PolarHBondContact N-O 2.88Å; Y322-V329 PolarHBondContact O-N 2.86Å; Y322-K331 HydrophobicContact CD2-CB 4.43Å; Y322-K331 HydrophobicContact CE2-CB 3.85Å; Y322-K331 HydrophobicContact CE2-CG 3.93Å; Y322-Y334 VanDerWaalsContact CB-CD2 3.5Å; Y322-Y334 AromaticContact CD1-CD1 3.7Å; Y322-Y334 HydrophobicContact CD1-CD1 3.7Å; Y322-Y334 AromaticContact CD1-CD2 3.73Å; Y322-Y334 HydrophobicContact CD1-CD2 3.73Å; Y322-Y334 AromaticContact CD1-CE1 3.7Å; Y322-Y334 HydrophobicContact CD1-CE1 3.7Å; Y322-Y334 AromaticContact CD1-CE2 3.75Å; Y322-Y334 HydrophobicContact CD1-CE2 3.75Å; Y322-Y334 AromaticContact CD1-CG 3.7Å; Y322-Y334 HydrophobicContact CD1-CG 3.7Å; Y322-Y334 AromaticContact CD1-CZ 3.73Å; Y322-Y334 AromaticContact CD2-CD1 3.92Å; Y322-Y334 HydrophobicContact CD2-CD1 3.92Å; Y322-Y334 HydrophobicContact CD2-CD2 4.22Å; Y322-Y334 AromaticContact CD2-CG 3.62Å; Y322-Y334 HydrophobicContact CD2-CG 3.62Å; Y322-Y334 AromaticContact CE1-CD1 3.65Å; Y322-Y334 HydrophobicContact CE1-CD1 3.65Å; Y322-Y334 AromaticContact CE1-CE1 3.56Å; Y322-Y334 HydrophobicContact CE1-CE1 3.56Å; Y322-Y334 HydrophobicContact CE1-CE2 4.44Å; Y322-Y334 HydrophobicContact CE1-CG 4.13Å; Y322-Y334 AromaticContact CE1-CZ 3.98Å; Y322-Y334 AromaticContact CE2-CD1 3.88Å; Y322-Y334 HydrophobicContact CE2-CD1 3.88Å; Y322-Y334 HydrophobicContact CE2-CG 4.06Å; Y322-Y334 AromaticContact CG-CD1 3.82Å; Y322-Y334 HydrophobicContact CG-CD1 3.82Å; Y322-Y334 AromaticContact CG-CD2 3.54Å; Y322-Y334 HydrophobicContact CG-CD2 3.54Å; Y322-Y334 HydrophobicContact CG-CE1 4.29Å; Y322-Y334 HydrophobicContact CG-CE2 4.05Å; Y322-Y334 AromaticContact CG-CG 3.41Å; Y322-Y334 HydrophobicContact CG-CG 3.41Å; Y322-Y334 VanDerWaalsContact CG-CG 3.41Å; Y322-Y334 AromaticContact CZ-CD1 3.72Å
323	E	85.1	Confident	87.2	Confident	57 Å²	57	77.3 Å²	77.3	27%	0.266	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	124.1	177.3	-174.2	-171.2	148.8	0	0	110.9	F296 T297 L326 H349	F296-E323 HydrophobicContact CE1-CB 4.16Å; F296-E323 HydrophobicContact CE1-CG 3.98Å; F296-E323 HydrophobicContact CZ-CB 3.65Å; F296-E323 HydrophobicContact CZ-CG 4Å; T297-E323 HydrophobicContact CG2-CG 3.75Å; T297-E323 VanDerWaalsContact CG2-OE2 3.28Å; T297-E323 WeakPolarHBondContact CG2-OE2 3.35Å; E323-L326 WeakPolarHBondContact OE1-CD2 3.41Å; E323-H349 PolarHBondContact O-NE2 3.27Å; E323-H349 VanDerWaalsContact O-NE2 3.07Å; E323-H349 IonicContact OE1-CE1 2.76Å; E323-H349 IonicContact OE2-CE1 2.7Å
324	I	85.9	Confident	87.2	Confident	24 Å²	24	72.9 Å²	72.9	12%	0.123	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	121.1	171	-54.1	-172.7	0	0	0	107	L326 K327 V329 Y334 L337 L345	I324-L326 VanDerWaalsContact C-N 3.26Å; I324-L326 PolarHBondContact O-N 3.05Å; I324-K327 PolarHBondContact N-O 3.38Å; I324-K327 VanDerWaalsContact N-O 3.14Å; I324-K327 WeakPolarHBondContact O-CB 3.42Å; I324-K327 PolarHBondContact O-N 3.07Å; I324-V329 HydrophobicContact CB-CG2 4.02Å; I324-V329 HydrophobicContact CD1-CB 4.23Å; I324-V329 HydrophobicContact CD1-CG1 4.17Å; I324-V329 HydrophobicContact CD1-CG2 3.91Å; I324-V329 HydrophobicContact CG1-CB 4.35Å; I324-V329 HydrophobicContact CG1-CG2 3.93Å; I324-Y334 HydrophobicContact CD1-CD2 4.28Å; I324-L337 HydrophobicContact CD1-CD1 3.39Å; I324-L345 HydrophobicContact CD1-CD1 4.02Å; I324-L345 HydrophobicContact CG1-CD1 4.04Å; I324-L345 HydrophobicContact CG2-CD2 4.26Å
325	D	80.3	Confident	87.2	Confident	129 Å²	129	70.9 Å²	70.9	69%	0.69	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	45.6	-178.1	-58	-28.5	0	0	0	113.4	K327	D325-K327 PolarHBondContact O-N 3.06Å
326	L	78.3	Confident	87.4	Confident	93 Å²	93	78.5 Å²	78.5	49%	0.487	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	18.6	-178.3	-53.9	164.2	0	0	0	114.5	T297 E323 I324	T297-L326 HydrophobicContact CG2-CD2 4.34Å; T297-L326 PolarHBondContact OG1-O 3.2Å; E323-L326 WeakPolarHBondContact OE1-CD2 3.41Å; I324-L326 VanDerWaalsContact C-N 3.26Å; I324-L326 PolarHBondContact O-N 3.05Å
327	K	83.9	Confident	87.6	Confident	106 Å²	106	76.4 Å²	76.4	46%	0.461	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	146.6	-178.9	-64.4	178	-176.9	176.2	0	112.3	F296 S309 I324 D325	F296-K327 WeakPolarHBondContact CE1-O 3.45Å; S309-K327 WeakPolarHBondContact OG-CB 3.48Å; I324-K327 PolarHBondContact N-O 3.38Å; I324-K327 VanDerWaalsContact N-O 3.14Å; I324-K327 WeakPolarHBondContact O-CB 3.42Å; I324-K327 PolarHBondContact O-N 3.07Å; D325-K327 PolarHBondContact O-N 3.06Å
328	P	89.1	Confident	88.3	Confident	2 Å²	2	73.5 Å²	73.5	1%	0.013	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	131.2	-178.2	31.1	-34.3	0	0	0	111.4	F296 F306 S309 L315 L321	F296-P328 HydrophobicContact CD1-CB 3.93Å; F296-P328 HydrophobicContact CD1-CG 4.26Å; F296-P328 HydrophobicContact CD2-CB 4.22Å; F296-P328 HydrophobicContact CE1-CB 3.94Å; F296-P328 VanDerWaalsContact CE1-N 3.31Å; F296-P328 HydrophobicContact CE2-CB 4.22Å; F296-P328 HydrophobicContact CG-CB 4.07Å; F296-P328 HydrophobicContact CZ-CB 4.07Å; F306-P328 HydrophobicContact CD2-CG 4.29Å; F306-P328 HydrophobicContact CE2-CB 3.86Å; F306-P328 HydrophobicContact CE2-CG 3.84Å; F306-P328 HydrophobicContact CZ-CB 4.24Å; S309-P328 PolarHBondContact N-O 3.48Å; S309-P328 PolarHBondContact OG-O 2.9Å; L315-P328 HydrophobicContact CD1-CB 3.82Å; L315-P328 HydrophobicContact CD1-CG 4.18Å; L321-P328 HydrophobicContact CD2-CB 4.44Å
329	V	91.3	Very high	88.4	Confident	2 Å²	2	70.8 Å²	70.8	1%	0.012	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	132.6	178	176.2	0	0	0	0	109.4	L310 L321 Y322 I324 C333	L310-V329 HydrophobicContact CD1-CG1 3.67Å; L310-V329 HydrophobicContact CD1-CG2 4.31Å; L310-V329 HydrophobicContact CG-CG1 4.1Å; L310-V329 HydrophobicContact CG-CG2 4.12Å; L321-V329 CarbonylContact C-O 3.58Å; L321-V329 WeakPolarHBondContact CA-O 3.45Å; Y322-V329 PolarHBondContact N-O 2.88Å; Y322-V329 PolarHBondContact O-N 2.86Å; I324-V329 HydrophobicContact CB-CG2 4.02Å; I324-V329 HydrophobicContact CD1-CB 4.23Å; I324-V329 HydrophobicContact CD1-CG1 4.17Å; I324-V329 HydrophobicContact CD1-CG2 3.91Å; I324-V329 HydrophobicContact CG1-CB 4.35Å; I324-V329 HydrophobicContact CG1-CG2 3.93Å; V329-C333 HydrophobicContact CG1-CB 3.71Å
330	C	93.6	Very high	88.6	Confident	8 Å²	8	76.2 Å²	76.2	5%	0.054	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	153.5	177.8	75.3	0	0	0	0	111.2	C308 L315 E332 C333 Y334	C308-C330 HydrophobicContact CB-CB 4.17Å; C308-C330 PolarHBondContact SG-N 3.07Å; C308-C330 VanDerWaalsContact SG-SG 3.64Å; L315-C330 HydrophobicContact CD2-CB 3.89Å; C330-E332 VanDerWaalsContact C-N 3.26Å; C330-E332 PolarHBondContact O-N 3.09Å; C330-C333 PolarHBondContact O-N 2.94Å; C330-C333 VanDerWaalsContact O-N 3.14Å; C330-C333 PolarHBondContact SG-N 3.14Å; C330-C333 VanDerWaalsContact SG-N 3.41Å; C330-Y334 PolarHBondContact O-N 2.86Å
331	K	92.7	Very high	88.5	Confident	89 Å²	89	76.3 Å²	76.3	39%	0.387	36%	0.363	S	S	.	.	H	α-helix	trans	-49.7	-44.1	176.3	-179.6	-179.8	179.8	-152.4	0	113.6	K320 Y322 C333 Y334 D335	K320-K331 HydrophobicContact CB-CB 4.06Å; K320-K331 HydrophobicContact CB-CD 4.39Å; K320-K331 HydrophobicContact CD-CD 4.12Å; K320-K331 PolarHBondContact O-N 2.92Å; K320-K331 VanDerWaalsContact O-N 3.09Å; Y322-K331 HydrophobicContact CD2-CB 4.43Å; Y322-K331 HydrophobicContact CE2-CB 3.85Å; Y322-K331 HydrophobicContact CE2-CG 3.93Å; K331-C333 VanDerWaalsContact C-N 3.33Å; K331-C333 PolarHBondContact O-N 2.83Å; K331-Y334 PolarHBondContact O-N 2.87Å; K331-D335 VanDerWaalsContact CE-OD2 3.24Å; K331-D335 WeakPolarHBondContact CE-OD2 3.4Å; K331-D335 WeakPolarHBondContact CG-OD2 3.29Å; K331-D335 WeakPolarHBondContact O-CB 3.37Å; K331-D335 VanDerWaalsContact O-CG 3.28Å; K331-D335 PolarHBondContact O-N 3.15Å
332	E	93.3	Very high	88.4	Confident	105 Å²	105	76.3 Å²	76.3	49%	0.491	36%	0.361	S	S	.	.	H	α-helix	trans	-61.8	-40.4	-178.2	-67.3	167.7	-168.5	0	0	112.5	R313 C330 K336	R313-E332 IonicContact CZ-OE1 3.93Å; R313-E332 IonicContact NH1-OE1 2.74Å; R313-E332 PolarHBondContact NH1-OE1 2.89Å; R313-E332 IonicContact NH1-OE2 2.95Å; R313-E332 PolarHBondContact NH1-OE2 3.28Å; C330-E332 VanDerWaalsContact C-N 3.26Å; C330-E332 PolarHBondContact O-N 3.09Å; E332-K336 VanDerWaalsContact O-CG 3.3Å; E332-K336 WeakPolarHBondContact O-CG 3.39Å; E332-K336 PolarHBondContact O-N 2.62Å
333	C	94.2	Very high	88.3	Confident	16 Å²	16	78.9 Å²	78.9	11%	0.108	37%	0.374	C	S	.	.	H	α-helix	trans	-72.8	-39.7	176	-72.7	0	0	0	0	111.6	L310 C311 V329 C330 K331 D335 K336	L310-C333 HydrophobicContact CB-CB 3.89Å; L310-C333 HydrophobicContact CD1-CB 3.86Å; L310-C333 HydrophobicContact CG-CB 4.43Å; C311-C333 PolarHBondContact SG-SG 3.34Å; V329-C333 HydrophobicContact CG1-CB 3.71Å; C330-C333 PolarHBondContact O-N 2.94Å; C330-C333 VanDerWaalsContact O-N 3.14Å; C330-C333 PolarHBondContact SG-N 3.14Å; C330-C333 VanDerWaalsContact SG-N 3.41Å; K331-C333 VanDerWaalsContact C-N 3.33Å; K331-C333 PolarHBondContact O-N 2.83Å; C333-D335 VanDerWaalsContact C-N 3.33Å; C333-D335 PolarHBondContact O-N 3.11Å; C333-K336 PolarHBondContact O-N 2.8Å
334	Y	92.2	Very high	88.3	Confident	40 Å²	40	80.5 Å²	80.5	16%	0.157	38%	0.383	C	S	.	.	H	α-helix	trans	-61.1	-43.1	174.7	-178.1	-94.9	0	0	0	111.7	Y322 I324 C330 K331 K336 L337 K342 L345	Y322-Y334 VanDerWaalsContact CB-CD2 3.5Å; Y322-Y334 AromaticContact CD1-CD1 3.7Å; Y322-Y334 HydrophobicContact CD1-CD1 3.7Å; Y322-Y334 AromaticContact CD1-CD2 3.73Å; Y322-Y334 HydrophobicContact CD1-CD2 3.73Å; Y322-Y334 AromaticContact CD1-CE1 3.7Å; Y322-Y334 HydrophobicContact CD1-CE1 3.7Å; Y322-Y334 AromaticContact CD1-CE2 3.75Å; Y322-Y334 HydrophobicContact CD1-CE2 3.75Å; Y322-Y334 AromaticContact CD1-CG 3.7Å; Y322-Y334 HydrophobicContact CD1-CG 3.7Å; Y322-Y334 AromaticContact CD1-CZ 3.73Å; Y322-Y334 AromaticContact CD2-CD1 3.92Å; Y322-Y334 HydrophobicContact CD2-CD1 3.92Å; Y322-Y334 HydrophobicContact CD2-CD2 4.22Å; Y322-Y334 AromaticContact CD2-CG 3.62Å; Y322-Y334 HydrophobicContact CD2-CG 3.62Å; Y322-Y334 AromaticContact CE1-CD1 3.65Å; Y322-Y334 HydrophobicContact CE1-CD1 3.65Å; Y322-Y334 AromaticContact CE1-CE1 3.56Å; Y322-Y334 HydrophobicContact CE1-CE1 3.56Å; Y322-Y334 HydrophobicContact CE1-CE2 4.44Å; Y322-Y334 HydrophobicContact CE1-CG 4.13Å; Y322-Y334 AromaticContact CE1-CZ 3.98Å; Y322-Y334 AromaticContact CE2-CD1 3.88Å; Y322-Y334 HydrophobicContact CE2-CD1 3.88Å; Y322-Y334 HydrophobicContact CE2-CG 4.06Å; Y322-Y334 AromaticContact CG-CD1 3.82Å; Y322-Y334 HydrophobicContact CG-CD1 3.82Å; Y322-Y334 AromaticContact CG-CD2 3.54Å; Y322-Y334 HydrophobicContact CG-CD2 3.54Å; Y322-Y334 HydrophobicContact CG-CE1 4.29Å; Y322-Y334 HydrophobicContact CG-CE2 4.05Å; Y322-Y334 AromaticContact CG-CG 3.41Å; Y322-Y334 HydrophobicContact CG-CG 3.41Å; Y322-Y334 VanDerWaalsContact CG-CG 3.41Å; Y322-Y334 AromaticContact CZ-CD1 3.72Å; I324-Y334 HydrophobicContact CD1-CD2 4.28Å; C330-Y334 PolarHBondContact O-N 2.86Å; K331-Y334 PolarHBondContact O-N 2.87Å; Y334-K336 PolarHBondContact O-N 2.78Å; Y334-L337 HydrophobicContact CD2-CD1 4Å; Y334-L337 HydrophobicContact CE2-CD1 4.49Å; Y334-L337 WeakPolarHBondContact O-CB 3.48Å; Y334-L337 WeakPolarHBondContact O-CG 3.31Å; Y334-L337 PolarHBondContact O-N 3.19Å; Y334-L337 VanDerWaalsContact O-N 3.07Å; Y334-K342 HydrophobicContact CE1-CD 4.26Å; Y334-K342 HydrophobicContact CE1-CG 4.38Å; Y334-K342 WeakPolarHBondContact O-CE 3.4Å; Y334-L345 HydrophobicContact CE2-CD1 4.09Å
335	D	91.7	Very high	88.2	Confident	77 Å²	77	79.9 Å²	79.9	41%	0.412	38%	0.38	S	S	.	.	H	α-helix	trans	-65.6	-27.8	-178.1	-76	-21.6	0	0	0	112.5	K331 C333 L337 K342	K331-D335 VanDerWaalsContact CE-OD2 3.24Å; K331-D335 WeakPolarHBondContact CE-OD2 3.4Å; K331-D335 WeakPolarHBondContact CG-OD2 3.29Å; K331-D335 WeakPolarHBondContact O-CB 3.37Å; K331-D335 VanDerWaalsContact O-CG 3.28Å; K331-D335 PolarHBondContact O-N 3.15Å; C333-D335 VanDerWaalsContact C-N 3.33Å; C333-D335 PolarHBondContact O-N 3.11Å; D335-L337 VanDerWaalsContact C-N 3.29Å; D335-L337 PolarHBondContact O-N 3.09Å; D335-K342 PolarHBondContact O-NZ 3.08Å
336	K	92.7	Very high	88.2	Confident	174 Å²	174	75.6 Å²	75.6	76%	0.757	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-10.4	174.6	-70.8	171.8	-176.7	-179.9	0	114.3	E332 C333 Y334	E332-K336 VanDerWaalsContact O-CG 3.3Å; E332-K336 WeakPolarHBondContact O-CG 3.39Å; E332-K336 PolarHBondContact O-N 2.62Å; C333-K336 PolarHBondContact O-N 2.8Å; Y334-K336 PolarHBondContact O-N 2.78Å
337	L	89.5	Confident	88.4	Confident	35 Å²	35	78.2 Å²	78.2	18%	0.183	37%	0.37	C	S	.	.	S	Bend	trans	-69.3	141.4	179.8	-66.2	170.8	0	0	0	111.9	I324 Y334 D335 K342 L345	I324-L337 HydrophobicContact CD1-CD1 3.39Å; Y334-L337 HydrophobicContact CD2-CD1 4Å; Y334-L337 HydrophobicContact CE2-CD1 4.49Å; Y334-L337 WeakPolarHBondContact O-CB 3.48Å; Y334-L337 WeakPolarHBondContact O-CG 3.31Å; Y334-L337 PolarHBondContact O-N 3.19Å; Y334-L337 VanDerWaalsContact O-N 3.07Å; D335-L337 VanDerWaalsContact C-N 3.29Å; D335-L337 PolarHBondContact O-N 3.09Å; L337-K342 HydrophobicContact CB-CG 4.17Å; L337-K342 VanDerWaalsContact O-CE 3.22Å; L337-K342 WeakPolarHBondContact O-CE 3.36Å; L337-L345 HydrophobicContact CD1-CD1 4.11Å
338	P	90.4	Very high	87.9	Confident	75 Å²	75	76.7 Å²	76.7	49%	0.487	37%	0.366	S	S	.	.			trans	-55	143.8	174.7	-24	32.7	0	0	0	112	Q340 W341 K342	P338-Q340 PolarHBondContact O-N 3.15Å; P338-Q340 VanDerWaalsContact O-N 3.12Å; P338-W341 WeakPolarHBondContact O-CB 3.44Å; P338-W341 PolarHBondContact O-N 2.95Å; P338-K342 PolarHBondContact O-N 3.34Å; P338-K342 VanDerWaalsContact O-N 3.15Å
339	M	86.4	Confident	87	Confident	136 Å²	136	79.1 Å²	79.1	67%	0.67	38%	0.377	S	S	*	.	H	α-helix	trans	-58.5	-31.8	-175.9	-171	165.6	124.6	0	0	113.2	K342 K343	M339-K342 PolarHBondContact O-N 3.09Å; M339-K343 WeakPolarHBondContact O-CG 3.38Å; M339-K343 PolarHBondContact O-N 3Å; M339-K343 VanDerWaalsContact O-N 3.13Å
340	Q	86.4	Confident	86	Confident	153 Å²	153	86.1 Å²	86.1	72%	0.715	40%	0.403	S	S	*	.	H	α-helix	trans	-62.7	-42.5	174.1	-64.4	177.8	-3.1	0	0	111.7	P338 K343 I344	P338-Q340 PolarHBondContact O-N 3.15Å; P338-Q340 VanDerWaalsContact O-N 3.12Å; Q340-K343 WeakPolarHBondContact O-CB 3.44Å; Q340-K343 PolarHBondContact O-N 3.25Å; Q340-I344 WeakPolarHBondContact O-CG1 3.49Å; Q340-I344 PolarHBondContact O-N 3.29Å; Q340-I344 VanDerWaalsContact O-N 3.08Å
341	W	85	Confident	84.6	Confident	151 Å²	151	88.1 Å²	88.1	57%	0.572	42%	0.418	S	S	*	.	H	α-helix	trans	-65.7	-43.8	177.2	-81.6	77.3	0	0	0	112	P338 K343 I344 L345	P338-W341 WeakPolarHBondContact O-CB 3.44Å; P338-W341 PolarHBondContact O-N 2.95Å; W341-K343 VanDerWaalsContact C-N 3.25Å; W341-K343 PolarHBondContact O-N 2.93Å; W341-I344 PolarHBondContact O-N 3.02Å; W341-I344 VanDerWaalsContact O-N 3.09Å; W341-L345 WeakPolarHBondContact O-CG 3.47Å; W341-L345 PolarHBondContact O-N 2.81Å
342	K	86.8	Confident	82.9	Confident	55 Å²	55	87.4 Å²	87.4	24%	0.239	42%	0.418	C	S	.	.	H	α-helix	trans	-57.9	-38.4	174.2	-66.3	-180	-177.7	170.6	0	112.1	Y334 D335 L337 P338 M339 A346	Y334-K342 HydrophobicContact CE1-CD 4.26Å; Y334-K342 HydrophobicContact CE1-CG 4.38Å; Y334-K342 WeakPolarHBondContact O-CE 3.4Å; D335-K342 PolarHBondContact O-NZ 3.08Å; L337-K342 HydrophobicContact CB-CG 4.17Å; L337-K342 VanDerWaalsContact O-CE 3.22Å; L337-K342 WeakPolarHBondContact O-CE 3.36Å; P338-K342 PolarHBondContact O-N 3.34Å; P338-K342 VanDerWaalsContact O-N 3.15Å; M339-K342 PolarHBondContact O-N 3.09Å; K342-A346 WeakPolarHBondContact O-CB 3.33Å; K342-A346 PolarHBondContact O-N 3.09Å
343	K	85.3	Confident	81.1	Confident	129 Å²	129	91 Å²	91	56%	0.561	43%	0.427	S	S	*	.	H	α-helix	trans	-66.4	-39.1	175.1	-74	179.9	180	-177.5	0	112.6	M339 Q340 W341 K347	M339-K343 WeakPolarHBondContact O-CG 3.38Å; M339-K343 PolarHBondContact O-N 3Å; M339-K343 VanDerWaalsContact O-N 3.13Å; Q340-K343 WeakPolarHBondContact O-CB 3.44Å; Q340-K343 PolarHBondContact O-N 3.25Å; W341-K343 VanDerWaalsContact C-N 3.25Å; W341-K343 PolarHBondContact O-N 2.93Å; K343-K347 PolarHBondContact O-N 3.21Å; K343-K347 VanDerWaalsContact O-N 3.15Å
344	I	84.8	Confident	78.9	Confident	91 Å²	91	97.1 Å²	97.1	47%	0.467	45%	0.454	S	S	.	.	H	α-helix	trans	-64.3	-50.3	176.1	-67.6	166.3	0	0	0	109.9	Q340 W341 A346 K347 I348	Q340-I344 WeakPolarHBondContact O-CG1 3.49Å; Q340-I344 PolarHBondContact O-N 3.29Å; Q340-I344 VanDerWaalsContact O-N 3.08Å; W341-I344 PolarHBondContact O-N 3.02Å; W341-I344 VanDerWaalsContact O-N 3.09Å; I344-A346 VanDerWaalsContact C-N 3.3Å; I344-A346 PolarHBondContact O-N 3.32Å; I344-K347 WeakPolarHBondContact O-CA 2.98Å; I344-K347 WeakPolarHBondContact O-CB 3.24Å; I344-K347 PolarHBondContact O-N 3.14Å; I344-I348 HydrophobicContact CG2-CD1 3.93Å; I344-I348 PolarHBondContact O-N 3.39Å
345	L	84.5	Confident	76.7	Confident	11 Å²	11	102.7 Å²	102.7	6%	0.058	48%	0.479	C	S	.	.	H	α-helix	trans	-56.8	-44.6	176.9	-68	171.1	0	0	0	111.3	I324 Y334 L337 W341 K347 I348 H349	I324-L345 HydrophobicContact CD1-CD1 4.02Å; I324-L345 HydrophobicContact CG1-CD1 4.04Å; I324-L345 HydrophobicContact CG2-CD2 4.26Å; Y334-L345 HydrophobicContact CE2-CD1 4.09Å; L337-L345 HydrophobicContact CD1-CD1 4.11Å; W341-L345 WeakPolarHBondContact O-CG 3.47Å; W341-L345 PolarHBondContact O-N 2.81Å; L345-K347 PolarHBondContact O-N 3.41Å; L345-I348 PolarHBondContact O-N 2.9Å; L345-H349 WeakPolarHBondContact O-CB 3.32Å; L345-H349 PolarHBondContact O-CD2 2.93Å; L345-H349 PolarHBondContact O-N 3.29Å
346	A	81	Confident	74.1	Confident	39 Å²	39	109.9 Å²	109.9	32%	0.322	50%	0.501	S	S	.	.	H	α-helix	trans	-64.5	-22.6	176.2	0	0	0	0	0	114.3	K342 I344 R350	K342-A346 WeakPolarHBondContact O-CB 3.33Å; K342-A346 PolarHBondContact O-N 3.09Å; I344-A346 VanDerWaalsContact C-N 3.3Å; I344-A346 PolarHBondContact O-N 3.32Å; A346-R350 WeakPolarHBondContact O-CG 3.22Å; A346-R350 PolarHBondContact O-NE 3.49Å
347	K	81.1	Confident	71.8	Confident	149 Å²	149	106 Å²	106	65%	0.648	50%	0.495	S	S	*	.	H	α-helix	trans	-77.2	-45.6	171.2	-76.6	-177.2	177.7	-175	0	111	K343 I344 L345 H349 R350 S351	K343-K347 PolarHBondContact O-N 3.21Å; K343-K347 VanDerWaalsContact O-N 3.15Å; I344-K347 WeakPolarHBondContact O-CA 2.98Å; I344-K347 WeakPolarHBondContact O-CB 3.24Å; I344-K347 PolarHBondContact O-N 3.14Å; L345-K347 PolarHBondContact O-N 3.41Å; K347-H349 PolarHBondContact O-N 3.24Å; K347-R350 WeakPolarHBondContact O-CB 3.35Å; K347-R350 PolarHBondContact O-N 3.48Å; K347-S351 PolarHBondContact O-N 3.15Å; K347-S351 PolarHBondContact O-OG 3.48Å
348	I	74.2	Confident	69.1	Low	73 Å²	73	114.3 Å²	114.3	37%	0.374	54%	0.54	S	S	.	.	H	α-helix	trans	-58.7	-48.5	178	-63.2	168.4	0	0	0	110.5	I344 L345 R350 S351 D352	I344-I348 HydrophobicContact CG2-CD1 3.93Å; I344-I348 PolarHBondContact O-N 3.39Å; L345-I348 PolarHBondContact O-N 2.9Å; I348-R350 PolarHBondContact O-N 3.34Å; I348-S351 WeakPolarHBondContact CA-OG 3.3Å; I348-S351 PolarHBondContact O-N 3.07Å; I348-S351 VanDerWaalsContact O-N 3.12Å; I348-S351 PolarHBondContact O-OG 2.81Å; I348-D352 PolarHBondContact O-N 3.29Å
349	H	70.2	Confident	68.1	Low	54 Å²	54	116.3 Å²	116.3	25%	0.25	54%	0.542	C	S	.	.	H	α-helix	trans	-62.5	-16.1	176.8	-76.8	-57.1	0	0	0	114.8	E323 L345 K347 R353	E323-H349 PolarHBondContact O-NE2 3.27Å; E323-H349 VanDerWaalsContact O-NE2 3.07Å; E323-H349 IonicContact OE1-CE1 2.76Å; E323-H349 IonicContact OE2-CE1 2.7Å; L345-H349 WeakPolarHBondContact O-CB 3.32Å; L345-H349 PolarHBondContact O-CD2 2.93Å; L345-H349 PolarHBondContact O-N 3.29Å; K347-H349 PolarHBondContact O-N 3.24Å; H349-R353 PolarHBondContact O-NE 3.34Å
350	R	69.3	Low	67.1	Low	149 Å²	149	115.3 Å²	115.3	56%	0.562	54%	0.536	S	S	*	.	H	α-helix	trans	-91	-42.2	173.1	-83.6	-177.2	-77.9	-158	-1	111.7	A346 K347 I348 D352 R353 Q354	A346-R350 WeakPolarHBondContact O-CG 3.22Å; A346-R350 PolarHBondContact O-NE 3.49Å; K347-R350 WeakPolarHBondContact O-CB 3.35Å; K347-R350 PolarHBondContact O-N 3.48Å; I348-R350 PolarHBondContact O-N 3.34Å; R350-D352 VanDerWaalsContact C-N 3.32Å; R350-D352 PolarHBondContact O-N 3.25Å; R350-R353 PolarHBondContact O-N 3.13Å; R350-Q354 PolarHBondContact O-N 3.48Å
351	S	64.4	Low	66	Low	50 Å²	50	113.2 Å²	113.2	35%	0.35	53%	0.526	S	S	.	.	H	α-helix	trans	-64.9	-36.9	177.5	50.6	0	0	0	0	112.4	K347 I348 R353 Q354 K355	K347-S351 PolarHBondContact O-N 3.15Å; K347-S351 PolarHBondContact O-OG 3.48Å; I348-S351 WeakPolarHBondContact CA-OG 3.3Å; I348-S351 PolarHBondContact O-N 3.07Å; I348-S351 VanDerWaalsContact O-N 3.12Å; I348-S351 PolarHBondContact O-OG 2.81Å; S351-R353 VanDerWaalsContact C-N 3.34Å; S351-R353 PolarHBondContact O-N 3.44Å; S351-Q354 PolarHBondContact O-N 3.41Å; S351-K355 PolarHBondContact O-N 3.12Å
352	D	56.7	Low	64.9	Low	73 Å²	73	110.9 Å²	110.9	39%	0.39	52%	0.523	S	S	.	.	H	α-helix	trans	-69.9	-32.7	179.6	-70.7	-19.2	0	0	0	111.9	I348 R350 Q354 K355	I348-D352 PolarHBondContact O-N 3.29Å; R350-D352 VanDerWaalsContact C-N 3.32Å; R350-D352 PolarHBondContact O-N 3.25Å; D352-Q354 VanDerWaalsContact C-N 3.33Å; D352-Q354 PolarHBondContact O-N 2.97Å; D352-K355 PolarHBondContact O-N 2.78Å
353	R	55.7	Low	63.5	Low	182 Å²	182	114.4 Å²	114.4	69%	0.687	54%	0.541	S	S	*	.	H	α-helix	trans	-67.2	-32.5	173.4	-84.5	-174.6	-88.5	-156.9	-7.4	113.5	H349 R350 S351 S357	H349-R353 PolarHBondContact O-NE 3.34Å; R350-R353 PolarHBondContact O-N 3.13Å; S351-R353 VanDerWaalsContact C-N 3.34Å; S351-R353 PolarHBondContact O-N 3.44Å; R353-S357 PolarHBondContact O-OG 3.39Å
354	Q	49.1	Very low	62.1	Low	144 Å²	144	113.5 Å²	113.5	67%	0.673	54%	0.539	S	S	*	.	H	α-helix	trans	-76.5	-26.2	178.9	-73.1	178.6	-17.4	0	0	113.2	R350 S351 D352 W356 S357	R350-Q354 PolarHBondContact O-N 3.48Å; S351-Q354 PolarHBondContact O-N 3.41Å; D352-Q354 VanDerWaalsContact C-N 3.33Å; D352-Q354 PolarHBondContact O-N 2.97Å; Q354-W356 VanDerWaalsContact C-N 3.31Å; Q354-W356 PolarHBondContact O-N 2.95Å; Q354-S357 PolarHBondContact O-OG 2.74Å
355	K	45.2	Very low	60.5	Low	157 Å²	157	115.1 Å²	115.1	68%	0.683	55%	0.545	S	S	*	.	H	α-helix	trans	-74.4	-16.1	-179.9	-81.3	-177.7	176	178	0	115	S351 D352	S351-K355 PolarHBondContact O-N 3.12Å; D352-K355 PolarHBondContact O-N 2.78Å
356	W	38.3	Very low	58.6	Low	228 Å²	228	123.1 Å²	123.1	86%	0.864	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.8	12.6	-177.5	-66.2	84.3	0	0	0	113.1	Q354	Q354-W356 VanDerWaalsContact C-N 3.31Å; Q354-W356 PolarHBondContact O-N 2.95Å
357	S	43	Very low	56.8	Low	91 Å²	91	130.1 Å²	130.1	64%	0.636	60%	0.604	S	S	*	*			trans	-111.2	7	175.1	27.8	0	0	0	0	113.7	R353 Q354	R353-S357 PolarHBondContact O-OG 3.39Å; Q354-S357 PolarHBondContact O-OG 2.74Å
358	N	33.8	Very low	54.5	Low	211 Å²	211	128.4 Å²	128.4	100%	1.128	60%	0.6	S	S	*	*			trans	-115.4	0	159.6	-73.4	-21.1	0	0	0	108.1

Retrieved 358 of 358 residues in 410.8 ms (Link to these results)

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