A0A087XUX7_POEFO Loading...

Interleukin 1 receptor accessory protein

AlphaFold DB , UniProt , Accession A0A087XUX7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 610 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.9	Very low	33.1	Very low	241 Å²	241	141 Å²	141	100%	1.187	78%	0.78	S	S	*	*				0	93	0	-70.9	-163.2	-88.6	0	0	106.9
2	A	31.4	Very low	32.9	Very low	98 Å²	98	144 Å²	144	81%	0.81	79%	0.792	S	S	*	*				76.4	121.9	117.8	0	0	0	0	0	111.9
3	S	30.5	Very low	32.9	Very low	104 Å²	104	143.5 Å²	143.5	73%	0.727	80%	0.796	S	S	*	*			cis	-162.6	135.9	42.6	-97.6	0	0	0	0	110
4	F	34.2	Very low	33	Very low	177 Å²	177	138.6 Å²	138.6	78%	0.776	79%	0.794	S	S	*	*				61.6	125.1	101.2	-90.3	-90.8	0	0	0	113.7	L6	F4-L6 HydrophobicContact CD1-CD1 4.29Å; F4-L6 HydrophobicContact CE1-CD1 4.1Å
5	V	36.3	Very low	32.5	Very low	126 Å²	126	146.2 Å²	146.2	76%	0.764	81%	0.805	S	S	*	*				-162.1	119	54.5	172.8	0	0	0	0	108.3
6	L	34.7	Very low	32.9	Very low	124 Å²	124	143.3 Å²	143.3	65%	0.649	81%	0.806	S	S	*	*				60.6	105.8	95	-108.8	100.5	0	0	0	115.9	F4	F4-L6 HydrophobicContact CD1-CD1 4.29Å; F4-L6 HydrophobicContact CE1-CD1 4.1Å
7	L	34.2	Very low	32.7	Very low	134 Å²	134	143.4 Å²	143.4	70%	0.702	81%	0.81	S	S	*	*				95	108.9	90	-117.8	126.6	0	0	0	112.1
8	F	31.5	Very low	32.6	Very low	181 Å²	181	138.8 Å²	138.8	79%	0.794	80%	0.8	S	S	*	*				67.4	132.3	90	-116.5	-80.7	0	0	0	116.1
9	L	29.3	Very low	32.8	Very low	139 Å²	139	141.6 Å²	141.6	73%	0.728	81%	0.805	S	S	*	*			trans	128.3	100.6	149.4	-68.1	169.9	0	0	0	112.2
10	L	31.4	Very low	32.7	Very low	144 Å²	144	141.1 Å²	141.1	75%	0.754	81%	0.805	S	S	*	*				78.2	102.7	87	-95.8	169.5	0	0	0	114
11	A	35	Very low	33.1	Very low	83 Å²	83	142 Å²	142	69%	0.686	81%	0.807	S	S	*	*			trans	25.6	126	138.4	0	0	0	0	0	119.9
12	L	30.6	Very low	33	Very low	177 Å²	177	137.1 Å²	137.1	93%	0.927	79%	0.786	S	S	*	*			trans	-152	125.8	135.9	-102.4	148.2	0	0	0	109.3
13	T	33	Very low	33.2	Very low	138 Å²	138	137.6 Å²	137.6	85%	0.847	78%	0.784	S	S	*	*			trans	-76.5	145.3	-173.8	45.3	0	0	0	0	113.3
14	G	33.4	Very low	33.9	Very low	74 Å²	74	139 Å²	139	76%	0.763	79%	0.788	S	S	*	*			trans	115	102.8	133.5	0	0	0	0	0	117.3
15	R	26.4	Very low	34.6	Very low	253 Å²	253	136.8 Å²	136.8	96%	0.955	78%	0.78	S	S	*	*				-158.4	135.9	129.6	-113	175.1	-179	168.9	0.6	110.9
16	A	38.8	Very low	35.5	Very low	100 Å²	100	134.4 Å²	134.4	83%	0.826	77%	0.767	S	S	*	*			trans	-66.7	146.6	-169.5	0	0	0	0	0	114
17	V	30.1	Very low	37.2	Very low	145 Å²	145	137.4 Å²	137.4	88%	0.879	78%	0.78	S	S	*	*			trans	-136.5	116.8	157.4	177.8	0	0	0	0	108.4
18	G	30.8	Very low	39.6	Very low	61 Å²	61	132.5 Å²	132.5	63%	0.629	76%	0.757	S	S	*	*			trans	53.9	102.4	144.2	0	0	0	0	0	119	T20	G18-T20 PolarHBondContact O-N 3.48Å; G18-T20 VanDerWaalsContact O-N 3.15Å
19	Q	34.9	Very low	42.4	Very low	191 Å²	191	129.2 Å²	129.2	89%	0.893	74%	0.744	S	S	*	*			trans	-55.1	112.6	146.8	-82.1	174.8	-28.5	0	0	109.3
20	T	30.8	Very low	45.2	Very low	132 Å²	132	126 Å²	126	81%	0.81	73%	0.727	S	S	*	*			trans	-96.5	110.7	147.7	45.3	0	0	0	0	106.6	G18 D22	G18-T20 PolarHBondContact O-N 3.48Å; G18-T20 VanDerWaalsContact O-N 3.15Å; T20-D22 VanDerWaalsContact C-N 3.31Å; T20-D22 PolarHBondContact O-N 3.11Å
21	N	40.9	Very low	47.8	Very low	159 Å²	159	125 Å²	125	85%	0.85	71%	0.714	S	S	*	*			trans	-59.1	97	164	-87.8	-13.9	0	0	0	107.7
22	D	35	Very low	50.3	Low	140 Å²	140	122.7 Å²	122.7	75%	0.749	70%	0.698	S	S	*	*			trans	-106.6	108.8	158.6	-149.5	5.6	0	0	0	106	T20 T24	T20-D22 VanDerWaalsContact C-N 3.31Å; T20-D22 PolarHBondContact O-N 3.11Å; D22-T24 PolarHBondContact O-N 2.94Å
23	S	36.1	Very low	53	Low	107 Å²	107	118.8 Å²	118.8	75%	0.748	68%	0.675	S	S	*	*			trans	-62.3	100.2	175.6	48.7	0	0	0	0	107.9	E25	S23-E25 PolarHBondContact O-N 2.78Å
24	T	44	Very low	55.4	Low	133 Å²	133	113.3 Å²	113.3	82%	0.816	64%	0.642	S	S	*	*			trans	-59.2	104.7	168.8	37.7	0	0	0	0	108	D22	D22-T24 PolarHBondContact O-N 2.94Å
25	E	49.7	Very low	57.4	Low	132 Å²	132	116 Å²	116	62%	0.617	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-54.3	127.3	165	-79.3	-162	120.6	0	0	107.5	S23 M27 R118	S23-E25 PolarHBondContact O-N 2.78Å; E25-M27 PolarHBondContact O-N 3.43Å; E25-M27 VanDerWaalsContact O-N 3.07Å; E25-R118 IonicContact OE1-CZ 2.67Å; E25-R118 IonicContact OE1-NH1 3.64Å; E25-R118 PolarHBondContact OE1-NH1 3.26Å; E25-R118 IonicContact OE1-NH2 3.91Å; E25-R118 PolarHBondContact OE1-NH2 2.96Å
26	P	54.8	Low	59.9	Low	76 Å²	76	108.2 Å²	108.2	49%	0.494	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-61.3	119.5	177.3	23.3	-30.7	0	0	0	108.3	C28	P26-C28 PolarHBondContact O-N 2.83Å; P26-C28 VanDerWaalsContact O-N 3.14Å
27	M	70.9	Confident	61.7	Low	187 Å²	187	107.8 Å²	107.8	92%	0.921	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-49.5	121.7	173.2	-86.2	179.8	53.7	0	0	109.2	E25	E25-M27 PolarHBondContact O-N 3.43Å; E25-M27 VanDerWaalsContact O-N 3.07Å
28	C	84.9	Confident	64.3	Low	31 Å²	31	102.7 Å²	102.7	21%	0.209	59%	0.593	C	S	.	*	P	Polyproline II helix	trans	-66.9	134.2	-178.4	-159.1	0	0	0	0	110.4	P26 D30 C123 S124	P26-C28 PolarHBondContact O-N 2.83Å; P26-C28 VanDerWaalsContact O-N 3.14Å; C28-D30 PolarHBondContact O-N 3.16Å; C28-C123 HydrophobicContact CB-CB 3.77Å; C28-C123 WeakPolarHBondContact CB-SG 3.47Å; C28-C123 WeakPolarHBondContact SG-CB 3.36Å; C28-C123 CovalentContact SG-SG 2.04Å; C28-C123 PolarHBondContact SG-SG 3.3Å; C28-S124 PolarHBondContact SG-N 3.3Å; C28-S124 VanDerWaalsContact SG-N 3.43Å
29	H	88.4	Confident	66.9	Low	112 Å²	112	101.1 Å²	101.1	52%	0.519	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.9	116.4	176.4	-174.9	62.9	0	0	0	109.9	W31 C123 S124 R125	H29-W31 AromaticContact CD2-CD1 3.93Å; H29-W31 AromaticContact CD2-CE2 3.97Å; H29-W31 AromaticContact CD2-NE1 3.52Å; H29-C123 WeakPolarHBondContact CB-O 3.46Å; H29-C123 PolarHBondContact N-O 3.07Å; H29-S124 CarbonylContact O-C 3.56Å; H29-S124 VanDerWaalsContact O-CA 3.29Å; H29-S124 WeakPolarHBondContact O-CA 3.29Å; H29-R125 PolarHBondContact O-N 2.72Å
30	D	89.4	Confident	69.4	Low	70 Å²	70	94.4 Å²	94.4	37%	0.374	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119	-176.2	-164.1	-10.7	0	0	0	110.8	C28 G32 R125	C28-D30 PolarHBondContact O-N 3.16Å; D30-G32 PolarHBondContact OD1-N 2.9Å; D30-R125 HydrophobicContact CB-CG 4.03Å; D30-R125 VanDerWaalsContact CG-NE 3.31Å; D30-R125 IonicContact OD1-NE 2.84Å; D30-R125 IonicContact OD2-CZ 2.75Å; D30-R125 IonicContact OD2-NE 3.4Å; D30-R125 PolarHBondContact OD2-NE 3.43Å; D30-R125 IonicContact OD2-NH2 3.53Å; D30-R125 PolarHBondContact OD2-NH2 3.39Å
31	W	85.8	Confident	72.2	Confident	125 Å²	125	88.5 Å²	88.5	47%	0.473	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-4.4	175.5	-68.7	77.2	0	0	0	112.7	H29 V59 R125 I126	H29-W31 AromaticContact CD2-CD1 3.93Å; H29-W31 AromaticContact CD2-CE2 3.97Å; H29-W31 AromaticContact CD2-NE1 3.52Å; W31-V59 HydrophobicContact CH2-CG1 4.32Å; W31-V59 HydrophobicContact CH2-CG2 4.27Å; W31-V59 HydrophobicContact CZ2-CG1 3.93Å; W31-V59 HydrophobicContact CZ2-CG2 4.38Å; W31-R125 PolarHBondContact N-O 2.73Å; W31-I126 HydrophobicContact CB-CB 4Å; W31-I126 HydrophobicContact CB-CD1 3.77Å; W31-I126 HydrophobicContact CB-CG1 3.88Å; W31-I126 HydrophobicContact CG-CD1 4.49Å
32	G	87.4	Confident	74.4	Confident	34 Å²	34	81.3 Å²	81.3	35%	0.351	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	77.4	-149.9	-174.9	0	0	0	0	0	112.2	D30 I126 A127	D30-G32 PolarHBondContact OD1-N 2.9Å; G32-I126 WeakPolarHBondContact O-CG1 3.27Å; G32-A127 PolarHBondContact O-N 2.97Å
33	E	87.1	Confident	77	Confident	95 Å²	95	76.9 Å²	76.9	44%	0.444	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	135.5	176.8	-171.6	163.6	-147.7	0	0	110.7	S35 Q112 A127 R129	E33-S35 PolarHBondContact O-N 3.44Å; E33-Q112 PolarHBondContact OE1-NE2 3.48Å; E33-Q112 PolarHBondContact OE2-NE2 3.4Å; E33-A127 HydrophobicContact CB-CB 4.42Å; E33-R129 WeakPolarHBondContact OE1-CB 3.18Å; E33-R129 WeakPolarHBondContact OE1-CD 3.46Å
34	S	84.6	Confident	79.5	Confident	22 Å²	22	73.5 Å²	73.5	15%	0.154	43%	0.425	C	S	.	.			trans	-55.7	137.1	178.2	-175.9	0	0	0	0	111.1	E36 A127	S34-E36 PolarHBondContact O-N 3.39Å; S34-E36 WeakPolarHBondContact OG-CB 3.45Å; S34-E36 WeakPolarHBondContact OG-CG 3.33Å; S34-E36 PolarHBondContact OG-N 2.97Å; S34-A127 PolarHBondContact N-O 3.41Å
35	S	75.4	Confident	81.7	Confident	132 Å²	132	68.3 Å²	68.3	92%	0.923	39%	0.391	S	S	*	.	S	Bend	trans	-71.6	-8.3	171.1	60.9	0	0	0	0	113.1	E33	E33-S35 PolarHBondContact O-N 3.44Å
36	E	77.4	Confident	83.7	Confident	88 Å²	88	62.1 Å²	62.1	41%	0.411	36%	0.363	S	S	.	.	S	Bend	trans	-63.1	146	171.7	-66.9	-177.9	179	0	0	110.4	S34 S55	S34-E36 PolarHBondContact O-N 3.39Å; S34-E36 WeakPolarHBondContact OG-CB 3.45Å; S34-E36 WeakPolarHBondContact OG-CG 3.33Å; S34-E36 PolarHBondContact OG-N 2.97Å; E36-S55 PolarHBondContact OE1-OG 3.12Å
37	A	77.9	Confident	85.3	Confident	91 Å²	91	58.6 Å²	58.6	75%	0.752	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-58.2	147.8	176.1	0	0	0	0	0	111	V39	A37-V39 PolarHBondContact O-N 3.32Å
38	A	83	Confident	86.2	Confident	39 Å²	39	50.8 Å²	50.8	32%	0.322	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-52.7	138.6	177.3	0	0	0	0	0	111.2	L40 R129	A38-L40 HydrophobicContact CB-CD2 4.43Å; A38-L40 PolarHBondContact O-N 2.8Å; A38-R129 HydrophobicContact CB-CB 3.86Å; A38-R129 HydrophobicContact CB-CG 3.99Å
39	V	86.2	Confident	86.4	Confident	28 Å²	28	49.3 Å²	49.3	17%	0.17	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	119	174.4	-177.6	0	0	0	0	107.9	A37 V41 V128 R129 L130 Q131	A37-V39 PolarHBondContact O-N 3.32Å; V39-V41 HydrophobicContact CG1-CG2 4.26Å; V39-V128 HydrophobicContact CG2-CG2 4.02Å; V39-R129 PolarHBondContact N-O 2.87Å; V39-L130 HydrophobicContact CB-CD1 4.04Å; V39-L130 HydrophobicContact CG1-CD1 3.93Å; V39-L130 WeakPolarHBondContact O-CA 3.38Å; V39-Q131 PolarHBondContact O-N 2.98Å
40	L	87.6	Confident	86.5	Confident	49 Å²	49	45.9 Å²	45.9	26%	0.257	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.3	-178.4	-57	-179.5	0	0	0	110	A38 Q131 A148 M149	A38-L40 HydrophobicContact CB-CD2 4.43Å; A38-L40 PolarHBondContact O-N 2.8Å; L40-Q131 WeakPolarHBondContact CA-O 3.36Å; L40-Q131 HydrophobicContact CD2-CB 3.76Å; L40-Q131 HydrophobicContact CD2-CG 4.37Å; L40-A148 HydrophobicContact CB-CB 3.88Å; L40-A148 WeakPolarHBondContact CB-O 3.45Å; L40-A148 WeakPolarHBondContact CD1-O 3.44Å; L40-M149 WeakPolarHBondContact O-CG 3.07Å
41	V	88.7	Confident	86.5	Confident	9 Å²	9	42.6 Å²	42.6	6%	0.055	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.4	177.7	-177.4	0	0	0	0	108.9	V39 A105 L130 Q131 V132 L133	V39-V41 HydrophobicContact CG1-CG2 4.26Å; V41-A105 HydrophobicContact CB-CB 4.46Å; V41-A105 HydrophobicContact CG1-CB 3.71Å; V41-L130 HydrophobicContact CB-CD1 4.49Å; V41-L130 HydrophobicContact CG2-CD1 3.77Å; V41-Q131 PolarHBondContact N-O 2.66Å; V41-V132 CarbonylContact O-C 3.6Å; V41-V132 VanDerWaalsContact O-CA 3.28Å; V41-V132 WeakPolarHBondContact O-CA 3.26Å; V41-L133 PolarHBondContact O-N 3Å
42	L	88.8	Confident	86.7	Confident	7 Å²	7	37.1 Å²	37.1	4%	0.037	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	143.1	173.7	-71.2	172	0	0	0	111.4	G44 E45 L133 A138 Q146 A148	L42-G44 PolarHBondContact O-N 3.21Å; L42-E45 HydrophobicContact CB-CB 4.28Å; L42-E45 HydrophobicContact CB-CG 3.89Å; L42-E45 WeakPolarHBondContact O-CB 3.38Å; L42-E45 PolarHBondContact O-N 2.78Å; L42-L133 HydrophobicContact CD2-CB 4.23Å; L42-A138 HydrophobicContact CD2-CB 4.32Å; L42-Q146 VanDerWaalsContact CD1-C 3.49Å; L42-Q146 HydrophobicContact CD1-CB 3.87Å; L42-Q146 WeakPolarHBondContact CD1-O 3.33Å; L42-Q146 HydrophobicContact CD2-CB 4.22Å; L42-A148 HydrophobicContact CD2-CB 4Å; L42-A148 HydrophobicContact CG-CB 3.73Å
43	D	89.5	Confident	86.7	Confident	48 Å²	48	35.5 Å²	35.5	26%	0.257	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	125.9	174	-170	26.4	0	0	0	111.3	V106 A107 V132 L133	D43-V106 VanDerWaalsContact OD1-CA 3.27Å; D43-V106 WeakPolarHBondContact OD1-CA 3.39Å; D43-A107 PolarHBondContact OD1-N 3.31Å; D43-A107 VanDerWaalsContact OD1-N 3.11Å; D43-V132 HydrophobicContact CB-CG1 4.05Å; D43-L133 WeakPolarHBondContact CB-O 3.31Å; D43-L133 PolarHBondContact N-O 2.99Å
44	G	88.1	Confident	86.6	Confident	35 Å²	35	32.4 Å²	32.4	36%	0.361	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	-2.8	-174.7	0	0	0	0	0	115.8	L42 P104 A105	L42-G44 PolarHBondContact O-N 3.21Å; G44-P104 WeakPolarHBondContact O-CB 3.11Å; G44-A105 PolarHBondContact N-O 3.43Å
45	E	90.8	Very high	86.3	Confident	24 Å²	24	32.8 Å²	32.8	11%	0.112	21%	0.213	C	C	.	.	S	Bend	trans	-93.4	161.2	174.2	-67.7	-162.4	160.8	0	0	112.7	L42 A105 S238 F239 T240	L42-E45 HydrophobicContact CB-CB 4.28Å; L42-E45 HydrophobicContact CB-CG 3.89Å; L42-E45 WeakPolarHBondContact O-CB 3.38Å; L42-E45 PolarHBondContact O-N 2.78Å; E45-A105 PolarHBondContact O-N 2.68Å; E45-S238 CarbonylContact C-O 3.59Å; E45-S238 VanDerWaalsContact CA-O 3.25Å; E45-S238 WeakPolarHBondContact CA-O 3.17Å; E45-S238 WeakPolarHBondContact CB-O 3.36Å; E45-F239 WeakPolarHBondContact OE2-CA 3.38Å; E45-T240 WeakPolarHBondContact OE1-CB 3.29Å; E45-T240 PolarHBondContact OE1-N 3.43Å; E45-T240 PolarHBondContact OE1-OG1 2.97Å; E45-T240 PolarHBondContact OE2-N 2.83Å
46	A	90.6	Very high	85.6	Confident	3 Å²	3	34.7 Å²	34.7	3%	0.025	21%	0.207	C	C	.	.			trans	-75.2	122.5	170	0	0	0	0	0	110.4	L102 Q103 Y230 S238	A46-L102 WeakPolarHBondContact CA-O 3.39Å; A46-Q103 HydrophobicContact CB-CG 4Å; A46-Y230 HydrophobicContact CB-CE1 4.31Å; A46-Y230 WeakPolarHBondContact CB-OH 3.12Å; A46-S238 PolarHBondContact N-O 2.92Å
47	G	88.9	Confident	84.9	Confident	2 Å²	2	35.7 Å²	35.7	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	166.8	177	0	0	0	0	0	112.1	L102	G47-L102 PolarHBondContact N-O 3.21Å; G47-L102 PolarHBondContact O-N 2.83Å
48	W	88.8	Confident	84.7	Confident	23 Å²	23	34.2 Å²	34.2	9%	0.087	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	157.7	171.5	63.5	97.2	0	0	0	111.5	L100 W101 N168	W48-L100 CarbonylContact C-O 3.49Å; W48-L100 WeakPolarHBondContact CA-O 3.47Å; W48-L100 VanDerWaalsContact CB-O 3.32Å; W48-L100 WeakPolarHBondContact CB-O 3.4Å; W48-W101 HydrophobicContact CB-CD2 3.74Å; W48-W101 HydrophobicContact CB-CE3 3.75Å; W48-W101 HydrophobicContact CB-CG 4.2Å; W48-W101 HydrophobicContact CB-CH2 4.3Å; W48-W101 HydrophobicContact CB-CZ2 4.33Å; W48-W101 HydrophobicContact CB-CZ3 4.05Å; W48-W101 HydrophobicContact CD2-CE3 4.14Å; W48-W101 AromaticContact CD2-CH2 3.48Å; W48-W101 HydrophobicContact CD2-CH2 3.48Å; W48-W101 VanDerWaalsContact CD2-CH2 3.48Å; W48-W101 HydrophobicContact CD2-CZ2 4.16Å; W48-W101 AromaticContact CD2-CZ3 3.51Å; W48-W101 HydrophobicContact CD2-CZ3 3.51Å; W48-W101 AromaticContact CE2-CH2 3.87Å; W48-W101 AromaticContact CE3-CE3 3.83Å; W48-W101 HydrophobicContact CE3-CE3 3.83Å; W48-W101 AromaticContact CE3-CH2 3.51Å; W48-W101 HydrophobicContact CE3-CH2 3.51Å; W48-W101 AromaticContact CE3-CZ3 3.09Å; W48-W101 HydrophobicContact CE3-CZ3 3.09Å; W48-W101 HydrophobicContact CG-CD2 4.35Å; W48-W101 HydrophobicContact CG-CE3 4.18Å; W48-W101 AromaticContact CG-CH2 3.88Å; W48-W101 HydrophobicContact CG-CH2 3.88Å; W48-W101 HydrophobicContact CG-CZ2 4.09Å; W48-W101 AromaticContact CG-CZ3 3.97Å; W48-W101 HydrophobicContact CG-CZ3 3.97Å; W48-W101 HydrophobicContact CH2-CH2 4.15Å; W48-W101 HydrophobicContact CH2-CZ3 4.31Å; W48-W101 HydrophobicContact CZ2-CH2 4.13Å; W48-W101 AromaticContact CZ3-CH2 3.88Å; W48-W101 HydrophobicContact CZ3-CH2 3.88Å; W48-W101 AromaticContact CZ3-CZ3 3.59Å; W48-W101 HydrophobicContact CZ3-CZ3 3.59Å; W48-N168 HydrophobicContact CH2-CB 3.34Å; W48-N168 VanDerWaalsContact CH2-ND2 3.29Å; W48-N168 WeakPolarHBondContact CH2-ND2 3.27Å; W48-N168 HydrophobicContact CZ2-CB 3.45Å; W48-N168 VanDerWaalsContact CZ2-CB 3.45Å; W48-N168 VanDerWaalsContact CZ2-CG 3.42Å; W48-N168 WeakPolarHBondContact CZ2-ND2 3.23Å
49	V	90.6	Very high	84.3	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126.7	176.3	-178.3	0	0	0	0	107.4	W74 R99 L100 L102 V128 L130	V49-W74 HydrophobicContact CB-CH2 4.41Å; V49-W74 HydrophobicContact CG1-CH2 3.85Å; V49-W74 HydrophobicContact CG1-CZ3 3.99Å; V49-R99 CarbonylContact O-C 3.58Å; V49-R99 WeakPolarHBondContact O-CA 3.19Å; V49-L100 PolarHBondContact N-O 3.35Å; V49-L100 PolarHBondContact O-N 2.59Å; V49-L102 HydrophobicContact CG2-CD1 4.4Å; V49-V128 HydrophobicContact CG1-CB 4.28Å; V49-V128 HydrophobicContact CG1-CG1 3.17Å; V49-V128 HydrophobicContact CG1-CG2 4.11Å; V49-L130 HydrophobicContact CG2-CB 4.15Å; V49-L130 HydrophobicContact CG2-CD1 3.96Å; V49-L130 HydrophobicContact CG2-CD2 4.22Å; V49-L130 HydrophobicContact CG2-CG 4.33Å
50	S	89.9	Confident	83.9	Confident	40 Å²	40	37.7 Å²	37.7	28%	0.28	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	142.2	174.4	-61.1	0	0	0	0	109.3	P52	S50-P52 WeakPolarHBondContact O-CD 3.36Å
51	C	90.4	Very high	83.7	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.007	23%	0.228	C	C	.	.			trans	-71.9	119.3	177.5	176.1	0	0	0	0	111.1	L53 F54 W74 E98 C115	C51-L53 PolarHBondContact O-N 2.77Å; C51-L53 VanDerWaalsContact O-N 3.11Å; C51-F54 HydrophobicContact CB-CD2 3.82Å; C51-F54 HydrophobicContact CB-CE2 4.12Å; C51-F54 PolarHBondContact O-N 3.15Å; C51-W74 HydrophobicContact CB-CH2 3.96Å; C51-W74 HydrophobicContact CB-CZ2 3.66Å; C51-E98 WeakPolarHBondContact CB-O 3.48Å; C51-E98 PolarHBondContact N-O 3.22Å; C51-C115 WeakPolarHBondContact CA-SG 3.16Å; C51-C115 HydrophobicContact CB-CB 3.56Å; C51-C115 WeakPolarHBondContact CB-SG 3.43Å; C51-C115 WeakPolarHBondContact SG-CB 3.48Å; C51-C115 CovalentContact SG-SG 2.04Å; C51-C115 PolarHBondContact SG-SG 3.04Å
52	P	88.9	Confident	83.4	Confident	9 Å²	9	41.1 Å²	41.1	6%	0.058	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-63.1	-19.8	-175.7	-24.1	33.4	0	0	0	115.2	S50 F54 S55 I126 V128	S50-P52 WeakPolarHBondContact O-CD 3.36Å; P52-F54 PolarHBondContact O-N 3.4Å; P52-S55 VanDerWaalsContact CA-OG 3.29Å; P52-S55 WeakPolarHBondContact CA-OG 3.5Å; P52-S55 PolarHBondContact O-N 3.26Å; P52-S55 VanDerWaalsContact O-N 3.15Å; P52-S55 PolarHBondContact O-OG 2.9Å; P52-I126 HydrophobicContact CB-CD1 4.06Å; P52-I126 HydrophobicContact CB-CG2 3.98Å; P52-I126 HydrophobicContact CG-CG2 4.05Å; P52-V128 HydrophobicContact CG-CB 4.01Å; P52-V128 HydrophobicContact CG-CG1 4.36Å
53	L	87.2	Confident	83.2	Confident	1 Å²	1	45 Å²	45	1%	0.005	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-58.4	-20.8	173.6	-62.5	177.7	0	0	0	113	C51 V59 Y60 L117 I126	C51-L53 PolarHBondContact O-N 2.77Å; C51-L53 VanDerWaalsContact O-N 3.11Å; L53-V59 PolarHBondContact O-N 2.93Å; L53-V59 VanDerWaalsContact O-N 3.17Å; L53-Y60 HydrophobicContact CB-CD2 4.24Å; L53-Y60 PolarHBondContact O-N 3.5Å; L53-L117 HydrophobicContact CD1-CB 3.87Å; L53-I126 HydrophobicContact CD1-CG2 4.46Å; L53-I126 HydrophobicContact CD2-CB 4.23Å; L53-I126 HydrophobicContact CD2-CG2 3.87Å; L53-I126 HydrophobicContact CG-CG2 3.67Å
54	F	85.8	Confident	82.9	Confident	29 Å²	29	48.8 Å²	48.8	13%	0.127	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-114.5	-2.7	179.1	-48.3	-74.4	0	0	0	113.5	C51 P52 Y60 Y62 A65 L72 E98 L117	C51-F54 HydrophobicContact CB-CD2 3.82Å; C51-F54 HydrophobicContact CB-CE2 4.12Å; C51-F54 PolarHBondContact O-N 3.15Å; P52-F54 PolarHBondContact O-N 3.4Å; F54-Y60 WeakPolarHBondContact CD1-O 3.39Å; F54-Y62 HydrophobicContact CD2-CD2 4.39Å; F54-Y62 HydrophobicContact CE1-CD2 4.22Å; F54-Y62 HydrophobicContact CE2-CD2 4.08Å; F54-Y62 AromaticContact CZ-CD2 3.97Å; F54-Y62 HydrophobicContact CZ-CD2 3.97Å; F54-A65 HydrophobicContact CE1-CB 4.08Å; F54-L72 HydrophobicContact CE2-CD1 4.03Å; F54-L72 HydrophobicContact CE2-CD2 4.01Å; F54-E98 HydrophobicContact CD2-CB 3.72Å; F54-E98 HydrophobicContact CE2-CB 4.24Å; F54-E98 HydrophobicContact CG-CB 4.33Å; F54-L117 HydrophobicContact CE1-CD2 4.19Å; F54-L117 HydrophobicContact CZ-CD1 3.96Å; F54-L117 HydrophobicContact CZ-CD2 3.92Å; F54-L117 HydrophobicContact CZ-CG 4.49Å
55	S	77.3	Confident	82.7	Confident	30 Å²	30	47.4 Å²	47.4	21%	0.21	26%	0.261	C	S	.	.	S	Bend	trans	-98.3	158.6	177.3	69.1	0	0	0	0	111.6	E36 P52 P57 A58	E36-S55 PolarHBondContact OE1-OG 3.12Å; P52-S55 VanDerWaalsContact CA-OG 3.29Å; P52-S55 WeakPolarHBondContact CA-OG 3.5Å; P52-S55 PolarHBondContact O-N 3.26Å; P52-S55 VanDerWaalsContact O-N 3.15Å; P52-S55 PolarHBondContact O-OG 2.9Å; S55-P57 CarbonylContact O-C 3.49Å; S55-A58 WeakPolarHBondContact O-CA 3.42Å; S55-A58 PolarHBondContact O-N 3.21Å
56	H	60.7	Low	82.4	Confident	173 Å²	173	51.9 Å²	51.9	80%	0.801	28%	0.282	S	S	*	.	S	Bend	trans	-67	127.3	-170.3	-171.5	68.1	0	0	0	112.7
57	P	62.8	Low	82.1	Confident	108 Å²	108	56.6 Å²	56.6	70%	0.701	32%	0.315	S	S	*	.	S	Bend	cis	-77.3	115.3	-0.3	30.2	-32.2	0	0	0	112.3	S55 V59	S55-P57 CarbonylContact O-C 3.49Å; P57-V59 PolarHBondContact O-N 3.49Å
58	A	73.4	Confident	81.8	Confident	60 Å²	60	59.3 Å²	59.3	50%	0.496	34%	0.337	S	S	.	.			trans	-70.5	117.5	-172.1	0	0	0	0	0	110.6	S55	S55-A58 WeakPolarHBondContact O-CA 3.42Å; S55-A58 PolarHBondContact O-N 3.21Å
59	V	75.1	Confident	81.5	Confident	67 Å²	67	60.4 Å²	60.4	41%	0.406	36%	0.356	S	S	.	.	S	Bend	trans	-75.3	-35.2	177	-174.6	0	0	0	0	110.4	W31 L53 P57	W31-V59 HydrophobicContact CH2-CG1 4.32Å; W31-V59 HydrophobicContact CH2-CG2 4.27Å; W31-V59 HydrophobicContact CZ2-CG1 3.93Å; W31-V59 HydrophobicContact CZ2-CG2 4.38Å; L53-V59 PolarHBondContact O-N 2.93Å; L53-V59 VanDerWaalsContact O-N 3.17Å; P57-V59 PolarHBondContact O-N 3.49Å
60	Y	78.7	Confident	81.3	Confident	73 Å²	73	62.1 Å²	62.1	29%	0.286	36%	0.363	S	S	.	.	S	Bend	trans	-130.5	154.4	179.4	-63	-83.3	0	0	0	111.2	L53 F54 L117 S124	L53-Y60 HydrophobicContact CB-CD2 4.24Å; L53-Y60 PolarHBondContact O-N 3.5Å; F54-Y60 WeakPolarHBondContact CD1-O 3.39Å; Y60-L117 HydrophobicContact CD1-CD2 4.36Å; Y60-L117 HydrophobicContact CD2-CD2 4.12Å; Y60-L117 HydrophobicContact CE2-CD2 4.49Å; Y60-L117 HydrophobicContact CG-CD2 4.04Å; Y60-S124 PolarHBondContact OH-OG 3.35Å
61	N	83.1	Confident	81.2	Confident	87 Å²	87	64.5 Å²	64.5	47%	0.465	37%	0.373	S	S	.	.			trans	-97.1	125.7	166.5	-178.1	-22.2	0	0	0	109	T63 M64 A65	N61-T63 PolarHBondContact O-N 2.92Å; N61-T63 PolarHBondContact OD1-N 3.19Å; N61-T63 PolarHBondContact OD1-OG1 3.08Å; N61-T63 VanDerWaalsContact OD1-OG1 3.1Å; N61-M64 HydrophobicContact CB-CB 4.1Å; N61-M64 HydrophobicContact CB-CG 4.07Å; N61-M64 HydrophobicContact CB-SD 4Å; N61-M64 PolarHBondContact O-N 3.06Å; N61-A65 VanDerWaalsContact O-CB 3.31Å; N61-A65 WeakPolarHBondContact O-CB 3.45Å; N61-A65 PolarHBondContact O-N 3.27Å
62	Y	82.9	Confident	81.2	Confident	44 Å²	44	64.8 Å²	64.8	17%	0.173	38%	0.375	C	S	.	.	H	α-helix	trans	-55.8	-47.9	-174.5	-179.5	-98.5	0	0	0	113.1	F54 M64 A65 Q66 L72 R97 E98	F54-Y62 HydrophobicContact CD2-CD2 4.39Å; F54-Y62 HydrophobicContact CE1-CD2 4.22Å; F54-Y62 HydrophobicContact CE2-CD2 4.08Å; F54-Y62 AromaticContact CZ-CD2 3.97Å; F54-Y62 HydrophobicContact CZ-CD2 3.97Å; Y62-M64 PolarHBondContact O-N 2.9Å; Y62-A65 PolarHBondContact O-N 2.95Å; Y62-Q66 WeakPolarHBondContact O-CB 3.37Å; Y62-Q66 PolarHBondContact O-N 3.12Å; Y62-L72 HydrophobicContact CE2-CD2 4.15Å; Y62-R97 HydrophobicContact CE1-CB 3.96Å; Y62-R97 HydrophobicContact CE1-CG 4.34Å; Y62-R97 WeakPolarHBondContact OH-CA 3.19Å; Y62-E98 HydrophobicContact CD2-CB 3.7Å; Y62-E98 HydrophobicContact CE2-CB 4.08Å; Y62-E98 HydrophobicContact CG-CB 4.31Å
63	T	84.5	Confident	81.2	Confident	89 Å²	89	66.5 Å²	66.5	55%	0.546	39%	0.385	S	S	.	.	H	α-helix	trans	-67.8	-38.5	-177.1	55.2	0	0	0	0	111.6	N61 S67	N61-T63 PolarHBondContact O-N 2.92Å; N61-T63 PolarHBondContact OD1-N 3.19Å; N61-T63 PolarHBondContact OD1-OG1 3.08Å; N61-T63 VanDerWaalsContact OD1-OG1 3.1Å; T63-S67 WeakPolarHBondContact O-CB 3.36Å; T63-S67 PolarHBondContact O-N 3.46Å; T63-S67 PolarHBondContact O-OG 3.07Å
64	M	83.2	Confident	81.5	Confident	126 Å²	126	66.5 Å²	66.5	62%	0.621	39%	0.385	S	S	*	.	H	α-helix	trans	-68.3	-44.7	176.5	-64	-178.3	122.6	0	0	111.3	N61 Y62 Q66 S67 A68	N61-M64 HydrophobicContact CB-CB 4.1Å; N61-M64 HydrophobicContact CB-CG 4.07Å; N61-M64 HydrophobicContact CB-SD 4Å; N61-M64 PolarHBondContact O-N 3.06Å; Y62-M64 PolarHBondContact O-N 2.9Å; M64-Q66 VanDerWaalsContact C-N 3.32Å; M64-Q66 PolarHBondContact O-N 2.72Å; M64-S67 WeakPolarHBondContact CA-OG 3.43Å; M64-S67 PolarHBondContact O-N 3.12Å; M64-S67 PolarHBondContact O-OG 3.16Å; M64-A68 WeakPolarHBondContact O-CB 3.31Å; M64-A68 PolarHBondContact O-N 3.09Å
65	A	83.8	Confident	81.8	Confident	7 Å²	7	68.3 Å²	68.3	6%	0.058	39%	0.391	C	S	.	.	H	α-helix	trans	-59.6	-42.9	177.2	0	0	0	0	0	111.6	F54 N61 Y62 A68 G69 H70 L117	F54-A65 HydrophobicContact CE1-CB 4.08Å; N61-A65 VanDerWaalsContact O-CB 3.31Å; N61-A65 WeakPolarHBondContact O-CB 3.45Å; N61-A65 PolarHBondContact O-N 3.27Å; Y62-A65 PolarHBondContact O-N 2.95Å; A65-A68 PolarHBondContact O-N 2.83Å; A65-G69 PolarHBondContact O-N 3.44Å; A65-H70 HydrophobicContact CB-CB 4.42Å; A65-H70 WeakPolarHBondContact O-CB 3.25Å; A65-H70 PolarHBondContact O-CD2 3.42Å; A65-H70 PolarHBondContact O-N 3.03Å; A65-L117 HydrophobicContact CB-CD2 4.11Å
66	Q	83.6	Confident	82.5	Confident	117 Å²	117	68.8 Å²	68.8	55%	0.547	39%	0.388	S	S	.	.	H	α-helix	trans	-65	-42.9	175.8	-167.8	172.2	33	0	0	111.8	Y62 M64 A68 G69	Y62-Q66 WeakPolarHBondContact O-CB 3.37Å; Y62-Q66 PolarHBondContact O-N 3.12Å; M64-Q66 VanDerWaalsContact C-N 3.32Å; M64-Q66 PolarHBondContact O-N 2.72Å; Q66-A68 VanDerWaalsContact C-N 3.26Å; Q66-A68 PolarHBondContact O-N 2.71Å; Q66-G69 PolarHBondContact O-N 2.92Å; Q66-G69 VanDerWaalsContact O-N 3.1Å
67	S	84.3	Confident	84	Confident	103 Å²	103	62.4 Å²	62.4	72%	0.72	36%	0.36	S	S	*	.	H	α-helix	trans	-64.9	-29.2	176.7	73.2	0	0	0	0	113.4	T63 M64 G69	T63-S67 WeakPolarHBondContact O-CB 3.36Å; T63-S67 PolarHBondContact O-N 3.46Å; T63-S67 PolarHBondContact O-OG 3.07Å; M64-S67 WeakPolarHBondContact CA-OG 3.43Å; M64-S67 PolarHBondContact O-N 3.12Å; M64-S67 PolarHBondContact O-OG 3.16Å; S67-G69 PolarHBondContact O-N 2.67Å
68	A	82.2	Confident	85.3	Confident	58 Å²	58	58.4 Å²	58.4	48%	0.479	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	1.9	176.1	0	0	0	0	0	113.4	M64 A65 Q66 N119	M64-A68 WeakPolarHBondContact O-CB 3.31Å; M64-A68 PolarHBondContact O-N 3.09Å; A65-A68 PolarHBondContact O-N 2.83Å; Q66-A68 VanDerWaalsContact C-N 3.26Å; Q66-A68 PolarHBondContact O-N 2.71Å; A68-N119 PolarHBondContact O-ND2 3.22Å
69	G	83.4	Confident	85.8	Confident	47 Å²	47	59.4 Å²	59.4	49%	0.485	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	19.3	176	0	0	0	0	0	114.8	A65 Q66 S67 N119	A65-G69 PolarHBondContact O-N 3.44Å; Q66-G69 PolarHBondContact O-N 2.92Å; Q66-G69 VanDerWaalsContact O-N 3.1Å; S67-G69 PolarHBondContact O-N 2.67Å; G69-N119 PolarHBondContact O-OD1 3.36Å
70	H	85.8	Confident	85.9	Confident	35 Å²	35	60.2 Å²	60.2	16%	0.162	35%	0.352	C	S	.	.			trans	-77.3	136.8	169.9	-65.2	-108.3	0	0	0	111	A65 L117 R118 N119 S122	A65-H70 HydrophobicContact CB-CB 4.42Å; A65-H70 WeakPolarHBondContact O-CB 3.25Å; A65-H70 PolarHBondContact O-CD2 3.42Å; A65-H70 PolarHBondContact O-N 3.03Å; H70-L117 HydrophobicContact CB-CD1 3.53Å; H70-L117 HydrophobicContact CB-CD2 4.34Å; H70-L117 HydrophobicContact CB-CG 3.78Å; H70-R118 CarbonylContact C-O 3.57Å; H70-R118 WeakPolarHBondContact CA-O 3.3Å; H70-N119 HydrophobicContact CB-CB 4.49Å; H70-S122 PolarHBondContact CE1-OG 3.27Å
71	D	88	Confident	86.2	Confident	91 Å²	91	61.3 Å²	61.3	49%	0.487	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	137.4	170.6	-169.8	20.1	0	0	0	110.6	R95 L117 R118	D71-R95 IonicContact OD1-NH1 2.86Å; D71-L117 WeakPolarHBondContact O-CA 3.46Å; D71-R118 PolarHBondContact N-O 3.1Å; D71-R118 PolarHBondContact O-N 3.46Å
72	L	89.8	Confident	86.1	Confident	7 Å²	7	64.8 Å²	64.8	4%	0.037	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	109.6	-179.2	178.4	65.8	0	0	0	109.8	F54 Y62 R95 E98 C115 M116 L117	F54-L72 HydrophobicContact CE2-CD1 4.03Å; F54-L72 HydrophobicContact CE2-CD2 4.01Å; Y62-L72 HydrophobicContact CE2-CD2 4.15Å; L72-R95 PolarHBondContact O-NH1 3.06Å; L72-E98 HydrophobicContact CD2-CB 4.49Å; L72-C115 HydrophobicContact CD1-CB 4.06Å; L72-M116 WeakPolarHBondContact CA-O 3.27Å; L72-L117 HydrophobicContact CB-CD1 4.23Å; L72-L117 HydrophobicContact CD1-CD1 4.42Å
73	V	90.4	Very high	86.3	Confident	44 Å²	44	69 Å²	69	27%	0.267	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	143.8	-180	-171.9	0	0	0	0	109.7	Y75 M116	V73-Y75 HydrophobicContact CB-CE2 4.25Å; V73-Y75 HydrophobicContact CG1-CD2 4.33Å; V73-Y75 HydrophobicContact CG1-CE2 3.68Å; V73-M116 PolarHBondContact N-O 2.65Å; V73-M116 PolarHBondContact O-N 2.98Å
74	W	93.1	Very high	86.6	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.008	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135.8	177.1	-75	90.5	0	0	0	111.5	V49 C51 I87 L100 I114 C115 V128	V49-W74 HydrophobicContact CB-CH2 4.41Å; V49-W74 HydrophobicContact CG1-CH2 3.85Å; V49-W74 HydrophobicContact CG1-CZ3 3.99Å; C51-W74 HydrophobicContact CB-CH2 3.96Å; C51-W74 HydrophobicContact CB-CZ2 3.66Å; W74-I87 HydrophobicContact CB-CD1 3.65Å; W74-I87 HydrophobicContact CB-CG1 4.22Å; W74-I87 PolarHBondContact O-N 2.82Å; W74-L100 HydrophobicContact CD2-CB 4.16Å; W74-L100 HydrophobicContact CD2-CD2 4.47Å; W74-L100 HydrophobicContact CE3-CD2 4.42Å; W74-L100 HydrophobicContact CG-CD1 4.45Å; W74-L100 HydrophobicContact CZ2-CB 4.2Å; W74-I114 CarbonylContact C-O 3.59Å; W74-I114 WeakPolarHBondContact CA-O 3.14Å; W74-C115 HydrophobicContact CD2-CB 3.92Å; W74-C115 HydrophobicContact CE3-CB 3.83Å; W74-C115 HydrophobicContact CH2-CB 3.74Å; W74-C115 HydrophobicContact CZ2-CB 3.81Å; W74-C115 HydrophobicContact CZ3-CB 3.74Å; W74-V128 HydrophobicContact CZ3-CG1 4.26Å
75	Y	91.9	Very high	86.9	Confident	67 Å²	67	66.1 Å²	66.1	26%	0.263	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	161.8	170.2	-65.2	-98	0	0	0	109.3	V73 Q85 P86 I114 M116	V73-Y75 HydrophobicContact CB-CE2 4.25Å; V73-Y75 HydrophobicContact CG1-CD2 4.33Å; V73-Y75 HydrophobicContact CG1-CE2 3.68Å; Y75-Q85 CarbonylContact C-O 3.53Å; Y75-Q85 WeakPolarHBondContact CA-O 3.34Å; Y75-P86 HydrophobicContact CD1-CB 4.34Å; Y75-P86 HydrophobicContact CE1-CB 4.2Å; Y75-I114 PolarHBondContact N-O 2.87Å; Y75-I114 PolarHBondContact O-N 2.89Å; Y75-M116 HydrophobicContact CD2-CE 4.45Å; Y75-M116 HydrophobicContact CE2-CB 4.44Å; Y75-M116 HydrophobicContact CE2-CE 4.05Å; Y75-M116 HydrophobicContact CE2-SD 4.17Å
76	R	92.9	Very high	87.2	Confident	39 Å²	39	70 Å²	70	15%	0.147	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	146.6	172.8	67.4	-178.6	-177.7	170.2	4.1	111.3	Q85 I87 Q112 Y113	R76-Q85 PolarHBondContact N-O 3.36Å; R76-Q85 PolarHBondContact O-N 3.3Å; R76-I87 HydrophobicContact CB-CD1 4.15Å; R76-I87 HydrophobicContact CB-CG1 4.08Å; R76-I87 HydrophobicContact CG-CG1 4.05Å; R76-Q112 CarbonylContact C-O 3.48Å; R76-Q112 VanDerWaalsContact CA-O 3.27Å; R76-Q112 WeakPolarHBondContact CA-O 3.31Å; R76-Y113 HydrophobicContact CB-CD1 4.15Å; R76-Y113 HydrophobicContact CB-CE1 4.11Å
77	L	92.2	Very high	87.4	Confident	39 Å²	39	64.9 Å²	64.9	20%	0.204	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	101.5	169.4	179.3	67.1	0	0	0	106.8	H81 L83 G111 Q112	L77-H81 WeakPolarHBondContact CD1-O 3.16Å; L77-L83 WeakPolarHBondContact CD1-O 3.49Å; L77-G111 CarbonylContact O-C 3.51Å; L77-G111 VanDerWaalsContact O-CA 3.32Å; L77-G111 WeakPolarHBondContact O-CA 3.36Å; L77-Q112 HydrophobicContact CB-CB 4.33Å; L77-Q112 PolarHBondContact N-O 2.96Å; L77-Q112 PolarHBondContact O-N 3.47Å
78	L	88.6	Confident	87.5	Confident	24 Å²	24	64 Å²	64	13%	0.126	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	152.6	-178.4	-63.6	177.2	0	0	0	110.7	G80 H81	L78-G80 PolarHBondContact O-N 3.13Å; L78-H81 WeakPolarHBondContact O-CB 3.48Å; L78-H81 PolarHBondContact O-N 3.37Å
79	D	84.1	Confident	87.8	Confident	82 Å²	82	66.5 Å²	66.5	44%	0.439	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	131.8	177.3	-81.1	-7.3	0	0	0	111.7	H81 T110 R129	D79-H81 VanDerWaalsContact C-N 3.32Å; D79-T110 PolarHBondContact N-O 3.46Å; D79-T110 VanDerWaalsContact N-O 3.1Å; D79-T110 WeakPolarHBondContact OD2-CG2 3.38Å; D79-R129 IonicContact OD1-CZ 2.76Å; D79-R129 VanDerWaalsContact OD1-CZ 3.28Å; D79-R129 IonicContact OD1-NH1 3.39Å; D79-R129 PolarHBondContact OD1-NH1 2.73Å; D79-R129 IonicContact OD1-NH2 2.86Å; D79-R129 PolarHBondContact OD1-NH2 2.93Å; D79-R129 IonicContact OD2-CZ 3.37Å; D79-R129 IonicContact OD2-NH2 3.67Å; D79-R129 PolarHBondContact OD2-NH2 2.93Å
80	G	78.1	Confident	87.9	Confident	84 Å²	84	67.1 Å²	67.1	87%	0.866	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	3.3	-174.4	0	0	0	0	0	114.9	L78	L78-G80 PolarHBondContact O-N 3.13Å
81	H	84.3	Confident	87.6	Confident	96 Å²	96	69.1 Å²	69.1	44%	0.444	39%	0.391	S	S	.	.			trans	-105.9	146.7	169.5	-69.5	-102.6	0	0	0	111.1	L77 L78 D79	L77-H81 WeakPolarHBondContact CD1-O 3.16Å; L78-H81 WeakPolarHBondContact O-CB 3.48Å; L78-H81 PolarHBondContact O-N 3.37Å; D79-H81 VanDerWaalsContact C-N 3.32Å
82	D	82.1	Confident	87.6	Confident	160 Å²	160	68.4 Å²	68.4	86%	0.856	38%	0.381	S	S	*	.			trans	-102	-4.5	-178.5	-59.9	-39.2	0	0	0	113.9
83	L	86.9	Confident	87.6	Confident	133 Å²	133	68.3 Å²	68.3	70%	0.696	38%	0.381	S	S	*	.	S	Bend	trans	-126.6	133	-173.7	-67.6	173.3	0	0	0	112.4	L77	L77-L83 WeakPolarHBondContact CD1-O 3.49Å
84	E	89.6	Confident	87.5	Confident	78 Å²	78	66.8 Å²	66.8	36%	0.364	37%	0.373	S	S	.	.			trans	-64.1	134.5	170.5	-63	179.8	-155.1	0	0	110.3	I114 R125	E84-I114 VanDerWaalsContact CD-CD1 3.49Å; E84-I114 HydrophobicContact CG-CD1 3.77Å; E84-R125 IonicContact OE1-CZ 3.43Å; E84-R125 IonicContact OE1-NH1 3.5Å; E84-R125 PolarHBondContact OE1-NH1 2.8Å; E84-R125 IonicContact OE1-NH2 2.75Å; E84-R125 IonicContact OE2-NH1 3.57Å; E84-R125 PolarHBondContact OE2-NH1 3.01Å; E84-R125 VanDerWaalsContact OE2-NH1 3.08Å
85	Q	89.1	Confident	87.3	Confident	76 Å²	76	72 Å²	72	36%	0.355	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	140.5	178.3	-63.8	176.2	20.4	0	0	110.5	Y75 R76	Y75-Q85 CarbonylContact C-O 3.53Å; Y75-Q85 WeakPolarHBondContact CA-O 3.34Å; R76-Q85 PolarHBondContact N-O 3.36Å; R76-Q85 PolarHBondContact O-N 3.3Å
86	P	90.3	Very high	86.9	Confident	87 Å²	87	72.2 Å²	72.2	57%	0.565	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63	144.9	170.4	28.4	-33.8	0	0	0	109.6	Y75 P88	Y75-P86 HydrophobicContact CD1-CB 4.34Å; Y75-P86 HydrophobicContact CE1-CB 4.2Å; P86-P88 VanDerWaalsContact O-CD 3.27Å; P86-P88 WeakPolarHBondContact O-CD 3.4Å
87	I	89.4	Confident	86.6	Confident	11 Å²	11	78.8 Å²	78.8	6%	0.056	42%	0.421	C	S	.	.			trans	-80.4	118.4	-177.6	-58.4	-173	0	0	0	110	W74 R76 Y89 V93 L100 Y113	W74-I87 HydrophobicContact CB-CD1 3.65Å; W74-I87 HydrophobicContact CB-CG1 4.22Å; W74-I87 PolarHBondContact O-N 2.82Å; R76-I87 HydrophobicContact CB-CD1 4.15Å; R76-I87 HydrophobicContact CB-CG1 4.08Å; R76-I87 HydrophobicContact CG-CG1 4.05Å; I87-Y89 PolarHBondContact O-N 2.68Å; I87-Y89 VanDerWaalsContact O-N 3.15Å; I87-V93 HydrophobicContact CG2-CG1 3.57Å; I87-L100 HydrophobicContact CD1-CD1 4.34Å; I87-L100 HydrophobicContact CD1-CD2 3.34Å; I87-L100 HydrophobicContact CD1-CG 4.48Å; I87-L100 HydrophobicContact CG2-CD1 4.43Å; I87-Y113 HydrophobicContact CD1-CD1 3.7Å; I87-Y113 HydrophobicContact CD1-CE1 3.96Å
88	P	85.9	Confident	86.3	Confident	83 Å²	83	78.7 Å²	78.7	54%	0.539	42%	0.419	S	S	.	.			trans	-73.7	108.3	174.4	29.5	-32.2	0	0	0	109.5	P86 S90	P86-P88 VanDerWaalsContact O-CD 3.27Å; P86-P88 WeakPolarHBondContact O-CD 3.4Å; P88-S90 PolarHBondContact O-N 3.38Å
89	Y	87.3	Confident	86.3	Confident	112 Å²	112	80.2 Å²	80.2	44%	0.439	42%	0.423	S	S	.	.			trans	-65.5	132.4	175.9	-62.2	-60	0	0	0	110.7	I87 V93 R95 L100	I87-Y89 PolarHBondContact O-N 2.68Å; I87-Y89 VanDerWaalsContact O-N 3.15Å; Y89-V93 WeakPolarHBondContact CA-O 3.28Å; Y89-R95 HydrophobicContact CD1-CB 4.3Å; Y89-R95 HydrophobicContact CE1-CB 3.56Å; Y89-L100 HydrophobicContact CE1-CD1 3.96Å
90	S	85.3	Confident	86.7	Confident	60 Å²	60	76.3 Å²	76.3	42%	0.42	40%	0.402	S	S	.	.			trans	-143.6	-178.6	-176.9	62	0	0	0	0	110.2	P88 R92 V93	P88-S90 PolarHBondContact O-N 3.38Å; S90-R92 PolarHBondContact O-N 2.95Å; S90-R92 PolarHBondContact OG-N 2.64Å; S90-V93 PolarHBondContact N-O 3.19Å; S90-V93 CarbonylContact O-C 3.51Å; S90-V93 PolarHBondContact OG-N 2.94Å; S90-V93 VanDerWaalsContact OG-N 3.09Å
91	A	80.8	Confident	87.2	Confident	77 Å²	77	72.7 Å²	72.7	64%	0.636	36%	0.362	S	S	*	.	S	Bend	trans	-59.7	-31.5	170.9	0	0	0	0	0	112.2	R233	A91-R233 PolarHBondContact O-NH1 3.24Å
92	R	88.3	Confident	87.5	Confident	75 Å²	75	68.1 Å²	68.1	28%	0.283	34%	0.341	S	S	.	.	S	Bend	trans	-85.1	-38.6	-178	-171.1	-178.3	73	81.3	-8.4	113.4	S90 Q103 P104 D109	S90-R92 PolarHBondContact O-N 2.95Å; S90-R92 PolarHBondContact OG-N 2.64Å; R92-Q103 WeakPolarHBondContact CA-O 3.45Å; R92-Q103 PolarHBondContact O-N 3.34Å; R92-P104 WeakPolarHBondContact CG-O 3.28Å; R92-P104 PolarHBondContact NH1-O 3.26Å; R92-D109 IonicContact CZ-OD1 3.74Å; R92-D109 IonicContact CZ-OD2 3.79Å; R92-D109 IonicContact NH1-OD1 3.31Å; R92-D109 PolarHBondContact NH1-OD1 3.3Å; R92-D109 IonicContact NH1-OD2 2.93Å; R92-D109 PolarHBondContact NH1-OD2 3.33Å; R92-D109 IonicContact NH2-OD1 2.83Å; R92-D109 PolarHBondContact NH2-OD1 2.87Å; R92-D109 IonicContact NH2-OD2 3.18Å
93	V	89.6	Confident	87.8	Confident	6 Å²	6	61.1 Å²	61.1	4%	0.036	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	112.8	-178.9	-177	0	0	0	0	109.1	I87 Y89 S90 L100 W101	I87-V93 HydrophobicContact CG2-CG1 3.57Å; Y89-V93 WeakPolarHBondContact CA-O 3.28Å; S90-V93 PolarHBondContact N-O 3.19Å; S90-V93 CarbonylContact O-C 3.51Å; S90-V93 PolarHBondContact OG-N 2.94Å; S90-V93 VanDerWaalsContact OG-N 3.09Å; V93-L100 HydrophobicContact CG1-CD1 3.97Å; V93-L100 HydrophobicContact CG1-CG 4.31Å; V93-W101 WeakPolarHBondContact CA-O 3.49Å
94	S	88.4	Confident	88	Confident	12 Å²	12	57 Å²	57	8%	0.084	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	144.5	-175.1	62.6	0	0	0	0	112.3	W101	S94-W101 PolarHBondContact N-O 2.96Å; S94-W101 PolarHBondContact O-N 2.87Å
95	R	88.7	Confident	88	Confident	110 Å²	110	53.3 Å²	53.3	42%	0.415	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	128.7	173.8	-176.8	-171.9	70.2	173.8	2.1	109.4	D71 L72 Y89	D71-R95 IonicContact OD1-NH1 2.86Å; L72-R95 PolarHBondContact O-NH1 3.06Å; Y89-R95 HydrophobicContact CD1-CB 4.3Å; Y89-R95 HydrophobicContact CE1-CB 3.56Å
96	E	83.4	Confident	88.2	Confident	72 Å²	72	52.5 Å²	52.5	34%	0.336	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	112.4	172.8	-167	157.7	-179.2	0	0	109	E98 R99 M175 R232	E96-E98 PolarHBondContact O-N 3.09Å; E96-R99 PolarHBondContact N-O 3.02Å; E96-R99 PolarHBondContact O-N 3.43Å; E96-M175 WeakPolarHBondContact OE2-CG 3.38Å; E96-R232 IonicContact OE2-CZ 2.62Å; E96-R232 IonicContact OE2-NH1 3.59Å; E96-R232 IonicContact OE2-NH2 3.11Å; E96-R232 PolarHBondContact OE2-NH2 2.42Å
97	R	85.4	Confident	88.1	Confident	178 Å²	178	49.1 Å²	49.1	67%	0.672	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	-122.1	-170.4	-57.5	-178.6	173.2	-166.4	-3.3	112.7	Y62 R99	Y62-R97 HydrophobicContact CE1-CB 3.96Å; Y62-R97 HydrophobicContact CE1-CG 4.34Å; Y62-R97 WeakPolarHBondContact OH-CA 3.19Å; R97-R99 VanDerWaalsContact C-N 3.31Å
98	E	86.7	Confident	88	Confident	37 Å²	37	55.1 Å²	55.1	17%	0.173	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-0.1	178.3	76.7	-70.4	167.9	0	0	114.2	C51 F54 Y62 L72 E96	C51-E98 WeakPolarHBondContact CB-O 3.48Å; C51-E98 PolarHBondContact N-O 3.22Å; F54-E98 HydrophobicContact CD2-CB 3.72Å; F54-E98 HydrophobicContact CE2-CB 4.24Å; F54-E98 HydrophobicContact CG-CB 4.33Å; Y62-E98 HydrophobicContact CD2-CB 3.7Å; Y62-E98 HydrophobicContact CE2-CB 4.08Å; Y62-E98 HydrophobicContact CG-CB 4.31Å; L72-E98 HydrophobicContact CD2-CB 4.49Å; E96-E98 PolarHBondContact O-N 3.09Å
99	R	89.1	Confident	88.3	Confident	55 Å²	55	51.4 Å²	51.4	21%	0.208	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	145.6	-172	-52	-173.5	-170.7	-177.5	1	112.2	V49 E96 R97 D171	V49-R99 CarbonylContact O-C 3.58Å; V49-R99 WeakPolarHBondContact O-CA 3.19Å; E96-R99 PolarHBondContact N-O 3.02Å; E96-R99 PolarHBondContact O-N 3.43Å; R97-R99 VanDerWaalsContact C-N 3.31Å; R99-D171 IonicContact CZ-OD2 3.86Å; R99-D171 IonicContact NH1-OD2 3.17Å; R99-D171 PolarHBondContact NH1-OD2 2.81Å; R99-D171 IonicContact NH2-OD2 3.08Å
100	L	91.4	Very high	88.5	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.7	171.4	-174.5	76.3	0	0	0	109.4	W48 V49 W74 I87 Y89 V93 Y113	W48-L100 CarbonylContact C-O 3.49Å; W48-L100 WeakPolarHBondContact CA-O 3.47Å; W48-L100 VanDerWaalsContact CB-O 3.32Å; W48-L100 WeakPolarHBondContact CB-O 3.4Å; V49-L100 PolarHBondContact N-O 3.35Å; V49-L100 PolarHBondContact O-N 2.59Å; W74-L100 HydrophobicContact CD2-CB 4.16Å; W74-L100 HydrophobicContact CD2-CD2 4.47Å; W74-L100 HydrophobicContact CE3-CD2 4.42Å; W74-L100 HydrophobicContact CG-CD1 4.45Å; W74-L100 HydrophobicContact CZ2-CB 4.2Å; I87-L100 HydrophobicContact CD1-CD1 4.34Å; I87-L100 HydrophobicContact CD1-CD2 3.34Å; I87-L100 HydrophobicContact CD1-CG 4.48Å; I87-L100 HydrophobicContact CG2-CD1 4.43Å; Y89-L100 HydrophobicContact CE1-CD1 3.96Å; V93-L100 HydrophobicContact CG1-CD1 3.97Å; V93-L100 HydrophobicContact CG1-CG 4.31Å; L100-Y113 HydrophobicContact CD2-CD1 3.4Å; L100-Y113 HydrophobicContact CD2-CE1 3.65Å
101	W	89	Confident	88.8	Confident	8 Å²	8	44.3 Å²	44.3	3%	0.03	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	137.6	-178.3	-68.9	86.9	0	0	0	111.7	W48 V93 S94 Q103 D171 M175	W48-W101 HydrophobicContact CB-CD2 3.74Å; W48-W101 HydrophobicContact CB-CE3 3.75Å; W48-W101 HydrophobicContact CB-CG 4.2Å; W48-W101 HydrophobicContact CB-CH2 4.3Å; W48-W101 HydrophobicContact CB-CZ2 4.33Å; W48-W101 HydrophobicContact CB-CZ3 4.05Å; W48-W101 HydrophobicContact CD2-CE3 4.14Å; W48-W101 AromaticContact CD2-CH2 3.48Å; W48-W101 HydrophobicContact CD2-CH2 3.48Å; W48-W101 VanDerWaalsContact CD2-CH2 3.48Å; W48-W101 HydrophobicContact CD2-CZ2 4.16Å; W48-W101 AromaticContact CD2-CZ3 3.51Å; W48-W101 HydrophobicContact CD2-CZ3 3.51Å; W48-W101 AromaticContact CE2-CH2 3.87Å; W48-W101 AromaticContact CE3-CE3 3.83Å; W48-W101 HydrophobicContact CE3-CE3 3.83Å; W48-W101 AromaticContact CE3-CH2 3.51Å; W48-W101 HydrophobicContact CE3-CH2 3.51Å; W48-W101 AromaticContact CE3-CZ3 3.09Å; W48-W101 HydrophobicContact CE3-CZ3 3.09Å; W48-W101 HydrophobicContact CG-CD2 4.35Å; W48-W101 HydrophobicContact CG-CE3 4.18Å; W48-W101 AromaticContact CG-CH2 3.88Å; W48-W101 HydrophobicContact CG-CH2 3.88Å; W48-W101 HydrophobicContact CG-CZ2 4.09Å; W48-W101 AromaticContact CG-CZ3 3.97Å; W48-W101 HydrophobicContact CG-CZ3 3.97Å; W48-W101 HydrophobicContact CH2-CH2 4.15Å; W48-W101 HydrophobicContact CH2-CZ3 4.31Å; W48-W101 HydrophobicContact CZ2-CH2 4.13Å; W48-W101 AromaticContact CZ3-CH2 3.88Å; W48-W101 HydrophobicContact CZ3-CH2 3.88Å; W48-W101 AromaticContact CZ3-CZ3 3.59Å; W48-W101 HydrophobicContact CZ3-CZ3 3.59Å; V93-W101 WeakPolarHBondContact CA-O 3.49Å; S94-W101 PolarHBondContact N-O 2.96Å; S94-W101 PolarHBondContact O-N 2.87Å; W101-Q103 HydrophobicContact CB-CG 4.49Å; W101-D171 HydrophobicContact CH2-CB 4.4Å; W101-M175 HydrophobicContact CD2-CE 4.12Å; W101-M175 HydrophobicContact CD2-SD 4.01Å; W101-M175 VanDerWaalsContact CE2-SD 3.55Å; W101-M175 HydrophobicContact CE3-CE 4.06Å; W101-M175 HydrophobicContact CE3-SD 4.44Å; W101-M175 HydrophobicContact CH2-CE 3.13Å; W101-M175 HydrophobicContact CH2-SD 4.19Å; W101-M175 HydrophobicContact CZ2-CE 3.14Å; W101-M175 HydrophobicContact CZ2-SD 3.68Å; W101-M175 HydrophobicContact CZ3-CE 3.58Å
102	L	91.3	Very high	89.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	109.5	172.5	-60	94.5	0	0	0	108.8	A46 G47 V49 A105 D109 L130	A46-L102 WeakPolarHBondContact CA-O 3.39Å; G47-L102 PolarHBondContact N-O 3.21Å; G47-L102 PolarHBondContact O-N 2.83Å; V49-L102 HydrophobicContact CG2-CD1 4.4Å; L102-A105 HydrophobicContact CB-CB 3.98Å; L102-A105 PolarHBondContact O-N 2.9Å; L102-D109 HydrophobicContact CD2-CB 3.64Å; L102-L130 HydrophobicContact CD1-CD2 3.9Å; L102-L130 HydrophobicContact CD2-CD2 3.76Å
103	Q	88.5	Confident	89.6	Confident	13 Å²	13	39.1 Å²	39.1	6%	0.061	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.3	89.2	-168.1	-75.7	175.7	-32.5	0	0	111.2	A46 R92 W101 Y230 L237	A46-Q103 HydrophobicContact CB-CG 4Å; R92-Q103 WeakPolarHBondContact CA-O 3.45Å; R92-Q103 PolarHBondContact O-N 3.34Å; W101-Q103 HydrophobicContact CB-CG 4.49Å; Q103-Y230 PolarHBondContact NE2-OH 3.2Å; Q103-L237 HydrophobicContact CB-CD1 3.71Å; Q103-L237 HydrophobicContact CB-CD2 4.14Å; Q103-L237 HydrophobicContact CG-CD1 3.85Å
104	P	90.2	Very high	89.7	Confident	47 Å²	47	39.1 Å²	39.1	31%	0.305	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	cis	-82.2	161.9	-7.9	33.6	-34.6	0	0	0	113.1	G44 R92	G44-P104 WeakPolarHBondContact O-CB 3.11Å; R92-P104 WeakPolarHBondContact CG-O 3.28Å; R92-P104 PolarHBondContact NH1-O 3.26Å
105	A	90.9	Very high	89.9	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.008	18%	0.182	C	C	.	.			trans	-74.1	142.2	165.8	0	0	0	0	0	110.4	V41 G44 E45 L102 V132	V41-A105 HydrophobicContact CB-CB 4.46Å; V41-A105 HydrophobicContact CG1-CB 3.71Å; G44-A105 PolarHBondContact N-O 3.43Å; E45-A105 PolarHBondContact O-N 2.68Å; L102-A105 HydrophobicContact CB-CB 3.98Å; L102-A105 PolarHBondContact O-N 2.9Å; A105-V132 HydrophobicContact CB-CG1 4.28Å; A105-V132 HydrophobicContact CB-CG2 4.14Å
106	V	91.5	Very high	90	Very high	58 Å²	58	34.4 Å²	34.4	35%	0.352	17%	0.168	S	C	.	.			trans	-119.4	148.2	178.3	-177.3	0	0	0	0	109	D43 N108 D109	D43-V106 VanDerWaalsContact OD1-CA 3.27Å; D43-V106 WeakPolarHBondContact OD1-CA 3.39Å; V106-N108 PolarHBondContact O-N 2.87Å; V106-D109 PolarHBondContact N-OD2 2.91Å; V106-D109 VanDerWaalsContact O-CB 3.26Å; V106-D109 WeakPolarHBondContact O-CB 3.36Å; V106-D109 PolarHBondContact O-N 3.3Å
107	A	88.6	Confident	90.4	Very high	17 Å²	17	31.1 Å²	31.1	14%	0.14	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-46.8	-38.8	178.7	0	0	0	0	0	114.3	D43 D109 T110 Q134	D43-A107 PolarHBondContact OD1-N 3.31Å; D43-A107 VanDerWaalsContact OD1-N 3.11Å; A107-D109 PolarHBondContact O-N 2.97Å; A107-T110 WeakPolarHBondContact O-CB 3.34Å; A107-T110 PolarHBondContact O-N 3.21Å; A107-T110 PolarHBondContact O-OG1 3Å; A107-Q134 HydrophobicContact CB-CG 3.95Å
108	N	88.9	Confident	90.6	Very high	136 Å²	136	27.7 Å²	27.7	73%	0.727	14%	0.14	S	C	*	.	G	3₁₀ helix	trans	-70.1	-8	177.9	-72.8	9.6	0	0	0	114.7	V106 T110	V106-N108 PolarHBondContact O-N 2.87Å; N108-T110 PolarHBondContact O-N 3.29Å
109	D	90.4	Very high	90.5	Very high	5 Å²	5	27.8 Å²	27.8	3%	0.027	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-80.1	-2.8	174.1	-62.9	-42.1	0	0	0	112.1	R92 L102 V106 A107 Y113 V132	R92-D109 IonicContact CZ-OD1 3.74Å; R92-D109 IonicContact CZ-OD2 3.79Å; R92-D109 IonicContact NH1-OD1 3.31Å; R92-D109 PolarHBondContact NH1-OD1 3.3Å; R92-D109 IonicContact NH1-OD2 2.93Å; R92-D109 PolarHBondContact NH1-OD2 3.33Å; R92-D109 IonicContact NH2-OD1 2.83Å; R92-D109 PolarHBondContact NH2-OD1 2.87Å; R92-D109 IonicContact NH2-OD2 3.18Å; L102-D109 HydrophobicContact CD2-CB 3.64Å; V106-D109 PolarHBondContact N-OD2 2.91Å; V106-D109 VanDerWaalsContact O-CB 3.26Å; V106-D109 WeakPolarHBondContact O-CB 3.36Å; V106-D109 PolarHBondContact O-N 3.3Å; A107-D109 PolarHBondContact O-N 2.97Å; D109-Y113 VanDerWaalsContact O-CE2 3.24Å; D109-Y113 WeakPolarHBondContact O-CE2 3.39Å; D109-Y113 PolarHBondContact O-OH 3.04Å; D109-V132 HydrophobicContact CB-CG2 4.25Å
110	T	91.5	Very high	90.1	Very high	23 Å²	23	34.8 Å²	34.8	14%	0.141	17%	0.173	C	C	.	.			trans	-62.9	130.5	176.9	-61	0	0	0	0	111.5	D79 A107 N108 L130 Q131 V132	D79-T110 PolarHBondContact N-O 3.46Å; D79-T110 VanDerWaalsContact N-O 3.1Å; D79-T110 WeakPolarHBondContact OD2-CG2 3.38Å; A107-T110 WeakPolarHBondContact O-CB 3.34Å; A107-T110 PolarHBondContact O-N 3.21Å; A107-T110 PolarHBondContact O-OG1 3Å; N108-T110 PolarHBondContact O-N 3.29Å; T110-L130 WeakPolarHBondContact CA-O 3.16Å; T110-Q131 HydrophobicContact CG2-CG 4.33Å; T110-V132 PolarHBondContact OG1-N 2.81Å
111	G	91.8	Very high	89.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.4	-166.2	-178.8	0	0	0	0	0	113	L77 L130	L77-G111 CarbonylContact O-C 3.51Å; L77-G111 VanDerWaalsContact O-CA 3.32Å; L77-G111 WeakPolarHBondContact O-CA 3.36Å; G111-L130 PolarHBondContact N-O 3.35Å; G111-L130 PolarHBondContact O-N 3.09Å
112	Q	92.9	Very high	89.5	Confident	40 Å²	40	41.3 Å²	41.3	19%	0.187	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	130.3	175.4	-70.7	174.9	-20.6	0	0	110.7	E33 R76 L77	E33-Q112 PolarHBondContact OE1-NE2 3.48Å; E33-Q112 PolarHBondContact OE2-NE2 3.4Å; R76-Q112 CarbonylContact C-O 3.48Å; R76-Q112 VanDerWaalsContact CA-O 3.27Å; R76-Q112 WeakPolarHBondContact CA-O 3.31Å; L77-Q112 HydrophobicContact CB-CB 4.33Å; L77-Q112 PolarHBondContact N-O 2.96Å; L77-Q112 PolarHBondContact O-N 3.47Å
113	Y	93.1	Very high	89.4	Confident	3 Å²	3	42 Å²	42	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	122.5	174.9	-73.1	-101.3	0	0	0	108.3	R76 I87 L100 D109 A127 V128 L130	R76-Y113 HydrophobicContact CB-CD1 4.15Å; R76-Y113 HydrophobicContact CB-CE1 4.11Å; I87-Y113 HydrophobicContact CD1-CD1 3.7Å; I87-Y113 HydrophobicContact CD1-CE1 3.96Å; L100-Y113 HydrophobicContact CD2-CD1 3.4Å; L100-Y113 HydrophobicContact CD2-CE1 3.65Å; D109-Y113 VanDerWaalsContact O-CE2 3.24Å; D109-Y113 WeakPolarHBondContact O-CE2 3.39Å; D109-Y113 PolarHBondContact O-OH 3.04Å; Y113-A127 CarbonylContact O-C 3.5Å; Y113-A127 WeakPolarHBondContact O-CA 3.31Å; Y113-V128 PolarHBondContact N-O 3.45Å; Y113-V128 VanDerWaalsContact O-CG1 3.24Å; Y113-V128 WeakPolarHBondContact O-CG1 3.34Å; Y113-V128 PolarHBondContact O-N 2.85Å; Y113-L130 HydrophobicContact CD2-CB 3.59Å; Y113-L130 HydrophobicContact CD2-CD2 4.12Å; Y113-L130 HydrophobicContact CE2-CB 3.58Å; Y113-L130 HydrophobicContact CE2-CD2 3.43Å; Y113-L130 VanDerWaalsContact CE2-CD2 3.43Å; Y113-L130 HydrophobicContact CE2-CG 4.1Å
114	I	92.8	Very high	89.5	Confident	7 Å²	7	41.9 Å²	41.9	4%	0.036	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	117.4	-171.8	-58.7	157.3	0	0	0	107.4	W74 Y75 E84 R125 I126 A127	W74-I114 CarbonylContact C-O 3.59Å; W74-I114 WeakPolarHBondContact CA-O 3.14Å; Y75-I114 PolarHBondContact N-O 2.87Å; Y75-I114 PolarHBondContact O-N 2.89Å; E84-I114 VanDerWaalsContact CD-CD1 3.49Å; E84-I114 HydrophobicContact CG-CD1 3.77Å; I114-R125 HydrophobicContact CG2-CB 4.17Å; I114-I126 WeakPolarHBondContact CA-O 3.36Å; I114-A127 HydrophobicContact CG1-CB 3.82Å
115	C	92.8	Very high	89.5	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	127.9	170.6	67.2	0	0	0	0	109.8	C51 L72 W74 R125 I126	C51-C115 WeakPolarHBondContact CA-SG 3.16Å; C51-C115 HydrophobicContact CB-CB 3.56Å; C51-C115 WeakPolarHBondContact CB-SG 3.43Å; C51-C115 WeakPolarHBondContact SG-CB 3.48Å; C51-C115 CovalentContact SG-SG 2.04Å; C51-C115 PolarHBondContact SG-SG 3.04Å; L72-C115 HydrophobicContact CD1-CB 4.06Å; W74-C115 HydrophobicContact CD2-CB 3.92Å; W74-C115 HydrophobicContact CE3-CB 3.83Å; W74-C115 HydrophobicContact CH2-CB 3.74Å; W74-C115 HydrophobicContact CZ2-CB 3.81Å; W74-C115 HydrophobicContact CZ3-CB 3.74Å; C115-R125 VanDerWaalsContact O-CA 3.25Å; C115-R125 WeakPolarHBondContact O-CA 3.36Å; C115-I126 PolarHBondContact N-O 3Å; C115-I126 PolarHBondContact O-N 2.78Å; C115-I126 VanDerWaalsContact O-N 3.09Å; C115-I126 VanDerWaalsContact SG-CG2 3.57Å
116	M	90.9	Very high	89.6	Confident	22 Å²	22	43.1 Å²	43.1	11%	0.108	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	119.6	-179.1	-178.9	-176.1	-66.8	0	0	109.1	L72 V73 Y75 S124 R125	L72-M116 WeakPolarHBondContact CA-O 3.27Å; V73-M116 PolarHBondContact N-O 2.65Å; V73-M116 PolarHBondContact O-N 2.98Å; Y75-M116 HydrophobicContact CD2-CE 4.45Å; Y75-M116 HydrophobicContact CE2-CB 4.44Å; Y75-M116 HydrophobicContact CE2-CE 4.05Å; Y75-M116 HydrophobicContact CE2-SD 4.17Å; M116-S124 WeakPolarHBondContact CA-O 3.4Å; M116-R125 HydrophobicContact CB-CB 4.07Å; M116-R125 HydrophobicContact CE-CB 4.42Å; M116-R125 HydrophobicContact CG-CB 4.19Å
117	L	90.3	Very high	89.6	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.021	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	111.1	174.8	-170.9	66.3	0	0	0	109	L53 F54 Y60 A65 H70 D71 L72 C123 S124	L53-L117 HydrophobicContact CD1-CB 3.87Å; F54-L117 HydrophobicContact CE1-CD2 4.19Å; F54-L117 HydrophobicContact CZ-CD1 3.96Å; F54-L117 HydrophobicContact CZ-CD2 3.92Å; F54-L117 HydrophobicContact CZ-CG 4.49Å; Y60-L117 HydrophobicContact CD1-CD2 4.36Å; Y60-L117 HydrophobicContact CD2-CD2 4.12Å; Y60-L117 HydrophobicContact CE2-CD2 4.49Å; Y60-L117 HydrophobicContact CG-CD2 4.04Å; A65-L117 HydrophobicContact CB-CD2 4.11Å; H70-L117 HydrophobicContact CB-CD1 3.53Å; H70-L117 HydrophobicContact CB-CD2 4.34Å; H70-L117 HydrophobicContact CB-CG 3.78Å; D71-L117 WeakPolarHBondContact O-CA 3.46Å; L72-L117 HydrophobicContact CB-CD1 4.23Å; L72-L117 HydrophobicContact CD1-CD1 4.42Å; L117-C123 WeakPolarHBondContact O-CA 3.49Å; L117-S124 PolarHBondContact N-O 3.24Å; L117-S124 PolarHBondContact O-N 2.76Å
118	R	89.3	Confident	89.8	Confident	106 Å²	106	40.2 Å²	40.2	40%	0.4	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	136.2	-174.1	-175.3	178.1	178.6	173.1	1.9	111.7	E25 H70 D71 S122 C123	E25-R118 IonicContact OE1-CZ 2.67Å; E25-R118 IonicContact OE1-NH1 3.64Å; E25-R118 PolarHBondContact OE1-NH1 3.26Å; E25-R118 IonicContact OE1-NH2 3.91Å; E25-R118 PolarHBondContact OE1-NH2 2.96Å; H70-R118 CarbonylContact C-O 3.57Å; H70-R118 WeakPolarHBondContact CA-O 3.3Å; D71-R118 PolarHBondContact N-O 3.1Å; D71-R118 PolarHBondContact O-N 3.46Å; R118-S122 CarbonylContact C-O 3.56Å; R118-C123 HydrophobicContact CG-CB 4.3Å
119	N	84.9	Confident	89.9	Confident	39 Å²	39	37.5 Å²	37.5	21%	0.209	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	173.7	165.7	-165.6	-9.6	0	0	0	108	A68 G69 H70 S121 S122	A68-N119 PolarHBondContact O-ND2 3.22Å; G69-N119 PolarHBondContact O-OD1 3.36Å; H70-N119 HydrophobicContact CB-CB 4.49Å; N119-S121 PolarHBondContact O-N 2.8Å; N119-S121 VanDerWaalsContact O-N 3.09Å; N119-S122 PolarHBondContact N-O 2.93Å; N119-S122 PolarHBondContact O-N 2.88Å
120	K	81.3	Confident	90	Very high	202 Å²	202	37.2 Å²	37.2	88%	0.878	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-30.3	-178.5	-67.2	-175.5	179.1	179.6	0	113.7
121	S	82.6	Confident	89.9	Confident	107 Å²	107	40 Å²	40	75%	0.748	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.8	-4.6	-174.8	56.6	0	0	0	0	114.9	N119	N119-S121 PolarHBondContact O-N 2.8Å; N119-S121 VanDerWaalsContact O-N 3.09Å
122	S	84.7	Confident	89.8	Confident	38 Å²	38	40.4 Å²	40.4	27%	0.266	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	135.5	-173.1	60.8	0	0	0	0	111.2	H70 R118 N119	H70-S122 PolarHBondContact CE1-OG 3.27Å; R118-S122 CarbonylContact C-O 3.56Å; N119-S122 PolarHBondContact N-O 2.93Å; N119-S122 PolarHBondContact O-N 2.88Å
123	C	89.5	Confident	89.5	Confident	14 Å²	14	39.9 Å²	39.9	10%	0.095	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	129.8	173.6	-173	0	0	0	0	109.4	C28 H29 L117 R118	C28-C123 HydrophobicContact CB-CB 3.77Å; C28-C123 WeakPolarHBondContact CB-SG 3.47Å; C28-C123 WeakPolarHBondContact SG-CB 3.36Å; C28-C123 CovalentContact SG-SG 2.04Å; C28-C123 PolarHBondContact SG-SG 3.3Å; H29-C123 WeakPolarHBondContact CB-O 3.46Å; H29-C123 PolarHBondContact N-O 3.07Å; L117-C123 WeakPolarHBondContact O-CA 3.49Å; R118-C123 HydrophobicContact CG-CB 4.3Å
124	S	90.4	Very high	88.9	Confident	10 Å²	10	43.6 Å²	43.6	7%	0.07	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	137	172.5	-61.9	0	0	0	0	109.8	C28 H29 Y60 M116 L117	C28-S124 PolarHBondContact SG-N 3.3Å; C28-S124 VanDerWaalsContact SG-N 3.43Å; H29-S124 CarbonylContact O-C 3.56Å; H29-S124 VanDerWaalsContact O-CA 3.29Å; H29-S124 WeakPolarHBondContact O-CA 3.29Å; Y60-S124 PolarHBondContact OH-OG 3.35Å; M116-S124 WeakPolarHBondContact CA-O 3.4Å; L117-S124 PolarHBondContact N-O 3.24Å; L117-S124 PolarHBondContact O-N 2.76Å
125	R	91.6	Very high	87.7	Confident	55 Å²	55	51.8 Å²	51.8	21%	0.208	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	151.6	176.2	72.4	-178.7	-165	157.8	5.5	111.6	H29 D30 W31 E84 I114 C115 M116	H29-R125 PolarHBondContact O-N 2.72Å; D30-R125 HydrophobicContact CB-CG 4.03Å; D30-R125 VanDerWaalsContact CG-NE 3.31Å; D30-R125 IonicContact OD1-NE 2.84Å; D30-R125 IonicContact OD2-CZ 2.75Å; D30-R125 IonicContact OD2-NE 3.4Å; D30-R125 PolarHBondContact OD2-NE 3.43Å; D30-R125 IonicContact OD2-NH2 3.53Å; D30-R125 PolarHBondContact OD2-NH2 3.39Å; W31-R125 PolarHBondContact N-O 2.73Å; E84-R125 IonicContact OE1-CZ 3.43Å; E84-R125 IonicContact OE1-NH1 3.5Å; E84-R125 PolarHBondContact OE1-NH1 2.8Å; E84-R125 IonicContact OE1-NH2 2.75Å; E84-R125 IonicContact OE2-NH1 3.57Å; E84-R125 PolarHBondContact OE2-NH1 3.01Å; E84-R125 VanDerWaalsContact OE2-NH1 3.08Å; I114-R125 HydrophobicContact CG2-CB 4.17Å; C115-R125 VanDerWaalsContact O-CA 3.25Å; C115-R125 WeakPolarHBondContact O-CA 3.36Å; M116-R125 HydrophobicContact CB-CB 4.07Å; M116-R125 HydrophobicContact CE-CB 4.42Å; M116-R125 HydrophobicContact CG-CB 4.19Å
126	I	91.6	Very high	86.2	Confident	19 Å²	19	56.6 Å²	56.6	10%	0.097	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	142.5	174	-168.5	163	0	0	0	109.2	W31 G32 P52 L53 I114 C115	W31-I126 HydrophobicContact CB-CB 4Å; W31-I126 HydrophobicContact CB-CD1 3.77Å; W31-I126 HydrophobicContact CB-CG1 3.88Å; W31-I126 HydrophobicContact CG-CD1 4.49Å; G32-I126 WeakPolarHBondContact O-CG1 3.27Å; P52-I126 HydrophobicContact CB-CD1 4.06Å; P52-I126 HydrophobicContact CB-CG2 3.98Å; P52-I126 HydrophobicContact CG-CG2 4.05Å; L53-I126 HydrophobicContact CD1-CG2 4.46Å; L53-I126 HydrophobicContact CD2-CB 4.23Å; L53-I126 HydrophobicContact CD2-CG2 3.87Å; L53-I126 HydrophobicContact CG-CG2 3.67Å; I114-I126 WeakPolarHBondContact CA-O 3.36Å; C115-I126 PolarHBondContact N-O 3Å; C115-I126 PolarHBondContact O-N 2.78Å; C115-I126 VanDerWaalsContact O-N 3.09Å; C115-I126 VanDerWaalsContact SG-CG2 3.57Å
127	A	91.9	Very high	84.5	Confident	9 Å²	9	61.5 Å²	61.5	7%	0.074	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	146.5	177	0	0	0	0	0	111.2	G32 E33 S34 Y113 I114	G32-A127 PolarHBondContact O-N 2.97Å; E33-A127 HydrophobicContact CB-CB 4.42Å; S34-A127 PolarHBondContact N-O 3.41Å; Y113-A127 CarbonylContact O-C 3.5Å; Y113-A127 WeakPolarHBondContact O-CA 3.31Å; I114-A127 HydrophobicContact CG1-CB 3.82Å
128	V	92	Very high	82.7	Confident	5 Å²	5	61.9 Å²	61.9	3%	0.03	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	134.2	171.2	50.3	0	0	0	0	109.4	V39 V49 P52 W74 Y113	V39-V128 HydrophobicContact CG2-CG2 4.02Å; V49-V128 HydrophobicContact CG1-CB 4.28Å; V49-V128 HydrophobicContact CG1-CG1 3.17Å; V49-V128 HydrophobicContact CG1-CG2 4.11Å; P52-V128 HydrophobicContact CG-CB 4.01Å; P52-V128 HydrophobicContact CG-CG1 4.36Å; W74-V128 HydrophobicContact CZ3-CG1 4.26Å; Y113-V128 PolarHBondContact N-O 3.45Å; Y113-V128 VanDerWaalsContact O-CG1 3.24Å; Y113-V128 WeakPolarHBondContact O-CG1 3.34Å; Y113-V128 PolarHBondContact O-N 2.85Å
129	R	92.2	Very high	80.8	Confident	79 Å²	79	62.8 Å²	62.8	30%	0.298	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	128.3	-179	-161.9	76.6	179.8	-174.9	3.9	110.6	E33 A38 V39 D79	E33-R129 WeakPolarHBondContact OE1-CB 3.18Å; E33-R129 WeakPolarHBondContact OE1-CD 3.46Å; A38-R129 HydrophobicContact CB-CB 3.86Å; A38-R129 HydrophobicContact CB-CG 3.99Å; V39-R129 PolarHBondContact N-O 2.87Å; D79-R129 IonicContact OD1-CZ 2.76Å; D79-R129 VanDerWaalsContact OD1-CZ 3.28Å; D79-R129 IonicContact OD1-NH1 3.39Å; D79-R129 PolarHBondContact OD1-NH1 2.73Å; D79-R129 IonicContact OD1-NH2 2.86Å; D79-R129 PolarHBondContact OD1-NH2 2.93Å; D79-R129 IonicContact OD2-CZ 3.37Å; D79-R129 IonicContact OD2-NH2 3.67Å; D79-R129 PolarHBondContact OD2-NH2 2.93Å
130	L	91.6	Very high	79	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.1	167.3	176.9	71	0	0	0	108.7	V39 V41 V49 L102 T110 G111 Y113 V132	V39-L130 HydrophobicContact CB-CD1 4.04Å; V39-L130 HydrophobicContact CG1-CD1 3.93Å; V39-L130 WeakPolarHBondContact O-CA 3.38Å; V41-L130 HydrophobicContact CB-CD1 4.49Å; V41-L130 HydrophobicContact CG2-CD1 3.77Å; V49-L130 HydrophobicContact CG2-CB 4.15Å; V49-L130 HydrophobicContact CG2-CD1 3.96Å; V49-L130 HydrophobicContact CG2-CD2 4.22Å; V49-L130 HydrophobicContact CG2-CG 4.33Å; L102-L130 HydrophobicContact CD1-CD2 3.9Å; L102-L130 HydrophobicContact CD2-CD2 3.76Å; T110-L130 WeakPolarHBondContact CA-O 3.16Å; G111-L130 PolarHBondContact N-O 3.35Å; G111-L130 PolarHBondContact O-N 3.09Å; Y113-L130 HydrophobicContact CD2-CB 3.59Å; Y113-L130 HydrophobicContact CD2-CD2 4.12Å; Y113-L130 HydrophobicContact CE2-CB 3.58Å; Y113-L130 HydrophobicContact CE2-CD2 3.43Å; Y113-L130 VanDerWaalsContact CE2-CD2 3.43Å; Y113-L130 HydrophobicContact CE2-CG 4.1Å; L130-V132 HydrophobicContact CD2-CG2 4.27Å; L130-V132 HydrophobicContact CG-CG2 4.28Å
131	Q	90.3	Very high	77.6	Confident	82 Å²	82	63.8 Å²	63.8	38%	0.383	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	118.6	173.2	-171.3	179.1	3.7	0	0	110	V39 L40 V41 T110 L133	V39-Q131 PolarHBondContact O-N 2.98Å; L40-Q131 WeakPolarHBondContact CA-O 3.36Å; L40-Q131 HydrophobicContact CD2-CB 3.76Å; L40-Q131 HydrophobicContact CD2-CG 4.37Å; V41-Q131 PolarHBondContact N-O 2.66Å; T110-Q131 HydrophobicContact CG2-CG 4.33Å; Q131-L133 HydrophobicContact CG-CD2 3.97Å
132	V	89.3	Confident	76.1	Confident	7 Å²	7	62.6 Å²	62.6	4%	0.042	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	109.1	176.8	-174.4	0	0	0	0	108.8	V41 D43 A105 D109 T110 L130	V41-V132 CarbonylContact O-C 3.6Å; V41-V132 VanDerWaalsContact O-CA 3.28Å; V41-V132 WeakPolarHBondContact O-CA 3.26Å; D43-V132 HydrophobicContact CB-CG1 4.05Å; A105-V132 HydrophobicContact CB-CG1 4.28Å; A105-V132 HydrophobicContact CB-CG2 4.14Å; D109-V132 HydrophobicContact CB-CG2 4.25Å; T110-V132 PolarHBondContact OG1-N 2.81Å; L130-V132 HydrophobicContact CD2-CG2 4.27Å; L130-V132 HydrophobicContact CG-CG2 4.28Å
133	L	86.3	Confident	75	Confident	30 Å²	30	64.2 Å²	64.2	16%	0.157	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	126.4	-175.9	-61.1	176.7	0	0	0	110.2	V41 L42 D43 Q131 A148	V41-L133 PolarHBondContact O-N 3Å; L42-L133 HydrophobicContact CD2-CB 4.23Å; D43-L133 WeakPolarHBondContact CB-O 3.31Å; D43-L133 PolarHBondContact N-O 2.99Å; Q131-L133 HydrophobicContact CG-CD2 3.97Å; L133-A148 HydrophobicContact CD1-CB 3.95Å
134	Q	80.4	Confident	74	Confident	81 Å²	81	64.3 Å²	64.3	38%	0.379	34%	0.335	S	S	.	.			trans	-70	150.4	169.8	-65.3	-174.2	5	0	0	110.3	A107 D136 Q137	A107-Q134 HydrophobicContact CB-CG 3.95Å; Q134-D136 WeakPolarHBondContact CB-OD1 3.49Å; Q134-D136 PolarHBondContact O-N 3.32Å; Q134-D136 VanDerWaalsContact O-N 3.16Å; Q134-Q137 HydrophobicContact CB-CG 4.47Å; Q134-Q137 PolarHBondContact O-N 2.86Å; Q134-Q137 VanDerWaalsContact O-N 3.11Å
135	R	67.4	Low	73.1	Confident	178 Å²	178	65.8 Å²	65.8	67%	0.672	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-20.2	-173.7	-71.3	-175.2	-175.4	159.4	2.3	114.3
136	D	61.2	Low	72.2	Confident	102 Å²	102	65.3 Å²	65.3	55%	0.545	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-20	178.1	62.4	-31.8	0	0	0	113.7	Q134	Q134-D136 WeakPolarHBondContact CB-OD1 3.49Å; Q134-D136 PolarHBondContact O-N 3.32Å; Q134-D136 VanDerWaalsContact O-N 3.16Å
137	Q	55	Low	71.4	Confident	125 Å²	125	66.2 Å²	66.2	58%	0.584	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-11.3	178.7	-62.9	177	6.6	0	0	113.3	Q134	Q134-Q137 HydrophobicContact CB-CG 4.47Å; Q134-Q137 PolarHBondContact O-N 2.86Å; Q134-Q137 VanDerWaalsContact O-N 3.11Å
138	A	52.7	Low	70.4	Confident	11 Å²	11	66.3 Å²	66.3	9%	0.091	35%	0.351	C	S	.	.	S	Bend	trans	-82.6	145.4	176.1	0	0	0	0	0	111.3	L42 R140 Q146	L42-A138 HydrophobicContact CD2-CB 4.32Å; A138-R140 PolarHBondContact O-N 3.36Å; A138-R140 VanDerWaalsContact O-N 3.1Å; A138-Q146 HydrophobicContact CB-CB 4Å; A138-Q146 HydrophobicContact CB-CG 4.04Å; A138-Q146 PolarHBondContact O-OE1 3.47Å
139	V	50	Low	69.4	Low	126 Å²	126	69.1 Å²	69.1	76%	0.764	37%	0.365	S	S	*	.			trans	-55.5	115.7	-170.8	178.4	0	0	0	0	111.2	S141 Q146	V139-S141 VanDerWaalsContact C-N 3.35Å; V139-S141 PolarHBondContact O-N 3.43Å; V139-Q146 PolarHBondContact O-NE2 3.38Å; V139-Q146 PolarHBondContact O-OE1 2.94Å
140	R	47.5	Very low	68.7	Low	225 Å²	225	69.7 Å²	69.7	85%	0.849	39%	0.386	S	S	*	.			trans	-66.8	89.3	173.3	-67.3	-175.6	-171.7	-165.5	2.3	110.3	A138	A138-R140 PolarHBondContact O-N 3.36Å; A138-R140 VanDerWaalsContact O-N 3.1Å
141	S	52.1	Low	68.3	Low	37 Å²	37	71.6 Å²	71.6	26%	0.259	40%	0.402	S	S	.	.			trans	-98.5	118.6	156.2	-141.9	0	0	0	0	107.9	V139 G143 C144 M187	V139-S141 VanDerWaalsContact C-N 3.35Å; V139-S141 PolarHBondContact O-N 3.43Å; S141-G143 PolarHBondContact O-N 3.31Å; S141-C144 PolarHBondContact O-N 3.32Å; S141-M187 WeakPolarHBondContact OG-CE 3.14Å
142	A	51.4	Low	68.2	Low	81 Å²	81	70.6 Å²	70.6	67%	0.669	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	114.1	-169.5	0	0	0	0	0	111.2
143	G	59.8	Low	68.3	Low	73 Å²	73	74.5 Å²	74.5	75%	0.753	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.1	7.2	174.4	0	0	0	0	0	116.5	S141	S141-G143 PolarHBondContact O-N 3.31Å
144	C	70.1	Confident	68.7	Low	16 Å²	16	75.8 Å²	75.8	11%	0.108	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-100.9	143.3	-178.7	-66	0	0	0	0	113.8	S141 Q146 M187 C194	S141-C144 PolarHBondContact O-N 3.32Å; C144-Q146 PolarHBondContact O-N 2.82Å; C144-Q146 PolarHBondContact O-NE2 3.43Å; C144-M187 HydrophobicContact CB-SD 4.31Å; C144-M187 PolarHBondContact SG-SD 2.94Å; C144-C194 WeakPolarHBondContact CA-SG 3.41Å; C144-C194 HydrophobicContact CB-CB 3.94Å; C144-C194 WeakPolarHBondContact CB-SG 3.2Å; C144-C194 WeakPolarHBondContact SG-CB 3.37Å; C144-C194 PolarHBondContact SG-N 2.92Å; C144-C194 VanDerWaalsContact SG-N 3.45Å; C144-C194 CovalentContact SG-SG 2.01Å; C144-C194 PolarHBondContact SG-SG 2.95Å
145	P	70.5	Confident	69.4	Low	40 Å²	40	73.2 Å²	73.2	26%	0.26	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-58.5	131.6	168.5	-17.9	30.2	0	0	0	109.5	T185 I225 T240	P145-T185 HydrophobicContact CG-CG2 4.26Å; P145-I225 HydrophobicContact CB-CG2 4.03Å; P145-I225 HydrophobicContact CG-CG2 4.16Å; P145-T240 HydrophobicContact CB-CG2 4.12Å
146	Q	73.3	Confident	70.7	Confident	46 Å²	46	65 Å²	65	22%	0.215	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-66.1	146.5	174.5	-60.7	-58.8	-55.8	0	0	108.7	L42 A138 V139 C144	L42-Q146 VanDerWaalsContact CD1-C 3.49Å; L42-Q146 HydrophobicContact CD1-CB 3.87Å; L42-Q146 WeakPolarHBondContact CD1-O 3.33Å; L42-Q146 HydrophobicContact CD2-CB 4.22Å; A138-Q146 HydrophobicContact CB-CB 4Å; A138-Q146 HydrophobicContact CB-CG 4.04Å; A138-Q146 PolarHBondContact O-OE1 3.47Å; V139-Q146 PolarHBondContact O-NE2 3.38Å; V139-Q146 PolarHBondContact O-OE1 2.94Å; C144-Q146 PolarHBondContact O-N 2.82Å; C144-Q146 PolarHBondContact O-NE2 3.43Å
147	V	73.9	Confident	72.3	Confident	38 Å²	38	60.3 Å²	60.3	23%	0.23	36%	0.358	C	S	.	.			trans	-135.9	123.3	177.6	-168.6	0	0	0	0	108.5	I225 T240	V147-I225 HydrophobicContact CG2-CD1 4.16Å; V147-I225 HydrophobicContact CG2-CG1 4.16Å; V147-I225 HydrophobicContact CG2-CG2 3.81Å; V147-T240 HydrophobicContact CG2-CG2 3.84Å
148	A	70.6	Confident	74.1	Confident	10 Å²	10	55.5 Å²	55.5	8%	0.083	34%	0.336	C	S	.	.			trans	-81.2	-36.1	178.5	0	0	0	0	0	112.4	L40 L42 L133	L40-A148 HydrophobicContact CB-CB 3.88Å; L40-A148 WeakPolarHBondContact CB-O 3.45Å; L40-A148 WeakPolarHBondContact CD1-O 3.44Å; L42-A148 HydrophobicContact CD2-CB 4Å; L42-A148 HydrophobicContact CG-CB 3.73Å; L133-A148 HydrophobicContact CD1-CB 3.95Å
149	M	71.8	Confident	76	Confident	65 Å²	65	61.4 Å²	61.4	32%	0.32	36%	0.361	S	S	.	.	S	Bend	trans	-87.2	148.9	-175	-66.8	-163.5	58.6	0	0	113.5	L40 R241	L40-M149 WeakPolarHBondContact O-CG 3.07Å; M149-R241 VanDerWaalsContact CE-NH1 3.33Å; M149-R241 PolarHBondContact SD-NH1 3.37Å; M149-R241 PolarHBondContact SD-NH2 3.16Å
150	A	77.3	Confident	78.1	Confident	90 Å²	90	57.6 Å²	57.6	74%	0.744	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-57.6	142.2	172	0	0	0	0	0	111	T152	A150-T152 PolarHBondContact O-N 3.17Å
151	A	84	Confident	80.3	Confident	41 Å²	41	49.1 Å²	49.1	34%	0.339	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-68.4	132.4	-178	0	0	0	0	0	111	L223 S242 K244	A151-L223 HydrophobicContact CB-CD1 3.6Å; A151-S242 WeakPolarHBondContact CA-O 3.13Å; A151-S242 VanDerWaalsContact CA-OG 3.28Å; A151-S242 WeakPolarHBondContact CA-OG 3.46Å; A151-S242 WeakPolarHBondContact CB-OG 3.06Å; A151-K244 HydrophobicContact CB-CB 4.04Å
152	T	87.9	Confident	82.4	Confident	60 Å²	60	50.9 Å²	50.9	37%	0.368	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	130.6	169.8	52.7	0	0	0	0	108.9	A150 P167 S242 I243 K244	A150-T152 PolarHBondContact O-N 3.17Å; T152-P167 HydrophobicContact CG2-CB 4.4Å; T152-P167 HydrophobicContact CG2-CG 3.97Å; T152-P167 WeakPolarHBondContact OG1-CG 3.41Å; T152-S242 PolarHBondContact N-O 3.44Å; T152-S242 PolarHBondContact OG1-O 3.31Å; T152-I243 CarbonylContact O-C 3.49Å; T152-I243 VanDerWaalsContact O-CA 3.25Å; T152-I243 WeakPolarHBondContact O-CA 3.31Å; T152-I243 WeakPolarHBondContact O-CG2 3.26Å; T152-K244 PolarHBondContact O-N 3.11Å
153	E	92	Very high	84.5	Confident	90 Å²	90	49.9 Å²	49.9	42%	0.421	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	132.1	-179.9	-170.5	169.8	-137.6	0	0	111.4	L155 K244 R323	E153-L155 HydrophobicContact CG-CD2 4.17Å; E153-K244 WeakPolarHBondContact CA-O 3.43Å; E153-R323 IonicContact OE1-CZ 2.79Å; E153-R323 VanDerWaalsContact OE1-CZ 3.25Å; E153-R323 IonicContact OE1-NH1 2.58Å; E153-R323 PolarHBondContact OE1-NH1 3.11Å; E153-R323 IonicContact OE1-NH2 2.91Å; E153-R323 PolarHBondContact OE1-NH2 3.33Å; E153-R323 IonicContact OE2-CZ 3.16Å; E153-R323 IonicContact OE2-NH2 3.92Å; E153-R323 PolarHBondContact OE2-NH2 3.25Å
154	E	94.3	Very high	86.3	Confident	57 Å²	57	46.6 Å²	46.6	27%	0.266	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	121.7	175.4	-76.5	-67.7	172.7	0	0	109.9	K162 L164 I243 K244 V245 S246	E154-K162 VanDerWaalsContact OE2-CE 3.3Å; E154-K162 WeakPolarHBondContact OE2-CE 3.23Å; E154-K162 IonicContact OE2-NZ 3.29Å; E154-K162 PolarHBondContact OE2-NZ 2.89Å; E154-L164 HydrophobicContact CB-CD2 4.18Å; E154-L164 HydrophobicContact CG-CD2 4.16Å; E154-I243 HydrophobicContact CB-CG2 3.83Å; E154-I243 HydrophobicContact CG-CG2 3.47Å; E154-I243 VanDerWaalsContact CG-CG2 3.47Å; E154-K244 PolarHBondContact N-O 3.3Å; E154-V245 HydrophobicContact CB-CG2 4.46Å; E154-V245 WeakPolarHBondContact O-CA 3.22Å; E154-S246 PolarHBondContact O-N 3.11Å
155	L	94.3	Very high	87.5	Confident	27 Å²	27	49.1 Å²	49.1	14%	0.141	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	132.4	178.3	-56.2	179.3	0	0	0	110.2	E153 K162 S246 I248 F286 I288	E153-L155 HydrophobicContact CG-CD2 4.17Å; L155-K162 PolarHBondContact O-NZ 2.79Å; L155-S246 WeakPolarHBondContact CA-O 3.49Å; L155-I248 HydrophobicContact CB-CD1 4.34Å; L155-I248 HydrophobicContact CB-CG2 4.4Å; L155-I248 HydrophobicContact CD2-CG2 4.22Å; L155-F286 HydrophobicContact CD1-CE1 3.59Å; L155-F286 HydrophobicContact CD1-CZ 4Å; L155-I288 HydrophobicContact CD1-CG1 4.4Å
156	I	94.8	Very high	88.6	Confident	6 Å²	6	47.4 Å²	47.4	3%	0.031	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	128.6	178.7	-46.3	178.2	0	0	0	109.2	K162 L164 I213 M216 V245 S246 G247 I248	I156-K162 HydrophobicContact CD1-CB 3.82Å; I156-K162 HydrophobicContact CD1-CD 4.3Å; I156-K162 HydrophobicContact CG1-CB 3.92Å; I156-K162 HydrophobicContact CG1-CD 3.75Å; I156-K162 HydrophobicContact CG1-CG 4.47Å; I156-K162 HydrophobicContact CG2-CB 3.98Å; I156-L164 HydrophobicContact CD1-CD2 4.45Å; I156-I213 HydrophobicContact CD1-CD1 3.71Å; I156-M216 HydrophobicContact CB-CB 4.21Å; I156-M216 HydrophobicContact CB-CG 3.96Å; I156-M216 HydrophobicContact CB-SD 4.3Å; I156-M216 HydrophobicContact CD1-SD 4.19Å; I156-M216 HydrophobicContact CG2-CB 3.65Å; I156-M216 HydrophobicContact CG2-CG 3.99Å; I156-V245 HydrophobicContact CD1-CG1 3.57Å; I156-V245 HydrophobicContact CG1-CG1 4.15Å; I156-S246 PolarHBondContact N-O 3.29Å; I156-S246 VanDerWaalsContact N-O 3.09Å; I156-G247 CarbonylContact O-C 3.55Å; I156-G247 WeakPolarHBondContact O-CA 3.47Å; I156-I248 PolarHBondContact O-N 3.33Å
157	G	94.2	Very high	89.4	Confident	3 Å²	3	46.2 Å²	46.2	3%	0.031	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	136	173.8	0	0	0	0	0	111.5	Q160 M216 I248	G157-Q160 WeakPolarHBondContact O-CA 3.28Å; G157-Q160 VanDerWaalsContact O-CB 3.25Å; G157-Q160 WeakPolarHBondContact O-CB 3.49Å; G157-Q160 PolarHBondContact O-N 2.99Å; G157-M216 WeakPolarHBondContact O-CB 3.4Å; G157-I248 CarbonylContact C-O 3.58Å; G157-I248 VanDerWaalsContact CA-O 3.29Å; G157-I248 WeakPolarHBondContact CA-O 3.31Å
158	F	94.3	Very high	90.1	Very high	24 Å²	24	47.1 Å²	47.1	11%	0.105	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	144.7	171.5	-68.5	-57.8	0	0	0	110.8	Q160 M216 I218 E221 I248 P250 H322	F158-Q160 PolarHBondContact O-N 2.59Å; F158-Q160 VanDerWaalsContact O-N 3.11Å; F158-M216 HydrophobicContact CD1-CG 4.15Å; F158-M216 HydrophobicContact CE1-CG 4.48Å; F158-I218 HydrophobicContact CE1-CG1 3.8Å; F158-I218 HydrophobicContact CZ-CG1 3.91Å; F158-E221 WeakPolarHBondContact CZ-OE1 3.45Å; F158-I248 VanDerWaalsContact CD2-O 3.23Å; F158-I248 WeakPolarHBondContact CD2-O 3.12Å; F158-I248 PolarHBondContact N-O 3.19Å; F158-P250 WeakPolarHBondContact O-CG 3.26Å; F158-H322 HydrophobicContact CE2-CB 3.88Å; F158-H322 AromaticContact CE2-CD2 3.59Å; F158-H322 AromaticContact CE2-CG 3.7Å; F158-H322 HydrophobicContact CZ-CB 4.44Å; F158-H322 AromaticContact CZ-CD2 3.36Å; F158-H322 WeakPolarHBondContact CZ-CD2 3.35Å; F158-H322 AromaticContact CZ-CG 3.98Å; F158-H322 AromaticContact CZ-NE2 3.86Å
159	Q	93	Very high	91	Very high	135 Å²	135	47.5 Å²	47.5	63%	0.631	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	8.6	-174.2	-53.1	-64.6	-39.4	0	0	114.8	M216	Q159-M216 PolarHBondContact N-O 2.85Å
160	Q	93.8	Very high	91.8	Very high	46 Å²	46	50.6 Å²	50.6	22%	0.215	29%	0.289	C	S	.	.			trans	-111.9	160	173.9	-55.5	179.5	-25.3	0	0	110.4	G157 F158 M216 T251	G157-Q160 WeakPolarHBondContact O-CA 3.28Å; G157-Q160 VanDerWaalsContact O-CB 3.25Å; G157-Q160 WeakPolarHBondContact O-CB 3.49Å; G157-Q160 PolarHBondContact O-N 2.99Å; F158-Q160 PolarHBondContact O-N 2.59Å; F158-Q160 VanDerWaalsContact O-N 3.11Å; Q160-M216 WeakPolarHBondContact O-CB 3.31Å; Q160-M216 PolarHBondContact O-N 2.99Å; Q160-T251 PolarHBondContact NE2-OG1 2.83Å; Q160-T251 PolarHBondContact OE1-OG1 2.78Å; Q160-T251 VanDerWaalsContact OE1-OG1 3.13Å
161	G	93.8	Very high	92.1	Very high	47 Å²	47	48 Å²	48	49%	0.485	26%	0.263	S	S	.	.			trans	-106.1	152.1	177.6	0	0	0	0	0	112.9	I213 Y214	G161-I213 CarbonylContact C-O 3.56Å; G161-I213 WeakPolarHBondContact CA-O 3.39Å; G161-Y214 WeakPolarHBondContact CA-O 3.32Å; G161-Y214 PolarHBondContact N-O 3.14Å
162	K	95.5	Very high	92.1	Very high	73 Å²	73	46 Å²	46	32%	0.317	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	147	171.9	-160.8	172.4	-169.1	177	0	110.2	E154 L155 I156 I213	E154-K162 VanDerWaalsContact OE2-CE 3.3Å; E154-K162 WeakPolarHBondContact OE2-CE 3.23Å; E154-K162 IonicContact OE2-NZ 3.29Å; E154-K162 PolarHBondContact OE2-NZ 2.89Å; L155-K162 PolarHBondContact O-NZ 2.79Å; I156-K162 HydrophobicContact CD1-CB 3.82Å; I156-K162 HydrophobicContact CD1-CD 4.3Å; I156-K162 HydrophobicContact CG1-CB 3.92Å; I156-K162 HydrophobicContact CG1-CD 3.75Å; I156-K162 HydrophobicContact CG1-CG 4.47Å; I156-K162 HydrophobicContact CG2-CB 3.98Å; K162-I213 PolarHBondContact N-O 3.45Å; K162-I213 PolarHBondContact O-N 3.47Å
163	T	96.1	Very high	92	Very high	61 Å²	61	45.8 Å²	45.8	37%	0.374	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	121.1	172.4	-57	0	0	0	0	108.8	R210	T163-R210 HydrophobicContact CG2-CB 3.71Å; T163-R210 HydrophobicContact CG2-CG 4.35Å
164	L	95.9	Very high	91.7	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.016	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	132.7	177.3	-54.5	179.4	0	0	0	109.8	E154 I156 W184 L211 I213 I243 V245	E154-L164 HydrophobicContact CB-CD2 4.18Å; E154-L164 HydrophobicContact CG-CD2 4.16Å; I156-L164 HydrophobicContact CD1-CD2 4.45Å; L164-W184 HydrophobicContact CB-CH2 3.95Å; L164-W184 HydrophobicContact CB-CZ3 4.49Å; L164-L211 HydrophobicContact CB-CB 4.36Å; L164-L211 HydrophobicContact CD1-CD2 4.25Å; L164-L211 PolarHBondContact N-O 3.47Å; L164-L211 PolarHBondContact O-N 3.16Å; L164-I213 HydrophobicContact CD1-CD1 3.9Å; L164-I213 HydrophobicContact CG-CD1 4.44Å; L164-I243 HydrophobicContact CB-CD1 4.45Å; L164-V245 HydrophobicContact CD1-CG2 3.71Å; L164-V245 HydrophobicContact CD2-CG2 4.4Å
165	T	95.4	Very high	91	Very high	69 Å²	69	46.9 Å²	46.9	42%	0.423	25%	0.251	S	S	.	.			trans	-112.5	131.6	172.4	44	0	0	0	0	108.8	R210	T165-R210 HydrophobicContact CG2-CG 4.04Å
166	C	93.7	Very high	90.6	Very high	4 Å²	4	46.6 Å²	46.6	3%	0.027	25%	0.252	C	S	.	.			trans	-62.1	130.1	178.9	-169.2	0	0	0	0	110	N168 L169 V182 W184 C226 V228	C166-N168 PolarHBondContact O-N 2.91Å; C166-L169 HydrophobicContact CB-CB 4.24Å; C166-L169 WeakPolarHBondContact O-CB 3.42Å; C166-L169 PolarHBondContact O-N 2.81Å; C166-V182 HydrophobicContact CB-CG1 4.39Å; C166-W184 HydrophobicContact CB-CH2 4.39Å; C166-W184 HydrophobicContact CB-CZ2 4.21Å; C166-C226 VanDerWaalsContact CA-SG 3.5Å; C166-C226 HydrophobicContact CB-CB 3.71Å; C166-C226 WeakPolarHBondContact CB-SG 3.47Å; C166-C226 WeakPolarHBondContact SG-CB 3.14Å; C166-C226 CovalentContact SG-SG 2.04Å; C166-C226 PolarHBondContact SG-SG 2.8Å; C166-V228 HydrophobicContact CB-CG2 4.2Å; C166-V228 WeakPolarHBondContact SG-CG2 3.32Å
167	P	91.6	Very high	90.2	Very high	21 Å²	21	51.6 Å²	51.6	14%	0.136	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	135.5	-179.8	-27.7	34.3	0	0	0	111.6	T152 L169 R241 I243	T152-P167 HydrophobicContact CG2-CB 4.4Å; T152-P167 HydrophobicContact CG2-CG 3.97Å; T152-P167 WeakPolarHBondContact OG1-CG 3.41Å; P167-L169 PolarHBondContact O-N 2.94Å; P167-L169 VanDerWaalsContact O-N 3.14Å; P167-R241 HydrophobicContact CB-CB 4.33Å; P167-R241 HydrophobicContact CB-CG 4.19Å; P167-R241 HydrophobicContact CG-CB 4.16Å; P167-I243 HydrophobicContact CG-CD1 4.47Å; P167-I243 HydrophobicContact CG-CG1 4.19Å
168	N	87.1	Confident	89.8	Confident	58 Å²	58	54.1 Å²	54.1	31%	0.31	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	14.4	176.1	-48.1	-17.2	0	0	0	115.1	W48 C166 E170 D171 A172 R241	W48-N168 HydrophobicContact CH2-CB 3.34Å; W48-N168 VanDerWaalsContact CH2-ND2 3.29Å; W48-N168 WeakPolarHBondContact CH2-ND2 3.27Å; W48-N168 HydrophobicContact CZ2-CB 3.45Å; W48-N168 VanDerWaalsContact CZ2-CB 3.45Å; W48-N168 VanDerWaalsContact CZ2-CG 3.42Å; W48-N168 WeakPolarHBondContact CZ2-ND2 3.23Å; C166-N168 PolarHBondContact O-N 2.91Å; N168-E170 VanDerWaalsContact C-N 3.31Å; N168-E170 PolarHBondContact O-N 3.36Å; N168-D171 PolarHBondContact O-N 3.33Å; N168-A172 PolarHBondContact O-N 2.84Å; N168-R241 PolarHBondContact ND2-NH1 3.15Å; N168-R241 PolarHBondContact ND2-NH2 2.82Å
169	L	90.1	Very high	89.5	Confident	17 Å²	17	60.2 Å²	60.2	9%	0.089	33%	0.33	C	S	.	.	H	α-helix	trans	-60.7	-39.3	172.7	177.8	65.5	0	0	0	112.1	C166 P167 D171 A172 S173 P180 V182 V228	C166-L169 HydrophobicContact CB-CB 4.24Å; C166-L169 WeakPolarHBondContact O-CB 3.42Å; C166-L169 PolarHBondContact O-N 2.81Å; P167-L169 PolarHBondContact O-N 2.94Å; P167-L169 VanDerWaalsContact O-N 3.14Å; L169-D171 VanDerWaalsContact C-N 3.34Å; L169-D171 PolarHBondContact O-N 3Å; L169-A172 PolarHBondContact O-N 3.44Å; L169-S173 WeakPolarHBondContact O-CB 3.32Å; L169-S173 PolarHBondContact O-N 3.08Å; L169-P180 HydrophobicContact CD1-CB 4.08Å; L169-P180 HydrophobicContact CD1-CG 3.84Å; L169-V182 HydrophobicContact CD1-CG2 3.77Å; L169-V182 HydrophobicContact CD2-CG2 4.1Å; L169-V228 HydrophobicContact CD1-CG1 3.61Å; L169-V228 HydrophobicContact CD1-CG2 4.08Å
170	E	88.1	Confident	89.5	Confident	130 Å²	130	54.5 Å²	54.5	61%	0.607	30%	0.304	S	S	*	.	H	α-helix	trans	-62.7	-41.4	179.9	-68	-171.1	177.4	0	0	111.9	N168 S173 K174	N168-E170 VanDerWaalsContact C-N 3.31Å; N168-E170 PolarHBondContact O-N 3.36Å; E170-S173 WeakPolarHBondContact CA-OG 3.17Å; E170-S173 PolarHBondContact O-N 3.11Å; E170-S173 PolarHBondContact O-OG 2.82Å; E170-K174 WeakPolarHBondContact O-CG 3.15Å; E170-K174 PolarHBondContact O-N 3.16Å; E170-K174 VanDerWaalsContact O-N 3.12Å
171	D	84.1	Confident	89.5	Confident	35 Å²	35	56 Å²	56	19%	0.187	32%	0.317	C	S	.	.	H	α-helix	trans	-62.8	-46.3	176.4	-67.1	-29.2	0	0	0	110.5	R99 W101 N168 L169 S173 K174 M175	R99-D171 IonicContact CZ-OD2 3.86Å; R99-D171 IonicContact NH1-OD2 3.17Å; R99-D171 PolarHBondContact NH1-OD2 2.81Å; R99-D171 IonicContact NH2-OD2 3.08Å; W101-D171 HydrophobicContact CH2-CB 4.4Å; N168-D171 PolarHBondContact O-N 3.33Å; L169-D171 VanDerWaalsContact C-N 3.34Å; L169-D171 PolarHBondContact O-N 3Å; D171-S173 VanDerWaalsContact C-N 3.3Å; D171-S173 PolarHBondContact O-N 2.84Å; D171-K174 PolarHBondContact O-N 2.77Å; D171-M175 VanDerWaalsContact C-CE 3.49Å; D171-M175 HydrophobicContact CB-CE 4.38Å; D171-M175 WeakPolarHBondContact O-CE 3.37Å
172	A	83.9	Confident	89.6	Confident	1 Å²	1	54 Å²	54	1%	0.008	30%	0.295	C	S	.	.	H	α-helix	trans	-58.8	-41.5	174.9	0	0	0	0	0	112.2	N168 L169 K174 M175 A176 Y230 F239	N168-A172 PolarHBondContact O-N 2.84Å; L169-A172 PolarHBondContact O-N 3.44Å; A172-K174 PolarHBondContact O-N 2.95Å; A172-M175 PolarHBondContact O-N 2.85Å; A172-A176 WeakPolarHBondContact O-CB 3.4Å; A172-A176 PolarHBondContact O-N 3.41Å; A172-A176 VanDerWaalsContact O-N 3.08Å; A172-Y230 HydrophobicContact CB-CD1 4.41Å; A172-Y230 HydrophobicContact CB-CE1 4.47Å; A172-F239 HydrophobicContact CB-CE1 3.59Å; A172-F239 HydrophobicContact CB-CZ 3.89Å
173	S	86.8	Confident	89.6	Confident	54 Å²	54	54.1 Å²	54.1	38%	0.378	30%	0.299	S	S	.	.	H	α-helix	trans	-64.1	-37.2	-179.4	74.2	0	0	0	0	113.1	L169 E170 D171 M175	L169-S173 WeakPolarHBondContact O-CB 3.32Å; L169-S173 PolarHBondContact O-N 3.08Å; E170-S173 WeakPolarHBondContact CA-OG 3.17Å; E170-S173 PolarHBondContact O-N 3.11Å; E170-S173 PolarHBondContact O-OG 2.82Å; D171-S173 VanDerWaalsContact C-N 3.3Å; D171-S173 PolarHBondContact O-N 2.84Å; S173-M175 PolarHBondContact O-N 3.33Å
174	K	85.2	Confident	89.5	Confident	154 Å²	154	51.3 Å²	51.3	67%	0.67	28%	0.282	S	S	*	.	H	α-helix	trans	-66.2	-26.3	177.9	-70.6	168.7	-172.8	160.4	0	113.2	E170 D171 A172	E170-K174 WeakPolarHBondContact O-CG 3.15Å; E170-K174 PolarHBondContact O-N 3.16Å; E170-K174 VanDerWaalsContact O-N 3.12Å; D171-K174 PolarHBondContact O-N 2.77Å; A172-K174 PolarHBondContact O-N 2.95Å
175	M	79.3	Confident	89.3	Confident	17 Å²	17	51.9 Å²	51.9	8%	0.084	29%	0.285	C	S	.	.	H	α-helix	trans	-103.1	-9.7	-175.3	-64.1	179.1	-75.1	0	0	113.8	E96 W101 D171 A172 S173 R232	E96-M175 WeakPolarHBondContact OE2-CG 3.38Å; W101-M175 HydrophobicContact CD2-CE 4.12Å; W101-M175 HydrophobicContact CD2-SD 4.01Å; W101-M175 VanDerWaalsContact CE2-SD 3.55Å; W101-M175 HydrophobicContact CE3-CE 4.06Å; W101-M175 HydrophobicContact CE3-SD 4.44Å; W101-M175 HydrophobicContact CH2-CE 3.13Å; W101-M175 HydrophobicContact CH2-SD 4.19Å; W101-M175 HydrophobicContact CZ2-CE 3.14Å; W101-M175 HydrophobicContact CZ2-SD 3.68Å; W101-M175 HydrophobicContact CZ3-CE 3.58Å; D171-M175 VanDerWaalsContact C-CE 3.49Å; D171-M175 HydrophobicContact CB-CE 4.38Å; D171-M175 WeakPolarHBondContact O-CE 3.37Å; A172-M175 PolarHBondContact O-N 2.85Å; S173-M175 PolarHBondContact O-N 3.33Å; M175-R232 PolarHBondContact O-NE 3.36Å
176	A	85.9	Confident	89	Confident	20 Å²	20	49.4 Å²	49.4	17%	0.165	27%	0.269	C	S	.	.			trans	-81.7	145.2	-177	0	0	0	0	0	111	A172 S178 Y230 Q231	A172-A176 WeakPolarHBondContact O-CB 3.4Å; A172-A176 PolarHBondContact O-N 3.41Å; A172-A176 VanDerWaalsContact O-N 3.08Å; A176-S178 VanDerWaalsContact CB-O 3.22Å; A176-S178 WeakPolarHBondContact CB-O 3.45Å; A176-S178 PolarHBondContact O-N 3.49Å; A176-Y230 HydrophobicContact CB-CD2 3.88Å; A176-Y230 HydrophobicContact CB-CG 4.28Å; A176-Q231 CarbonylContact C-O 3.55Å; A176-Q231 WeakPolarHBondContact CA-O 3.41Å
177	D	86.4	Confident	88.7	Confident	111 Å²	111	50.2 Å²	50.2	59%	0.594	27%	0.272	S	S	*	.	S	Bend	trans	-76.2	-16.5	174.4	-59.4	-27.6	0	0	0	111.6	Q231 R232 R233	D177-Q231 PolarHBondContact N-O 3.46Å; D177-R232 WeakPolarHBondContact OD2-CA 3.19Å; D177-R233 PolarHBondContact OD2-N 2.84Å
178	S	86.6	Confident	88	Confident	56 Å²	56	50.8 Å²	50.8	39%	0.392	27%	0.274	S	S	.	.	S	Bend	trans	-142.6	160.6	-179.8	70.9	0	0	0	0	111	A176	A176-S178 VanDerWaalsContact CB-O 3.22Å; A176-S178 WeakPolarHBondContact CB-O 3.45Å; A176-S178 PolarHBondContact O-N 3.49Å
179	D	88.1	Confident	87.3	Confident	152 Å²	152	54.4 Å²	54.4	81%	0.813	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-56.3	129.4	175.9	-73.1	-40.2	0	0	0	111.6
180	P	92.9	Very high	86.4	Confident	15 Å²	15	58.2 Å²	58.2	10%	0.097	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-71	147.4	-179.5	28.4	-34.3	0	0	0	111.2	L169 T209 V228 R229	L169-P180 HydrophobicContact CD1-CB 4.08Å; L169-P180 HydrophobicContact CD1-CG 3.84Å; P180-T209 WeakPolarHBondContact O-CG2 3.15Å; P180-V228 HydrophobicContact CB-CG1 4.04Å; P180-R229 CarbonylContact C-O 3.58Å; P180-R229 WeakPolarHBondContact CA-O 3.21Å
181	T	93.5	Very high	85.4	Confident	78 Å²	78	57.8 Å²	57.8	48%	0.479	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	143.7	172.6	57.1	0	0	0	0	110.1	V228 R229	T181-V228 CarbonylContact O-C 3.48Å; T181-V228 WeakPolarHBondContact O-CA 3.45Å; T181-R229 PolarHBondContact N-O 3.33Å; T181-R229 PolarHBondContact O-N 3.03Å; T181-R229 PolarHBondContact OG1-O 3.28Å
182	V	95.4	Very high	84.9	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.024	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	127.1	-179.2	-175.2	0	0	0	0	109.5	C166 L169 Q206 T209 C226 T227 V228	C166-V182 HydrophobicContact CB-CG1 4.39Å; L169-V182 HydrophobicContact CD1-CG2 3.77Å; L169-V182 HydrophobicContact CD2-CG2 4.1Å; V182-Q206 PolarHBondContact O-NE2 3.41Å; V182-T209 HydrophobicContact CG2-CG2 3.87Å; V182-C226 HydrophobicContact CG1-CB 3.9Å; V182-T227 WeakPolarHBondContact CA-O 3.49Å; V182-V228 HydrophobicContact CG2-CG1 4.48Å; V182-V228 HydrophobicContact CG2-CG2 4.16Å
183	N	94.5	Very high	84.7	Confident	76 Å²	76	66.3 Å²	66.3	41%	0.406	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.7	171.5	-70	11.4	0	0	0	109	C226 T227 R229	N183-C226 WeakPolarHBondContact O-CA 3.19Å; N183-T227 PolarHBondContact N-O 3.01Å; N183-T227 PolarHBondContact O-N 3.31Å; N183-R229 PolarHBondContact ND2-NH1 2.99Å
184	W	94	Very high	84.6	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.008	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	135.2	177	-69.7	89.3	0	0	0	111.4	L164 C166 Y197 F199 T209 L211 I225 C226 I243	L164-W184 HydrophobicContact CB-CH2 3.95Å; L164-W184 HydrophobicContact CB-CZ3 4.49Å; C166-W184 HydrophobicContact CB-CH2 4.39Å; C166-W184 HydrophobicContact CB-CZ2 4.21Å; W184-Y197 PolarHBondContact O-N 3.24Å; W184-F199 HydrophobicContact CB-CZ 4.08Å; W184-T209 PolarHBondContact NE1-O 2.77Å; W184-L211 HydrophobicContact CB-CD2 4.44Å; W184-L211 HydrophobicContact CD2-CB 3.68Å; W184-L211 HydrophobicContact CD2-CD2 3.95Å; W184-L211 HydrophobicContact CD2-CG 4.4Å; W184-L211 HydrophobicContact CE3-CB 4.13Å; W184-L211 HydrophobicContact CE3-CD2 3.78Å; W184-L211 HydrophobicContact CG-CB 4.04Å; W184-L211 HydrophobicContact CG-CD2 4.26Å; W184-L211 HydrophobicContact CH2-CB 4.33Å; W184-L211 HydrophobicContact CZ2-CB 3.92Å; W184-L211 HydrophobicContact CZ3-CB 4.43Å; W184-L211 HydrophobicContact CZ3-CD2 4.33Å; W184-I225 WeakPolarHBondContact CA-O 3.47Å; W184-C226 HydrophobicContact CD2-CB 3.96Å; W184-C226 HydrophobicContact CE3-CB 3.8Å; W184-C226 HydrophobicContact CH2-CB 3.96Å; W184-C226 HydrophobicContact CZ2-CB 4.1Å; W184-C226 HydrophobicContact CZ3-CB 3.8Å; W184-I243 HydrophobicContact CH2-CD1 3.62Å; W184-I243 HydrophobicContact CZ3-CD1 3.78Å
185	T	91.9	Very high	84.6	Confident	16 Å²	16	58.8 Å²	58.8	10%	0.098	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	141.7	172.8	56.5	0	0	0	0	109.3	P145 D195 P196 Y224 I225	P145-T185 HydrophobicContact CG-CG2 4.26Å; T185-D195 WeakPolarHBondContact CA-O 3.07Å; T185-P196 HydrophobicContact CG2-CB 4.1Å; T185-Y224 WeakPolarHBondContact O-CA 3.48Å; T185-I225 PolarHBondContact N-O 3.37Å; T185-I225 PolarHBondContact O-N 2.88Å; T185-I225 WeakPolarHBondContact OG1-CB 3.36Å; T185-I225 PolarHBondContact OG1-O 2.86Å
186	Y	90.6	Very high	85.1	Confident	17 Å²	17	61.9 Å²	61.9	7%	0.067	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128	178.9	170.3	-114.1	0	0	0	109.4	N188 C194 D195 P219 E221 Y224	Y186-N188 HydrophobicContact CE1-CB 4.23Å; Y186-N188 PolarHBondContact O-N 3.43Å; Y186-C194 WeakPolarHBondContact O-CA 3.44Å; Y186-D195 PolarHBondContact N-O 3.3Å; Y186-D195 PolarHBondContact O-N 3.41Å; Y186-P219 PolarHBondContact OH-O 2.88Å; Y186-E221 PolarHBondContact OH-O 3.11Å; Y186-Y224 HydrophobicContact CD2-CD1 4.06Å; Y186-Y224 HydrophobicContact CD2-CD2 4.08Å; Y186-Y224 AromaticContact CD2-CE1 3.71Å; Y186-Y224 HydrophobicContact CD2-CE1 3.71Å; Y186-Y224 AromaticContact CD2-CE2 3.71Å; Y186-Y224 HydrophobicContact CD2-CE2 3.71Å; Y186-Y224 HydrophobicContact CD2-CG 4.25Å; Y186-Y224 AromaticContact CD2-CZ 3.53Å; Y186-Y224 HydrophobicContact CE2-CD2 4.49Å; Y186-Y224 HydrophobicContact CE2-CE1 4.49Å; Y186-Y224 AromaticContact CE2-CE2 3.85Å; Y186-Y224 HydrophobicContact CE2-CE2 3.85Å; Y186-Y224 AromaticContact CE2-CZ 3.87Å; Y186-Y224 HydrophobicContact CG-CE1 4.23Å
187	M	86.2	Confident	85.2	Confident	21 Å²	21	65.1 Å²	65.1	10%	0.103	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	105.9	174.3	-178.1	79.9	-147.9	0	0	109.2	S141 C144 Q189 L223	S141-M187 WeakPolarHBondContact OG-CE 3.14Å; C144-M187 HydrophobicContact CB-SD 4.31Å; C144-M187 PolarHBondContact SG-SD 2.94Å; M187-Q189 PolarHBondContact O-N 3.41Å; M187-L223 HydrophobicContact CB-CB 3.92Å; M187-L223 WeakPolarHBondContact CB-O 3.45Å; M187-L223 PolarHBondContact N-O 3.45Å
188	N	77	Confident	85.1	Confident	33 Å²	33	63.2 Å²	63.2	18%	0.176	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	105.5	169.8	-171	-30.4	0	0	0	109.3	Y186 A190 M191 S192 R193	Y186-N188 HydrophobicContact CE1-CB 4.23Å; Y186-N188 PolarHBondContact O-N 3.43Å; N188-A190 VanDerWaalsContact C-N 3.33Å; N188-A190 PolarHBondContact O-N 3.46Å; N188-A190 PolarHBondContact OD1-N 2.99Å; N188-A190 VanDerWaalsContact OD1-N 3.13Å; N188-M191 HydrophobicContact CB-CB 4.41Å; N188-M191 PolarHBondContact ND2-SD 3.23Å; N188-M191 VanDerWaalsContact ND2-SD 3.41Å; N188-M191 PolarHBondContact O-N 3.18Å; N188-M191 PolarHBondContact OD1-N 3.42Å; N188-S192 WeakPolarHBondContact O-CA 3.42Å; N188-S192 PolarHBondContact O-N 3.48Å; N188-R193 PolarHBondContact N-O 3.31Å; N188-R193 PolarHBondContact O-N 3.26Å
189	Q	72	Confident	85	Confident	134 Å²	134	61.7 Å²	61.7	63%	0.626	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-36.5	-178.3	-66.7	-178.6	-10.3	0	0	112.5	M187 M191	M187-Q189 PolarHBondContact O-N 3.41Å; Q189-M191 VanDerWaalsContact C-N 3.34Å; Q189-M191 PolarHBondContact O-N 3.23Å
190	A	72.3	Confident	84.6	Confident	96 Å²	96	66 Å²	66	79%	0.793	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-35.1	-178.9	0	0	0	0	0	112.5	N188	N188-A190 VanDerWaalsContact C-N 3.33Å; N188-A190 PolarHBondContact O-N 3.46Å; N188-A190 PolarHBondContact OD1-N 2.99Å; N188-A190 VanDerWaalsContact OD1-N 3.13Å
191	M	66.8	Low	84	Confident	122 Å²	122	66.8 Å²	66.8	60%	0.601	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-2.5	-177.5	-63.5	171.3	67.7	0	0	113	N188 Q189 R193	N188-M191 HydrophobicContact CB-CB 4.41Å; N188-M191 PolarHBondContact ND2-SD 3.23Å; N188-M191 VanDerWaalsContact ND2-SD 3.41Å; N188-M191 PolarHBondContact O-N 3.18Å; N188-M191 PolarHBondContact OD1-N 3.42Å; Q189-M191 VanDerWaalsContact C-N 3.34Å; Q189-M191 PolarHBondContact O-N 3.23Å; M191-R193 HydrophobicContact CB-CB 4.34Å; M191-R193 PolarHBondContact O-N 3.42Å; M191-R193 VanDerWaalsContact O-N 3.16Å
192	S	73.1	Confident	83.5	Confident	72 Å²	72	70.5 Å²	70.5	50%	0.503	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	40.2	-175.2	-61.9	0	0	0	0	112.7	N188	N188-S192 WeakPolarHBondContact O-CA 3.42Å; N188-S192 PolarHBondContact O-N 3.48Å
193	R	80.1	Confident	83.1	Confident	142 Å²	142	73.6 Å²	73.6	54%	0.536	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	147.7	-175.2	-178.7	-178.4	179.7	-171.5	0.3	110.2	N188 M191 D195	N188-R193 PolarHBondContact N-O 3.31Å; N188-R193 PolarHBondContact O-N 3.26Å; M191-R193 HydrophobicContact CB-CB 4.34Å; M191-R193 PolarHBondContact O-N 3.42Å; M191-R193 VanDerWaalsContact O-N 3.16Å; R193-D195 IonicContact CZ-OD1 2.67Å; R193-D195 IonicContact NE-OD1 3.35Å
194	C	84.1	Confident	83	Confident	11 Å²	11	70.8 Å²	70.8	7%	0.074	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	128.9	166.2	-77.3	0	0	0	0	112.4	C144 Y186	C144-C194 WeakPolarHBondContact CA-SG 3.41Å; C144-C194 HydrophobicContact CB-CB 3.94Å; C144-C194 WeakPolarHBondContact CB-SG 3.2Å; C144-C194 WeakPolarHBondContact SG-CB 3.37Å; C144-C194 PolarHBondContact SG-N 2.92Å; C144-C194 VanDerWaalsContact SG-N 3.45Å; C144-C194 CovalentContact SG-SG 2.01Å; C144-C194 PolarHBondContact SG-SG 2.95Å; Y186-C194 WeakPolarHBondContact O-CA 3.44Å
195	D	86.9	Confident	83	Confident	39 Å²	39	74.4 Å²	74.4	21%	0.209	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	115.5	176.1	-61.7	-44	0	0	0	108.4	T185 Y186 R193 F199	T185-D195 WeakPolarHBondContact CA-O 3.07Å; Y186-D195 PolarHBondContact N-O 3.3Å; Y186-D195 PolarHBondContact O-N 3.41Å; R193-D195 IonicContact CZ-OD1 2.67Å; R193-D195 IonicContact NE-OD1 3.35Å; D195-F199 WeakPolarHBondContact O-CD1 3.31Å; D195-F199 VanDerWaalsContact O-CE1 3.23Å; D195-F199 WeakPolarHBondContact O-CE1 3.48Å
196	P	89.5	Confident	83.1	Confident	83 Å²	83	75.7 Å²	75.7	54%	0.539	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	154.9	173	30.3	-33.4	0	0	0	111.3	T185	T185-P196 HydrophobicContact CG2-CB 4.1Å
197	Y	88.4	Confident	83.1	Confident	88 Å²	88	78.7 Å²	78.7	35%	0.345	40%	0.401	S	S	.	.	S	Bend	trans	-57.6	142.9	170	-179.9	-90	0	0	0	111.2	W184 F199 Q206	W184-Y197 PolarHBondContact O-N 3.24Å; Y197-F199 HydrophobicContact CD2-CD2 4.39Å; Y197-F199 HydrophobicContact CD2-CE2 4.42Å; Y197-Q206 HydrophobicContact CD1-CB 4.05Å; Y197-Q206 HydrophobicContact CD2-CB 3.81Å; Y197-Q206 HydrophobicContact CE1-CB 3.99Å; Y197-Q206 HydrophobicContact CE2-CB 3.79Å; Y197-Q206 VanDerWaalsContact CE2-N 3.31Å; Y197-Q206 HydrophobicContact CG-CB 3.97Å
198	P	83.6	Confident	83.4	Confident	70 Å²	70	80.5 Å²	80.5	46%	0.455	43%	0.426	S	S	.	.	P	Polyproline II helix	cis	-75.7	131.5	0.9	30	-32.2	0	0	0	112.1	W200	P198-W200 PolarHBondContact O-N 3.48Å; P198-W200 PolarHBondContact O-NE1 3.01Å
199	F	84.4	Confident	84.2	Confident	24 Å²	24	81.1 Å²	81.1	11%	0.105	43%	0.43	C	S	.	.			trans	-72.8	12.2	-177.8	-50	-53.1	0	0	0	114.5	W184 D195 Y197 D201 R204 L211 Y224	W184-F199 HydrophobicContact CB-CZ 4.08Å; D195-F199 WeakPolarHBondContact O-CD1 3.31Å; D195-F199 VanDerWaalsContact O-CE1 3.23Å; D195-F199 WeakPolarHBondContact O-CE1 3.48Å; Y197-F199 HydrophobicContact CD2-CD2 4.39Å; Y197-F199 HydrophobicContact CD2-CE2 4.42Å; F199-D201 VanDerWaalsContact C-N 3.27Å; F199-D201 PolarHBondContact O-N 2.81Å; F199-R204 VanDerWaalsContact CB-NH2 3.27Å; F199-R204 HydrophobicContact CD2-CB 4.07Å; F199-L211 HydrophobicContact CE2-CD1 3.8Å; F199-L211 HydrophobicContact CE2-CD2 3.87Å; F199-L211 HydrophobicContact CZ-CD2 4.32Å; F199-Y224 HydrophobicContact CE2-CE1 4.22Å; F199-Y224 HydrophobicContact CZ-CD1 4.49Å
200	W	78.8	Confident	85.3	Confident	242 Å²	242	80.8 Å²	80.8	92%	0.917	42%	0.423	S	S	*	.	S	Bend	trans	54.2	37	179.5	-54	-6.7	0	0	0	114	P198	P198-W200 PolarHBondContact O-N 3.48Å; P198-W200 PolarHBondContact O-NE1 3.01Å
201	D	81.3	Confident	86.4	Confident	33 Å²	33	76.2 Å²	76.2	18%	0.176	39%	0.386	C	S	.	.			trans	-136.3	156.7	170.5	75.4	74.5	0	0	0	111.1	F199 H203 R204	F199-D201 VanDerWaalsContact C-N 3.27Å; F199-D201 PolarHBondContact O-N 2.81Å; D201-H203 WeakPolarHBondContact OD1-CA 3.32Å; D201-H203 PolarHBondContact OD1-N 2.8Å; D201-R204 PolarHBondContact OD1-N 2.78Å; D201-R204 IonicContact OD1-NE 2.69Å; D201-R204 IonicContact OD2-CZ 3.88Å; D201-R204 IonicContact OD2-NE 2.97Å; D201-R204 PolarHBondContact OD2-NE 3.32Å; D201-R204 IonicContact OD2-NH2 2.87Å; D201-R204 PolarHBondContact OD2-NH2 2.81Å
202	N	83.4	Confident	87.7	Confident	155 Å²	155	76 Å²	76	83%	0.829	38%	0.378	S	S	*	.	S	Bend	trans	-91.1	0.2	-178.3	-62.2	-15	0	0	0	113.3
203	H	87.4	Confident	88.8	Confident	69 Å²	69	72.6 Å²	72.6	32%	0.319	35%	0.354	S	S	.	.	S	Bend	trans	-95.8	-13.9	-175.6	-66.8	61	0	0	0	111.6	D201 I213 Y214 Y220	D201-H203 WeakPolarHBondContact OD1-CA 3.32Å; D201-H203 PolarHBondContact OD1-N 2.8Å; H203-I213 CarbonylContact O-C 3.6Å; H203-Y214 PolarHBondContact O-N 2.91Å; H203-Y220 HydrophobicContact CB-CD2 4.44Å; H203-Y220 HydrophobicContact CB-CE2 3.43Å; H203-Y220 VanDerWaalsContact CB-CE2 3.43Å; H203-Y220 AromaticContact CG-CE2 3.91Å
204	R	92.1	Very high	89.4	Confident	17 Å²	17	70.1 Å²	70.1	6%	0.064	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	126.3	178.2	-59	-177.1	-67.8	179.7	-1.5	110.3	F199 D201 R212 I213 Y224	F199-R204 VanDerWaalsContact CB-NH2 3.27Å; F199-R204 HydrophobicContact CD2-CB 4.07Å; D201-R204 PolarHBondContact OD1-N 2.78Å; D201-R204 IonicContact OD1-NE 2.69Å; D201-R204 IonicContact OD2-CZ 3.88Å; D201-R204 IonicContact OD2-NE 2.97Å; D201-R204 PolarHBondContact OD2-NE 3.32Å; D201-R204 IonicContact OD2-NH2 2.87Å; D201-R204 PolarHBondContact OD2-NH2 2.81Å; R204-R212 CarbonylContact C-O 3.49Å; R204-R212 VanDerWaalsContact CA-O 3.31Å; R204-R212 WeakPolarHBondContact CA-O 3.3Å; R204-I213 HydrophobicContact CG-CG1 4.18Å; R204-I213 HydrophobicContact CG-CG2 4.44Å; R204-Y224 WeakPolarHBondContact CD-OH 3.33Å; R204-Y224 PolarHBondContact NH1-OH 3.08Å
205	E	93.5	Very high	89.9	Confident	78 Å²	78	71.4 Å²	71.4	36%	0.364	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	134.1	-179.1	-175.9	-179	-161.3	0	0	110.6	V207 R212 Y214	E205-V207 HydrophobicContact CG-CG2 4.04Å; E205-V207 PolarHBondContact O-N 2.97Å; E205-R212 PolarHBondContact N-O 3.38Å; E205-R212 PolarHBondContact O-N 3.09Å; E205-Y214 HydrophobicContact CB-CE2 3.76Å; E205-Y214 WeakPolarHBondContact OE2-CE2 3.34Å; E205-Y214 PolarHBondContact OE2-OH 3.41Å
206	Q	93.7	Very high	90.2	Very high	44 Å²	44	69.5 Å²	69.5	21%	0.206	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	113.8	169.5	-179.2	173.1	-27.8	0	0	109.5	V182 Y197 G208	V182-Q206 PolarHBondContact O-NE2 3.41Å; Y197-Q206 HydrophobicContact CD1-CB 4.05Å; Y197-Q206 HydrophobicContact CD2-CB 3.81Å; Y197-Q206 HydrophobicContact CE1-CB 3.99Å; Y197-Q206 HydrophobicContact CE2-CB 3.79Å; Y197-Q206 VanDerWaalsContact CE2-N 3.31Å; Y197-Q206 HydrophobicContact CG-CB 3.97Å; Q206-G208 WeakPolarHBondContact CG-O 2.95Å; Q206-G208 PolarHBondContact NE2-O 3.39Å
207	V	91.6	Very high	90.4	Very high	79 Å²	79	67.8 Å²	67.8	48%	0.479	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	96.7	177.4	-175.4	0	0	0	0	108.1	E205 T209 R210 R212	E205-V207 HydrophobicContact CG-CG2 4.04Å; E205-V207 PolarHBondContact O-N 2.97Å; V207-T209 PolarHBondContact O-N 2.73Å; V207-R210 PolarHBondContact N-O 2.88Å; V207-R210 PolarHBondContact O-N 3.34Å; V207-R212 HydrophobicContact CG2-CB 4.48Å
208	G	91.1	Very high	90.5	Very high	60 Å²	60	68.6 Å²	68.6	62%	0.619	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	-119.9	-173.6	0	0	0	0	0	111.8	Q206	Q206-G208 WeakPolarHBondContact CG-O 2.95Å; Q206-G208 PolarHBondContact NE2-O 3.39Å
209	T	93.6	Very high	90.8	Very high	45 Å²	45	69.6 Å²	69.6	28%	0.276	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-8.1	178.3	56.3	0	0	0	0	113.8	P180 V182 W184 V207	P180-T209 WeakPolarHBondContact O-CG2 3.15Å; V182-T209 HydrophobicContact CG2-CG2 3.87Å; W184-T209 PolarHBondContact NE1-O 2.77Å; V207-T209 PolarHBondContact O-N 2.73Å
210	R	95.1	Very high	91.1	Very high	128 Å²	128	69.8 Å²	69.8	48%	0.483	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	149.9	-174.4	-56.4	-174.3	-177.8	-172.1	-2.5	111.1	T163 T165 V207	T163-R210 HydrophobicContact CG2-CB 3.71Å; T163-R210 HydrophobicContact CG2-CG 4.35Å; T165-R210 HydrophobicContact CG2-CG 4.04Å; V207-R210 PolarHBondContact N-O 2.88Å; V207-R210 PolarHBondContact O-N 3.34Å
211	L	95.4	Very high	91.6	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	116.2	173.8	177.8	64.9	0	0	0	109.4	L164 W184 F199 Y224	L164-L211 HydrophobicContact CB-CB 4.36Å; L164-L211 HydrophobicContact CD1-CD2 4.25Å; L164-L211 PolarHBondContact N-O 3.47Å; L164-L211 PolarHBondContact O-N 3.16Å; W184-L211 HydrophobicContact CB-CD2 4.44Å; W184-L211 HydrophobicContact CD2-CB 3.68Å; W184-L211 HydrophobicContact CD2-CD2 3.95Å; W184-L211 HydrophobicContact CD2-CG 4.4Å; W184-L211 HydrophobicContact CE3-CB 4.13Å; W184-L211 HydrophobicContact CE3-CD2 3.78Å; W184-L211 HydrophobicContact CG-CB 4.04Å; W184-L211 HydrophobicContact CG-CD2 4.26Å; W184-L211 HydrophobicContact CH2-CB 4.33Å; W184-L211 HydrophobicContact CZ2-CB 3.92Å; W184-L211 HydrophobicContact CZ3-CB 4.43Å; W184-L211 HydrophobicContact CZ3-CD2 4.33Å; F199-L211 HydrophobicContact CE2-CD1 3.8Å; F199-L211 HydrophobicContact CE2-CD2 3.87Å; F199-L211 HydrophobicContact CZ-CD2 4.32Å; L211-Y224 HydrophobicContact CD2-CD1 3.49Å; L211-Y224 VanDerWaalsContact CD2-CD1 3.49Å; L211-Y224 HydrophobicContact CD2-CE1 3.8Å; L211-Y224 HydrophobicContact CD2-CG 4.47Å
212	R	95.2	Very high	92	Very high	116 Å²	116	59.3 Å²	59.3	44%	0.438	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	122.1	179.5	-171.7	168.1	-174.7	159.9	1.6	110	R204 E205 V207 Y214	R204-R212 CarbonylContact C-O 3.49Å; R204-R212 VanDerWaalsContact CA-O 3.31Å; R204-R212 WeakPolarHBondContact CA-O 3.3Å; E205-R212 PolarHBondContact N-O 3.38Å; E205-R212 PolarHBondContact O-N 3.09Å; V207-R212 HydrophobicContact CG2-CB 4.48Å; R212-Y214 HydrophobicContact CG-CD1 4.31Å; R212-Y214 HydrophobicContact CG-CE1 4.12Å; R212-Y214 VanDerWaalsContact NE-CE1 3.3Å
213	I	95.3	Very high	92.4	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	111.1	167	-56.3	178.7	0	0	0	105.8	I156 G161 K162 L164 H203 R204 M216 V245	I156-I213 HydrophobicContact CD1-CD1 3.71Å; G161-I213 CarbonylContact C-O 3.56Å; G161-I213 WeakPolarHBondContact CA-O 3.39Å; K162-I213 PolarHBondContact N-O 3.45Å; K162-I213 PolarHBondContact O-N 3.47Å; L164-I213 HydrophobicContact CD1-CD1 3.9Å; L164-I213 HydrophobicContact CG-CD1 4.44Å; H203-I213 CarbonylContact O-C 3.6Å; R204-I213 HydrophobicContact CG-CG1 4.18Å; R204-I213 HydrophobicContact CG-CG2 4.44Å; I213-M216 HydrophobicContact CG2-SD 4.36Å; I213-V245 HydrophobicContact CD1-CG1 4.36Å
214	Y	93.9	Very high	92.6	Very high	90 Å²	90	50.9 Å²	50.9	35%	0.353	26%	0.264	S	S	.	.	S	Bend	trans	-72.4	-44	-179.5	-73.5	-71.5	0	0	0	111.8	G161 H203 E205 R212	G161-Y214 WeakPolarHBondContact CA-O 3.32Å; G161-Y214 PolarHBondContact N-O 3.14Å; H203-Y214 PolarHBondContact O-N 2.91Å; E205-Y214 HydrophobicContact CB-CE2 3.76Å; E205-Y214 WeakPolarHBondContact OE2-CE2 3.34Å; E205-Y214 PolarHBondContact OE2-OH 3.41Å; R212-Y214 HydrophobicContact CG-CD1 4.31Å; R212-Y214 HydrophobicContact CG-CE1 4.12Å; R212-Y214 VanDerWaalsContact NE-CE1 3.3Å
215	T	94.1	Very high	92.6	Very high	38 Å²	38	50.2 Å²	50.2	23%	0.233	26%	0.261	C	S	.	.	S	Bend	trans	-142.5	113.7	-177.1	-57.7	0	0	0	0	108.5	L217	T215-L217 HydrophobicContact CG2-CD2 4.38Å
216	M	93.7	Very high	92.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.244	C	C	.	.			trans	-73.2	128.7	179.1	-174.3	63.2	-172	0	0	111.4	I156 G157 F158 Q159 Q160 I213 E221 V245	I156-M216 HydrophobicContact CB-CB 4.21Å; I156-M216 HydrophobicContact CB-CG 3.96Å; I156-M216 HydrophobicContact CB-SD 4.3Å; I156-M216 HydrophobicContact CD1-SD 4.19Å; I156-M216 HydrophobicContact CG2-CB 3.65Å; I156-M216 HydrophobicContact CG2-CG 3.99Å; G157-M216 WeakPolarHBondContact O-CB 3.4Å; F158-M216 HydrophobicContact CD1-CG 4.15Å; F158-M216 HydrophobicContact CE1-CG 4.48Å; Q159-M216 PolarHBondContact N-O 2.85Å; Q160-M216 WeakPolarHBondContact O-CB 3.31Å; Q160-M216 PolarHBondContact O-N 2.99Å; I213-M216 HydrophobicContact CG2-SD 4.36Å; M216-E221 HydrophobicContact CE-CB 4.26Å; M216-E221 HydrophobicContact CE-CG 3.44Å; M216-E221 VanDerWaalsContact CE-CG 3.44Å; M216-V245 HydrophobicContact CE-CG1 3.86Å; M216-V245 HydrophobicContact SD-CG1 4.18Å
217	L	92.5	Very high	92.6	Very high	47 Å²	47	45.2 Å²	45.2	25%	0.246	24%	0.239	C	C	.	.			trans	-129.9	157.3	176.6	-58.8	177.6	0	0	0	109.4	T215 P219 Y220	T215-L217 HydrophobicContact CG2-CD2 4.38Å; L217-P219 VanDerWaalsContact C-CD 3.44Å; L217-P219 VanDerWaalsContact C-N 3.34Å; L217-Y220 HydrophobicContact CB-CD2 3.76Å; L217-Y220 HydrophobicContact CB-CE2 3.78Å; L217-Y220 HydrophobicContact CB-CG 4.39Å; L217-Y220 HydrophobicContact CD1-CD2 4.46Å; L217-Y220 HydrophobicContact CD1-CE2 3.63Å; L217-Y220 HydrophobicContact CG-CD2 4.15Å; L217-Y220 HydrophobicContact CG-CE2 3.75Å; L217-Y220 WeakPolarHBondContact O-CB 3.47Å; L217-Y220 PolarHBondContact O-N 2.95Å
218	I	90.4	Very high	92.7	Very high	104 Å²	104	41.4 Å²	41.4	53%	0.533	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-51.3	-43.9	-179.8	-58.7	169.2	0	0	0	112.7	F158 Y220 E221	F158-I218 HydrophobicContact CE1-CG1 3.8Å; F158-I218 HydrophobicContact CZ-CG1 3.91Å; I218-Y220 PolarHBondContact O-N 3.37Å; I218-E221 WeakPolarHBondContact O-CB 3.23Å; I218-E221 WeakPolarHBondContact O-CG 3.32Å; I218-E221 PolarHBondContact O-N 3.49Å; I218-E221 VanDerWaalsContact O-N 3.16Å
219	P	89.4	Confident	92.7	Very high	92 Å²	92	43.5 Å²	43.5	60%	0.597	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-66.6	-11.2	179.8	-21.2	34.6	0	0	0	115.2	Y186 L217	Y186-P219 PolarHBondContact OH-O 2.88Å; L217-P219 VanDerWaalsContact C-CD 3.44Å; L217-P219 VanDerWaalsContact C-N 3.34Å
220	Y	90.6	Very high	92.7	Very high	27 Å²	27	41.6 Å²	41.6	11%	0.106	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-95	-3.7	-179.5	-53.5	-27	0	0	0	112.6	H203 L217 I218 Y224	H203-Y220 HydrophobicContact CB-CD2 4.44Å; H203-Y220 HydrophobicContact CB-CE2 3.43Å; H203-Y220 VanDerWaalsContact CB-CE2 3.43Å; H203-Y220 AromaticContact CG-CE2 3.91Å; L217-Y220 HydrophobicContact CB-CD2 3.76Å; L217-Y220 HydrophobicContact CB-CE2 3.78Å; L217-Y220 HydrophobicContact CB-CG 4.39Å; L217-Y220 HydrophobicContact CD1-CD2 4.46Å; L217-Y220 HydrophobicContact CD1-CE2 3.63Å; L217-Y220 HydrophobicContact CG-CD2 4.15Å; L217-Y220 HydrophobicContact CG-CE2 3.75Å; L217-Y220 WeakPolarHBondContact O-CB 3.47Å; L217-Y220 PolarHBondContact O-N 2.95Å; I218-Y220 PolarHBondContact O-N 3.37Å; Y220-Y224 VanDerWaalsContact O-CE2 3.29Å; Y220-Y224 WeakPolarHBondContact O-CE2 3.26Å; Y220-Y224 PolarHBondContact O-OH 3.19Å
221	E	91.1	Very high	92.4	Very high	50 Å²	50	39.1 Å²	39.1	23%	0.234	19%	0.187	C	C	.	.			trans	-66.6	138.4	167.9	-63.6	-173.5	144.1	0	0	110.5	F158 Y186 M216 I218 G247 H322	F158-E221 WeakPolarHBondContact CZ-OE1 3.45Å; Y186-E221 PolarHBondContact OH-O 3.11Å; M216-E221 HydrophobicContact CE-CB 4.26Å; M216-E221 HydrophobicContact CE-CG 3.44Å; M216-E221 VanDerWaalsContact CE-CG 3.44Å; I218-E221 WeakPolarHBondContact O-CB 3.23Å; I218-E221 WeakPolarHBondContact O-CG 3.32Å; I218-E221 PolarHBondContact O-N 3.49Å; I218-E221 VanDerWaalsContact O-N 3.16Å; E221-G247 WeakPolarHBondContact OE1-CA 3.33Å; E221-G247 PolarHBondContact OE1-N 2.96Å; E221-H322 IonicContact OE1-CD2 3.87Å; E221-H322 PolarHBondContact OE1-CD2 3.33Å
222	G	89.5	Confident	92	Very high	5 Å²	5	40.3 Å²	40.3	5%	0.052	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.9	-162.4	177.4	0	0	0	0	0	113.4	V245	G222-V245 PolarHBondContact N-O 3.01Å; G222-V245 PolarHBondContact O-N 3.23Å
223	L	90.8	Very high	91.3	Very high	47 Å²	47	41.9 Å²	41.9	25%	0.246	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	119.3	-176	-166.5	73.3	0	0	0	109.9	A151 M187 I225 K244	A151-L223 HydrophobicContact CB-CD1 3.6Å; M187-L223 HydrophobicContact CB-CB 3.92Å; M187-L223 WeakPolarHBondContact CB-O 3.45Å; M187-L223 PolarHBondContact N-O 3.45Å; L223-I225 HydrophobicContact CD2-CD1 4.36Å; L223-I225 HydrophobicContact CD2-CG1 4.32Å; L223-I225 HydrophobicContact CG-CG1 4.35Å; L223-K244 HydrophobicContact CD1-CB 4.31Å
224	Y	92.1	Very high	90.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128.8	173.1	-69.2	-101.1	0	0	0	108.4	T185 Y186 F199 R204 L211 Y220 S242 I243 V245	T185-Y224 WeakPolarHBondContact O-CA 3.48Å; Y186-Y224 HydrophobicContact CD2-CD1 4.06Å; Y186-Y224 HydrophobicContact CD2-CD2 4.08Å; Y186-Y224 AromaticContact CD2-CE1 3.71Å; Y186-Y224 HydrophobicContact CD2-CE1 3.71Å; Y186-Y224 AromaticContact CD2-CE2 3.71Å; Y186-Y224 HydrophobicContact CD2-CE2 3.71Å; Y186-Y224 HydrophobicContact CD2-CG 4.25Å; Y186-Y224 AromaticContact CD2-CZ 3.53Å; Y186-Y224 HydrophobicContact CE2-CD2 4.49Å; Y186-Y224 HydrophobicContact CE2-CE1 4.49Å; Y186-Y224 AromaticContact CE2-CE2 3.85Å; Y186-Y224 HydrophobicContact CE2-CE2 3.85Å; Y186-Y224 AromaticContact CE2-CZ 3.87Å; Y186-Y224 HydrophobicContact CG-CE1 4.23Å; F199-Y224 HydrophobicContact CE2-CE1 4.22Å; F199-Y224 HydrophobicContact CZ-CD1 4.49Å; R204-Y224 WeakPolarHBondContact CD-OH 3.33Å; R204-Y224 PolarHBondContact NH1-OH 3.08Å; L211-Y224 HydrophobicContact CD2-CD1 3.49Å; L211-Y224 VanDerWaalsContact CD2-CD1 3.49Å; L211-Y224 HydrophobicContact CD2-CE1 3.8Å; L211-Y224 HydrophobicContact CD2-CG 4.47Å; Y220-Y224 VanDerWaalsContact O-CE2 3.29Å; Y220-Y224 WeakPolarHBondContact O-CE2 3.26Å; Y220-Y224 PolarHBondContact O-OH 3.19Å; Y224-S242 CarbonylContact O-C 3.54Å; Y224-S242 WeakPolarHBondContact O-CA 3.4Å; Y224-I243 PolarHBondContact N-O 3Å; Y224-I243 PolarHBondContact O-N 3.09Å; Y224-V245 HydrophobicContact CD2-CB 3.82Å; Y224-V245 HydrophobicContact CD2-CG2 3.37Å; Y224-V245 HydrophobicContact CE2-CB 3.72Å; Y224-V245 HydrophobicContact CE2-CG1 4.34Å; Y224-V245 HydrophobicContact CE2-CG2 3.66Å; Y224-V245 HydrophobicContact CG-CG2 4.25Å
225	I	92.1	Very high	89.9	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	130.9	-179	-58.8	166.1	0	0	0	107.4	P145 V147 W184 T185 L223 T240 R241	P145-I225 HydrophobicContact CB-CG2 4.03Å; P145-I225 HydrophobicContact CG-CG2 4.16Å; V147-I225 HydrophobicContact CG2-CD1 4.16Å; V147-I225 HydrophobicContact CG2-CG1 4.16Å; V147-I225 HydrophobicContact CG2-CG2 3.81Å; W184-I225 WeakPolarHBondContact CA-O 3.47Å; T185-I225 PolarHBondContact N-O 3.37Å; T185-I225 PolarHBondContact O-N 2.88Å; T185-I225 WeakPolarHBondContact OG1-CB 3.36Å; T185-I225 PolarHBondContact OG1-O 2.86Å; L223-I225 HydrophobicContact CD2-CD1 4.36Å; L223-I225 HydrophobicContact CD2-CG1 4.32Å; L223-I225 HydrophobicContact CG-CG1 4.35Å; I225-T240 HydrophobicContact CG2-CG2 3.33Å; I225-R241 CarbonylContact C-O 3.56Å; I225-R241 WeakPolarHBondContact CA-O 3.4Å
226	C	93.6	Very high	89.6	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.6	176.1	54	0	0	0	0	109.7	C166 V182 N183 W184 T240 R241	C166-C226 VanDerWaalsContact CA-SG 3.5Å; C166-C226 HydrophobicContact CB-CB 3.71Å; C166-C226 WeakPolarHBondContact CB-SG 3.47Å; C166-C226 WeakPolarHBondContact SG-CB 3.14Å; C166-C226 CovalentContact SG-SG 2.04Å; C166-C226 PolarHBondContact SG-SG 2.8Å; V182-C226 HydrophobicContact CG1-CB 3.9Å; N183-C226 WeakPolarHBondContact O-CA 3.19Å; W184-C226 HydrophobicContact CD2-CB 3.96Å; W184-C226 HydrophobicContact CE3-CB 3.8Å; W184-C226 HydrophobicContact CH2-CB 3.96Å; W184-C226 HydrophobicContact CZ2-CB 4.1Å; W184-C226 HydrophobicContact CZ3-CB 3.8Å; C226-T240 WeakPolarHBondContact O-CA 3.06Å; C226-R241 PolarHBondContact N-O 2.91Å; C226-R241 PolarHBondContact O-N 3.5Å
227	T	92.7	Very high	89.5	Confident	16 Å²	16	45.8 Å²	45.8	10%	0.098	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	114.6	172.9	-58.1	0	0	0	0	108.6	V182 N183	V182-T227 WeakPolarHBondContact CA-O 3.49Å; N183-T227 PolarHBondContact N-O 3.01Å; N183-T227 PolarHBondContact O-N 3.31Å
228	V	93.7	Very high	89.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	132.7	178.9	-174.6	0	0	0	0	108.9	C166 L169 P180 T181 V182 S238 F239	C166-V228 HydrophobicContact CB-CG2 4.2Å; C166-V228 WeakPolarHBondContact SG-CG2 3.32Å; L169-V228 HydrophobicContact CD1-CG1 3.61Å; L169-V228 HydrophobicContact CD1-CG2 4.08Å; P180-V228 HydrophobicContact CB-CG1 4.04Å; T181-V228 CarbonylContact O-C 3.48Å; T181-V228 WeakPolarHBondContact O-CA 3.45Å; V182-V228 HydrophobicContact CG2-CG1 4.48Å; V182-V228 HydrophobicContact CG2-CG2 4.16Å; V228-S238 CarbonylContact O-C 3.58Å; V228-S238 WeakPolarHBondContact O-CA 2.95Å; V228-S238 VanDerWaalsContact O-CB 3.31Å; V228-S238 WeakPolarHBondContact O-CB 3.21Å; V228-F239 HydrophobicContact CB-CD1 4.17Å; V228-F239 HydrophobicContact CB-CD2 4.38Å; V228-F239 HydrophobicContact CB-CE1 3.7Å; V228-F239 HydrophobicContact CB-CE2 3.95Å; V228-F239 HydrophobicContact CB-CZ 3.58Å; V228-F239 HydrophobicContact CG1-CE1 3.77Å; V228-F239 HydrophobicContact CG1-CZ 3.81Å; V228-F239 HydrophobicContact CG2-CD2 4.36Å; V228-F239 HydrophobicContact CG2-CE1 4.27Å; V228-F239 HydrophobicContact CG2-CE2 3.67Å; V228-F239 HydrophobicContact CG2-CZ 3.62Å; V228-F239 PolarHBondContact N-O 3.4Å; V228-F239 PolarHBondContact O-N 2.9Å; V228-F239 VanDerWaalsContact O-N 3.07Å
229	R	92.8	Very high	89.5	Confident	104 Å²	104	40.5 Å²	40.5	39%	0.392	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	134.4	171.6	-56.4	-172.8	179.4	87.2	0.9	110.4	P180 T181 N183 L237	P180-R229 CarbonylContact C-O 3.58Å; P180-R229 WeakPolarHBondContact CA-O 3.21Å; T181-R229 PolarHBondContact N-O 3.33Å; T181-R229 PolarHBondContact O-N 3.03Å; T181-R229 PolarHBondContact OG1-O 3.28Å; N183-R229 PolarHBondContact ND2-NH1 2.99Å; R229-L237 WeakPolarHBondContact CA-O 3.28Å
230	Y	91.9	Very high	89.6	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.016	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	156	-179.2	66.2	-80	0	0	0	110.9	A46 Q103 A172 A176 R232 L237 F239	A46-Y230 HydrophobicContact CB-CE1 4.31Å; A46-Y230 WeakPolarHBondContact CB-OH 3.12Å; Q103-Y230 PolarHBondContact NE2-OH 3.2Å; A172-Y230 HydrophobicContact CB-CD1 4.41Å; A172-Y230 HydrophobicContact CB-CE1 4.47Å; A176-Y230 HydrophobicContact CB-CD2 3.88Å; A176-Y230 HydrophobicContact CB-CG 4.28Å; Y230-R232 HydrophobicContact CD2-CB 4.33Å; Y230-R232 HydrophobicContact CE2-CB 4.14Å; Y230-L237 HydrophobicContact CD1-CB 4.33Å; Y230-L237 HydrophobicContact CD2-CB 4.49Å; Y230-L237 HydrophobicContact CE1-CB 3.81Å; Y230-L237 HydrophobicContact CE2-CB 4.01Å; Y230-L237 HydrophobicContact CE2-CD1 3.8Å; Y230-L237 PolarHBondContact N-O 3.44Å; Y230-L237 PolarHBondContact O-N 3.13Å; Y230-F239 HydrophobicContact CD1-CD1 4.46Å; Y230-F239 HydrophobicContact CD1-CE1 4.25Å; Y230-F239 AromaticContact CE1-CD1 3.84Å; Y230-F239 HydrophobicContact CE1-CD1 3.84Å; Y230-F239 AromaticContact CE1-CE1 3.89Å; Y230-F239 HydrophobicContact CE1-CE1 3.89Å
231	Q	90.4	Very high	89.6	Confident	76 Å²	76	36.4 Å²	36.4	36%	0.355	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	136.7	175.8	-64.5	-64.6	-24.9	0	0	109.8	A176 D177 G235 S236	A176-Q231 CarbonylContact C-O 3.55Å; A176-Q231 WeakPolarHBondContact CA-O 3.41Å; D177-Q231 PolarHBondContact N-O 3.46Å; Q231-G235 PolarHBondContact OE1-O 3.01Å; Q231-S236 PolarHBondContact NE2-OG 3.34Å
232	R	85.6	Confident	89.6	Confident	26 Å²	26	34.4 Å²	34.4	10%	0.098	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	127.5	171.7	-166.5	179.1	-164.9	-168.9	10.9	109.7	E96 M175 D177 Y230 G234 G235 L237	E96-R232 IonicContact OE2-CZ 2.62Å; E96-R232 IonicContact OE2-NH1 3.59Å; E96-R232 IonicContact OE2-NH2 3.11Å; E96-R232 PolarHBondContact OE2-NH2 2.42Å; M175-R232 PolarHBondContact O-NE 3.36Å; D177-R232 WeakPolarHBondContact OD2-CA 3.19Å; Y230-R232 HydrophobicContact CD2-CB 4.33Å; Y230-R232 HydrophobicContact CE2-CB 4.14Å; R232-G234 PolarHBondContact O-N 2.83Å; R232-G235 PolarHBondContact N-O 3.14Å; R232-G235 PolarHBondContact O-N 3.31Å; R232-L237 HydrophobicContact CB-CD1 4.02Å
233	R	81.5	Confident	89.8	Confident	148 Å²	148	34.3 Å²	34.3	56%	0.558	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	38.7	177.6	-61.5	169.9	-179.5	175.3	-2	113.1	A91 D177 G235	A91-R233 PolarHBondContact O-NH1 3.24Å; D177-R233 PolarHBondContact OD2-N 2.84Å; R233-G235 VanDerWaalsContact C-N 3.26Å; R233-G235 PolarHBondContact O-N 2.67Å
234	G	76.8	Confident	89.9	Confident	77 Å²	77	37 Å²	37	79%	0.794	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.1	6.2	-179.1	0	0	0	0	0	115.5	R232	R232-G234 PolarHBondContact O-N 2.83Å
235	G	82.9	Confident	90	Very high	32 Å²	32	37 Å²	37	33%	0.33	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	141.1	174.1	0	0	0	0	0	112.7	Q231 R232 R233	Q231-G235 PolarHBondContact OE1-O 3.01Å; R232-G235 PolarHBondContact N-O 3.14Å; R232-G235 PolarHBondContact O-N 3.31Å; R233-G235 VanDerWaalsContact C-N 3.26Å; R233-G235 PolarHBondContact O-N 2.67Å
236	S	88.7	Confident	90.1	Very high	82 Å²	82	37.5 Å²	37.5	57%	0.573	21%	0.208	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	119.4	173.7	-172.6	0	0	0	0	110.2	Q231	Q231-S236 PolarHBondContact NE2-OG 3.34Å
237	L	91.1	Very high	90.1	Very high	20 Å²	20	37.6 Å²	37.6	11%	0.105	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	154.1	178.5	-65.5	169.2	0	0	0	110.7	Q103 R229 Y230 R232	Q103-L237 HydrophobicContact CB-CD1 3.71Å; Q103-L237 HydrophobicContact CB-CD2 4.14Å; Q103-L237 HydrophobicContact CG-CD1 3.85Å; R229-L237 WeakPolarHBondContact CA-O 3.28Å; Y230-L237 HydrophobicContact CD1-CB 4.33Å; Y230-L237 HydrophobicContact CD2-CB 4.49Å; Y230-L237 HydrophobicContact CE1-CB 3.81Å; Y230-L237 HydrophobicContact CE2-CB 4.01Å; Y230-L237 HydrophobicContact CE2-CD1 3.8Å; Y230-L237 PolarHBondContact N-O 3.44Å; Y230-L237 PolarHBondContact O-N 3.13Å; R232-L237 HydrophobicContact CB-CD1 4.02Å
238	S	92	Very high	90.2	Very high	37 Å²	37	37 Å²	37	26%	0.259	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	154	175.9	60.7	0	0	0	0	112.5	E45 A46 V228	E45-S238 CarbonylContact C-O 3.59Å; E45-S238 VanDerWaalsContact CA-O 3.25Å; E45-S238 WeakPolarHBondContact CA-O 3.17Å; E45-S238 WeakPolarHBondContact CB-O 3.36Å; A46-S238 PolarHBondContact N-O 2.92Å; V228-S238 CarbonylContact O-C 3.58Å; V228-S238 WeakPolarHBondContact O-CA 2.95Å; V228-S238 VanDerWaalsContact O-CB 3.31Å; V228-S238 WeakPolarHBondContact O-CB 3.21Å
239	F	91.1	Very high	90.1	Very high	3 Å²	3	40.7 Å²	40.7	1%	0.013	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	154.9	167.1	63.9	-89.1	0	0	0	110.5	E45 A172 V228 Y230 R241	E45-F239 WeakPolarHBondContact OE2-CA 3.38Å; A172-F239 HydrophobicContact CB-CE1 3.59Å; A172-F239 HydrophobicContact CB-CZ 3.89Å; V228-F239 HydrophobicContact CB-CD1 4.17Å; V228-F239 HydrophobicContact CB-CD2 4.38Å; V228-F239 HydrophobicContact CB-CE1 3.7Å; V228-F239 HydrophobicContact CB-CE2 3.95Å; V228-F239 HydrophobicContact CB-CZ 3.58Å; V228-F239 HydrophobicContact CG1-CE1 3.77Å; V228-F239 HydrophobicContact CG1-CZ 3.81Å; V228-F239 HydrophobicContact CG2-CD2 4.36Å; V228-F239 HydrophobicContact CG2-CE1 4.27Å; V228-F239 HydrophobicContact CG2-CE2 3.67Å; V228-F239 HydrophobicContact CG2-CZ 3.62Å; V228-F239 PolarHBondContact N-O 3.4Å; V228-F239 PolarHBondContact O-N 2.9Å; V228-F239 VanDerWaalsContact O-N 3.07Å; Y230-F239 HydrophobicContact CD1-CD1 4.46Å; Y230-F239 HydrophobicContact CD1-CE1 4.25Å; Y230-F239 AromaticContact CE1-CD1 3.84Å; Y230-F239 HydrophobicContact CE1-CD1 3.84Å; Y230-F239 AromaticContact CE1-CE1 3.89Å; Y230-F239 HydrophobicContact CE1-CE1 3.89Å; F239-R241 HydrophobicContact CD2-CG 3.9Å; F239-R241 HydrophobicContact CE2-CG 3.96Å
240	T	90.8	Very high	90.1	Very high	9 Å²	9	36.7 Å²	36.7	6%	0.055	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	136	-178	-53.5	0	0	0	0	111.1	E45 P145 V147 I225 C226	E45-T240 WeakPolarHBondContact OE1-CB 3.29Å; E45-T240 PolarHBondContact OE1-N 3.43Å; E45-T240 PolarHBondContact OE1-OG1 2.97Å; E45-T240 PolarHBondContact OE2-N 2.83Å; P145-T240 HydrophobicContact CB-CG2 4.12Å; V147-T240 HydrophobicContact CG2-CG2 3.84Å; I225-T240 HydrophobicContact CG2-CG2 3.33Å; C226-T240 WeakPolarHBondContact O-CA 3.06Å
241	R	90.7	Very high	90	Very high	25 Å²	25	40.1 Å²	40.1	9%	0.094	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	154.1	175.9	-60.2	-63.6	179.1	142.8	-14.9	110.8	M149 P167 N168 I225 C226 F239	M149-R241 VanDerWaalsContact CE-NH1 3.33Å; M149-R241 PolarHBondContact SD-NH1 3.37Å; M149-R241 PolarHBondContact SD-NH2 3.16Å; P167-R241 HydrophobicContact CB-CB 4.33Å; P167-R241 HydrophobicContact CB-CG 4.19Å; P167-R241 HydrophobicContact CG-CB 4.16Å; N168-R241 PolarHBondContact ND2-NH1 3.15Å; N168-R241 PolarHBondContact ND2-NH2 2.82Å; I225-R241 CarbonylContact C-O 3.56Å; I225-R241 WeakPolarHBondContact CA-O 3.4Å; C226-R241 PolarHBondContact N-O 2.91Å; C226-R241 PolarHBondContact O-N 3.5Å; F239-R241 HydrophobicContact CD2-CG 3.9Å; F239-R241 HydrophobicContact CE2-CG 3.96Å
242	S	90.4	Very high	89.9	Confident	8 Å²	8	42.2 Å²	42.2	6%	0.056	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	144.8	175.8	62.3	0	0	0	0	111.3	A151 T152 Y224	A151-S242 WeakPolarHBondContact CA-O 3.13Å; A151-S242 VanDerWaalsContact CA-OG 3.28Å; A151-S242 WeakPolarHBondContact CA-OG 3.46Å; A151-S242 WeakPolarHBondContact CB-OG 3.06Å; T152-S242 PolarHBondContact N-O 3.44Å; T152-S242 PolarHBondContact OG1-O 3.31Å; Y224-S242 CarbonylContact O-C 3.54Å; Y224-S242 WeakPolarHBondContact O-CA 3.4Å
243	I	93.6	Very high	90.1	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	120.3	179.4	-51.5	-178.2	0	0	0	107.3	T152 E154 L164 P167 W184 Y224 V245	T152-I243 CarbonylContact O-C 3.49Å; T152-I243 VanDerWaalsContact O-CA 3.25Å; T152-I243 WeakPolarHBondContact O-CA 3.31Å; T152-I243 WeakPolarHBondContact O-CG2 3.26Å; E154-I243 HydrophobicContact CB-CG2 3.83Å; E154-I243 HydrophobicContact CG-CG2 3.47Å; E154-I243 VanDerWaalsContact CG-CG2 3.47Å; L164-I243 HydrophobicContact CB-CD1 4.45Å; P167-I243 HydrophobicContact CG-CD1 4.47Å; P167-I243 HydrophobicContact CG-CG1 4.19Å; W184-I243 HydrophobicContact CH2-CD1 3.62Å; W184-I243 HydrophobicContact CZ3-CD1 3.78Å; Y224-I243 PolarHBondContact N-O 3Å; Y224-I243 PolarHBondContact O-N 3.09Å; I243-V245 HydrophobicContact CG2-CG2 4.13Å; I243-V245 PolarHBondContact O-N 3.44Å
244	K	93.3	Very high	90.5	Very high	103 Å²	103	42.4 Å²	42.4	45%	0.448	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	104.8	173	-176.9	-176.9	176.9	-173.4	0	108.4	A151 T152 E153 E154 L223	A151-K244 HydrophobicContact CB-CB 4.04Å; T152-K244 PolarHBondContact O-N 3.11Å; E153-K244 WeakPolarHBondContact CA-O 3.43Å; E154-K244 PolarHBondContact N-O 3.3Å; L223-K244 HydrophobicContact CD1-CB 4.31Å
245	V	94	Very high	91.2	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	120.6	176.5	178	0	0	0	0	108.7	E154 I156 L164 I213 M216 G222 Y224 I243	E154-V245 HydrophobicContact CB-CG2 4.46Å; E154-V245 WeakPolarHBondContact O-CA 3.22Å; I156-V245 HydrophobicContact CD1-CG1 3.57Å; I156-V245 HydrophobicContact CG1-CG1 4.15Å; L164-V245 HydrophobicContact CD1-CG2 3.71Å; L164-V245 HydrophobicContact CD2-CG2 4.4Å; I213-V245 HydrophobicContact CD1-CG1 4.36Å; M216-V245 HydrophobicContact CE-CG1 3.86Å; M216-V245 HydrophobicContact SD-CG1 4.18Å; G222-V245 PolarHBondContact N-O 3.01Å; G222-V245 PolarHBondContact O-N 3.23Å; Y224-V245 HydrophobicContact CD2-CB 3.82Å; Y224-V245 HydrophobicContact CD2-CG2 3.37Å; Y224-V245 HydrophobicContact CE2-CB 3.72Å; Y224-V245 HydrophobicContact CE2-CG1 4.34Å; Y224-V245 HydrophobicContact CE2-CG2 3.66Å; Y224-V245 HydrophobicContact CG-CG2 4.25Å; I243-V245 HydrophobicContact CG2-CG2 4.13Å; I243-V245 PolarHBondContact O-N 3.44Å
246	S	93.8	Very high	91.7	Very high	15 Å²	15	42.2 Å²	42.2	11%	0.105	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	137.2	175	-48.4	0	0	0	0	110.2	E154 L155 I156	E154-S246 PolarHBondContact O-N 3.11Å; L155-S246 WeakPolarHBondContact CA-O 3.49Å; I156-S246 PolarHBondContact N-O 3.29Å; I156-S246 VanDerWaalsContact N-O 3.09Å
247	G	93.8	Very high	92.1	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	143.6	173.2	0	0	0	0	0	110.8	I156 E221	I156-G247 CarbonylContact O-C 3.55Å; I156-G247 WeakPolarHBondContact O-CA 3.47Å; E221-G247 WeakPolarHBondContact OE1-CA 3.33Å; E221-G247 PolarHBondContact OE1-N 2.96Å
248	I	95.1	Very high	92.3	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.026	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	159.6	170.1	61.4	173	0	0	0	109.3	L155 I156 G157 F158 T251 F286 I288 R323	L155-I248 HydrophobicContact CB-CD1 4.34Å; L155-I248 HydrophobicContact CB-CG2 4.4Å; L155-I248 HydrophobicContact CD2-CG2 4.22Å; I156-I248 PolarHBondContact O-N 3.33Å; G157-I248 CarbonylContact C-O 3.58Å; G157-I248 VanDerWaalsContact CA-O 3.29Å; G157-I248 WeakPolarHBondContact CA-O 3.31Å; F158-I248 VanDerWaalsContact CD2-O 3.23Å; F158-I248 WeakPolarHBondContact CD2-O 3.12Å; F158-I248 PolarHBondContact N-O 3.19Å; I248-T251 HydrophobicContact CD1-CG2 4.34Å; I248-F286 HydrophobicContact CG2-CD1 4.33Å; I248-I288 HydrophobicContact CD1-CD1 3.97Å; I248-I288 HydrophobicContact CD1-CG1 4.14Å; I248-R323 HydrophobicContact CG2-CB 4.04Å; I248-R323 HydrophobicContact CG2-CG 3.72Å
249	Y	92.9	Very high	92.6	Very high	77 Å²	77	38.5 Å²	38.5	30%	0.302	21%	0.212	S	C	.	.	S	Bend	trans	-57.8	140.4	170.7	-80.2	-82.4	0	0	0	111.2	T251 K255 D321 H322 D324	Y249-T251 PolarHBondContact O-N 2.78Å; Y249-K255 PolarHBondContact O-NZ 3.34Å; Y249-D321 VanDerWaalsContact CE2-O 3.32Å; Y249-D321 WeakPolarHBondContact CE2-O 3.42Å; Y249-D321 PolarHBondContact OH-OD1 2.95Å; Y249-D321 PolarHBondContact OH-OD2 3.2Å; Y249-H322 HydrophobicContact CD2-CB 4.42Å; Y249-H322 HydrophobicContact CE2-CB 4.33Å; Y249-D324 HydrophobicContact CD2-CB 3.83Å; Y249-D324 WeakPolarHBondContact CD2-OD2 3.46Å; Y249-D324 HydrophobicContact CE2-CB 4.18Å
250	P	92.6	Very high	92.8	Very high	20 Å²	20	44 Å²	44	13%	0.13	24%	0.24	C	C	.	.			trans	-48.4	137	-172.4	-18.9	18.6	0	0	0	112.8	F158 T252 L253 K255	F158-P250 WeakPolarHBondContact O-CG 3.26Å; P250-T252 PolarHBondContact O-N 2.96Å; P250-L253 HydrophobicContact CB-CD1 4.28Å; P250-L253 HydrophobicContact CB-CG 4.19Å; P250-L253 HydrophobicContact CG-CD1 3.87Å; P250-L253 HydrophobicContact CG-CG 4.27Å; P250-L253 PolarHBondContact O-N 3.43Å; P250-K255 WeakPolarHBondContact O-CE 3.33Å
251	T	88.6	Confident	92.9	Very high	76 Å²	76	46.2 Å²	46.2	47%	0.466	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-14.1	178.5	56.3	0	0	0	0	113.1	Q160 I248 Y249	Q160-T251 PolarHBondContact NE2-OG1 2.83Å; Q160-T251 PolarHBondContact OE1-OG1 2.78Å; Q160-T251 VanDerWaalsContact OE1-OG1 3.13Å; I248-T251 HydrophobicContact CD1-CG2 4.34Å; Y249-T251 PolarHBondContact O-N 2.78Å
252	T	88.1	Confident	93.2	Very high	119 Å²	119	45 Å²	45	73%	0.73	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-17.7	175.6	48.5	0	0	0	0	113.7	P250	P250-T252 PolarHBondContact O-N 2.96Å
253	L	89.6	Confident	93.3	Very high	97 Å²	97	48.8 Å²	48.8	51%	0.508	27%	0.268	S	S	.	.	S	Bend	trans	-76.3	156	175.7	-66.9	174.7	0	0	0	110.8	P250 K255	P250-L253 HydrophobicContact CB-CD1 4.28Å; P250-L253 HydrophobicContact CB-CG 4.19Å; P250-L253 HydrophobicContact CG-CD1 3.87Å; P250-L253 HydrophobicContact CG-CG 4.27Å; P250-L253 PolarHBondContact O-N 3.43Å; L253-K255 PolarHBondContact O-N 3.32Å
254	S	90.2	Very high	93.3	Very high	81 Å²	81	53.4 Å²	53.4	57%	0.566	29%	0.293	S	S	*	.			trans	-56.7	133.6	171.7	165.1	0	0	0	0	109.5	D256	S254-D256 WeakPolarHBondContact OG-CB 3.38Å; S254-D256 PolarHBondContact OG-N 2.88Å; S254-D256 PolarHBondContact OG-OD2 3.4Å
255	K	92.8	Very high	93.3	Very high	24 Å²	24	49.6 Å²	49.6	10%	0.104	28%	0.283	C	S	.	.			trans	-107.8	24	175.7	-61.7	-62	-175.9	174.5	0	111	Y249 P250 L253 P285 I287 D324 N351 R353	Y249-K255 PolarHBondContact O-NZ 3.34Å; P250-K255 WeakPolarHBondContact O-CE 3.33Å; L253-K255 PolarHBondContact O-N 3.32Å; K255-P285 HydrophobicContact CB-CB 4.15Å; K255-P285 HydrophobicContact CD-CB 3.6Å; K255-I287 HydrophobicContact CB-CG1 4.33Å; K255-D324 IonicContact NZ-OD1 3.87Å; K255-N351 PolarHBondContact O-ND2 3.46Å; K255-R353 HydrophobicContact CB-CG 4.14Å
256	D	93.8	Very high	93.2	Very high	82 Å²	82	52.8 Å²	52.8	44%	0.439	30%	0.296	S	S	.	.			trans	-79.2	136	175.2	-59.8	-61.8	0	0	0	109.8	S254	S254-D256 WeakPolarHBondContact OG-CB 3.38Å; S254-D256 PolarHBondContact OG-N 2.88Å; S254-D256 PolarHBondContact OG-OD2 3.4Å
257	P	96.4	Very high	93.2	Very high	5 Å²	5	55.3 Å²	55.3	3%	0.032	31%	0.311	C	S	.	.			trans	-73.4	141.5	179.2	32.7	-32.3	0	0	0	109.3	L283 V349 N351 G354	P257-L283 WeakPolarHBondContact CA-O 3.49Å; P257-V349 HydrophobicContact CB-CB 4.22Å; P257-V349 HydrophobicContact CB-CG2 3.81Å; P257-V349 HydrophobicContact CG-CG2 4.29Å; P257-N351 WeakPolarHBondContact CD-OD1 3.27Å; P257-G354 WeakPolarHBondContact CG-O 3.48Å
258	T	95.6	Very high	93.1	Very high	53 Å²	53	56.7 Å²	56.7	33%	0.325	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	143	-174.5	54	0	0	0	0	111.9	G282 L283	T258-G282 CarbonylContact O-C 3.6Å; T258-G282 WeakPolarHBondContact O-CA 3.29Å; T258-L283 PolarHBondContact N-O 2.96Å; T258-L283 PolarHBondContact O-N 3.43Å
259	I	96.9	Very high	92.9	Very high	3 Å²	3	60.9 Å²	60.9	2%	0.015	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	118.1	173.5	-59.6	175.4	0	0	0	108.1	H261 C347 V349 M356 R358	I259-H261 VanDerWaalsContact CG2-O 3.26Å; I259-H261 WeakPolarHBondContact CG2-O 3.43Å; I259-C347 WeakPolarHBondContact CD1-O 3.46Å; I259-V349 HydrophobicContact CD1-CG2 4.19Å; I259-V349 HydrophobicContact CG1-CB 4.49Å; I259-V349 HydrophobicContact CG1-CG1 4.05Å; I259-V349 HydrophobicContact CG1-CG2 3.65Å; I259-M356 HydrophobicContact CB-SD 4.25Å; I259-M356 HydrophobicContact CD1-CG 4.37Å; I259-M356 HydrophobicContact CG1-CG 4.37Å; I259-M356 HydrophobicContact CG1-SD 4.31Å; I259-M356 PolarHBondContact N-SD 2.9Å; I259-M356 VanDerWaalsContact N-SD 3.36Å; I259-R358 HydrophobicContact CB-CG 4.33Å; I259-R358 HydrophobicContact CD1-CB 4.12Å; I259-R358 HydrophobicContact CD1-CG 4.06Å; I259-R358 HydrophobicContact CG2-CG 4.37Å; I259-R358 PolarHBondContact O-NH1 3.41Å; I259-R358 PolarHBondContact O-NH2 2.88Å; I259-R358 VanDerWaalsContact O-NH2 3.15Å
260	L	95	Very high	92.8	Very high	118 Å²	118	57.4 Å²	57.4	62%	0.618	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	-40.8	177.5	-58.7	177.3	0	0	0	110.8	R281	L260-R281 PolarHBondContact N-O 3.05Å
261	H	94.8	Very high	92.7	Very high	56 Å²	56	63.3 Å²	63.3	26%	0.259	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	143	178.3	-169.2	88	0	0	0	109.7	I259 K266 T279 C280 R281	I259-H261 VanDerWaalsContact CG2-O 3.26Å; I259-H261 WeakPolarHBondContact CG2-O 3.43Å; H261-K266 PolarHBondContact CE1-NZ 3.18Å; H261-T279 PolarHBondContact CD2-O 3.44Å; H261-C280 CarbonylContact O-C 3.59Å; H261-C280 VanDerWaalsContact O-CA 3.26Å; H261-C280 WeakPolarHBondContact O-CA 2.99Å; H261-C280 PolarHBondContact O-SG 3.43Å; H261-C280 VanDerWaalsContact O-SG 3.41Å; H261-R281 HydrophobicContact CB-CB 4.16Å; H261-R281 PolarHBondContact N-O 2.95Å; H261-R281 VanDerWaalsContact N-O 3.15Å; H261-R281 PolarHBondContact O-N 2.94Å
262	P	95.2	Very high	92.6	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.341	C	S	.	.	S	Bend	cis	-76.7	173.2	-6.7	30.7	-31	0	0	0	112	K266 F268 R358 V360	P262-K266 HydrophobicContact CB-CB 4.01Å; P262-K266 HydrophobicContact CB-CD 3.83Å; P262-K266 HydrophobicContact CB-CG 4.47Å; P262-F268 HydrophobicContact CB-CE2 4.14Å; P262-F268 HydrophobicContact CB-CZ 4.19Å; P262-R358 WeakPolarHBondContact O-CD 3.17Å; P262-R358 PolarHBondContact O-NH1 3.17Å; P262-V360 HydrophobicContact CB-CG2 4.18Å; P262-V360 HydrophobicContact CG-CG2 3.37Å
263	T	93.9	Very high	92.6	Very high	86 Å²	86	60.7 Å²	60.7	53%	0.528	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-72.8	155.7	166.8	46.2	0	0	0	0	110.5	G265 K266	T263-G265 PolarHBondContact O-N 2.94Å; T263-K266 WeakPolarHBondContact O-CB 2.89Å; T263-K266 PolarHBondContact O-N 2.58Å; T263-K266 VanDerWaalsContact O-N 3.17Å
264	N	94	Very high	92.7	Very high	99 Å²	99	57.9 Å²	57.9	53%	0.529	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	128.7	-179.6	-163	36.4	0	0	0	110.3	K266 R358 W359	N264-K266 VanDerWaalsContact C-N 3.32Å; N264-R358 HydrophobicContact CB-CG 4.15Å; N264-W359 PolarHBondContact OD1-N 2.92Å; N264-W359 PolarHBondContact OD1-NE1 3.19Å
265	G	91.4	Very high	92.8	Very high	23 Å²	23	58.7 Å²	58.7	24%	0.237	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	24.1	-176.6	0	0	0	0	0	114.1	T263 V267 W359	T263-G265 PolarHBondContact O-N 2.94Å; G265-V267 PolarHBondContact O-N 2.85Å; G265-W359 PolarHBondContact N-O 3.26Å
266	K	93.2	Very high	92.9	Very high	68 Å²	68	58.3 Å²	58.3	30%	0.296	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	133.4	174.1	-176.3	167.8	176.3	-178	0	109.9	H261 P262 T263 N264 F268 V360 Q361	H261-K266 PolarHBondContact CE1-NZ 3.18Å; P262-K266 HydrophobicContact CB-CB 4.01Å; P262-K266 HydrophobicContact CB-CD 3.83Å; P262-K266 HydrophobicContact CB-CG 4.47Å; T263-K266 WeakPolarHBondContact O-CB 2.89Å; T263-K266 PolarHBondContact O-N 2.58Å; T263-K266 VanDerWaalsContact O-N 3.17Å; N264-K266 VanDerWaalsContact C-N 3.32Å; K266-F268 HydrophobicContact CB-CE2 4.09Å; K266-F268 HydrophobicContact CD-CE2 3.74Å; K266-F268 HydrophobicContact CD-CZ 3.86Å; K266-F268 HydrophobicContact CG-CD2 4.13Å; K266-F268 HydrophobicContact CG-CE2 3.7Å; K266-F268 HydrophobicContact CG-CZ 4.32Å; K266-V360 WeakPolarHBondContact O-CA 3.13Å; K266-V360 WeakPolarHBondContact O-CG1 3.34Å; K266-Q361 PolarHBondContact O-N 2.98Å
267	V	93.1	Very high	92.9	Very high	68 Å²	68	59.8 Å²	59.8	41%	0.412	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	133.5	174.6	-172.8	0	0	0	0	109.8	G265 Q361 E363	G265-V267 PolarHBondContact O-N 2.85Å; V267-Q361 CarbonylContact C-O 2.97Å; V267-Q361 WeakPolarHBondContact CA-O 3.4Å; V267-Q361 HydrophobicContact CG2-CB 4.32Å; V267-E363 HydrophobicContact CG1-CB 3.53Å; V267-E363 WeakPolarHBondContact CG1-OE2 3.39Å
268	F	91.7	Very high	92.9	Very high	31 Å²	31	59.5 Å²	59.5	14%	0.136	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	118.1	173.3	-74.1	-103.7	0	0	0	109.3	P262 K266 L278 V360 Q361 L362 E363	P262-F268 HydrophobicContact CB-CE2 4.14Å; P262-F268 HydrophobicContact CB-CZ 4.19Å; K266-F268 HydrophobicContact CB-CE2 4.09Å; K266-F268 HydrophobicContact CD-CE2 3.74Å; K266-F268 HydrophobicContact CD-CZ 3.86Å; K266-F268 HydrophobicContact CG-CD2 4.13Å; K266-F268 HydrophobicContact CG-CE2 3.7Å; K266-F268 HydrophobicContact CG-CZ 4.32Å; F268-L278 HydrophobicContact CB-CD2 4.22Å; F268-L278 HydrophobicContact CD1-CD2 3.97Å; F268-L278 HydrophobicContact CD2-CD2 4.23Å; F268-L278 HydrophobicContact CE1-CD2 4.35Å; F268-L278 HydrophobicContact CG-CD2 3.88Å; F268-V360 HydrophobicContact CD2-CG1 3.15Å; F268-V360 HydrophobicContact CE2-CB 4.44Å; F268-V360 HydrophobicContact CE2-CG1 3.35Å; F268-V360 HydrophobicContact CE2-CG2 4.19Å; F268-V360 HydrophobicContact CG-CG1 4.25Å; F268-Q361 PolarHBondContact N-O 3.21Å; F268-L362 HydrophobicContact CB-CD2 4Å; F268-L362 WeakPolarHBondContact O-CA 3.48Å; F268-E363 PolarHBondContact O-N 3.05Å
269	P	91.4	Very high	92.9	Very high	92 Å²	92	58.7 Å²	58.7	60%	0.597	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	130.7	174	29.3	-32.4	0	0	0	109.5	E363 E365	P269-E363 CarbonylContact C-O 3.5Å; P269-E363 VanDerWaalsContact CA-O 3.27Å; P269-E363 WeakPolarHBondContact CA-O 3.26Å; P269-E365 HydrophobicContact CB-CB 4.27Å; P269-E365 HydrophobicContact CB-CG 4.42Å
270	V	91.4	Very high	92.9	Very high	5 Å²	5	58.6 Å²	58.6	3%	0.03	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	150.1	-177.2	-62.4	0	0	0	0	111.1	V276 V336 L341 L362 E363 E364 E365	V270-V276 HydrophobicContact CB-CG2 3.95Å; V270-V276 HydrophobicContact CG1-CB 4.32Å; V270-V276 HydrophobicContact CG1-CG1 3.79Å; V270-V276 HydrophobicContact CG1-CG2 3.6Å; V270-V336 HydrophobicContact CG2-CG1 4.38Å; V270-L341 HydrophobicContact CG2-CD2 3.61Å; V270-L362 HydrophobicContact CG1-CD2 3.94Å; V270-L362 HydrophobicContact CG2-CB 4.01Å; V270-E363 PolarHBondContact N-O 3.31Å; V270-E364 CarbonylContact O-C 3.58Å; V270-E364 WeakPolarHBondContact O-CA 3.38Å; V270-E365 PolarHBondContact O-N 3.26Å
271	R	89.1	Confident	93	Very high	144 Å²	144	59.2 Å²	59.2	54%	0.543	32%	0.316	S	S	.	.			trans	-97.6	131.5	168.8	-61.6	180	-171.4	-171.3	-3.3	108.4	S274 E365	R271-S274 WeakPolarHBondContact O-CB 3.16Å; R271-S274 PolarHBondContact O-N 3.04Å; R271-S274 PolarHBondContact O-OG 3.49Å; R271-E365 HydrophobicContact CG-CB 4.17Å; R271-E365 WeakPolarHBondContact CG-OE2 2.96Å; R271-E365 IonicContact CZ-OE1 3.08Å; R271-E365 IonicContact CZ-OE2 2.8Å; R271-E365 IonicContact NE-OE1 3.49Å; R271-E365 IonicContact NE-OE2 3.81Å; R271-E365 PolarHBondContact NE-OE2 3.35Å; R271-E365 IonicContact NH2-OE1 2.87Å; R271-E365 PolarHBondContact NH2-OE1 2.93Å; R271-E365 IonicContact NH2-OE2 3.94Å; R271-E365 PolarHBondContact NH2-OE2 3Å
272	T	87.4	Confident	93.1	Very high	42 Å²	42	56.7 Å²	56.7	26%	0.258	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	147.1	169.1	36.8	0	0	0	0	109.7	S274 L341 E364	T272-S274 VanDerWaalsContact C-N 3.27Å; T272-S274 PolarHBondContact O-N 3.43Å; T272-L341 HydrophobicContact CG2-CD1 4.39Å; T272-E364 PolarHBondContact OG1-OE1 2.73Å
273	S	88.4	Confident	93.1	Very high	97 Å²	97	59 Å²	59	68%	0.678	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	22.5	-174.1	70.4	0	0	0	0	116.4	D335 V336	S273-D335 WeakPolarHBondContact CA-OD1 3.43Å; S273-V336 PolarHBondContact N-O 2.85Å
274	S	90.4	Very high	93.1	Very high	39 Å²	39	55 Å²	55	27%	0.273	29%	0.293	S	S	.	.	S	Bend	trans	-117.9	161.5	173.6	74.6	0	0	0	0	112.1	R271 T272 V336	R271-S274 WeakPolarHBondContact O-CB 3.16Å; R271-S274 PolarHBondContact O-N 3.04Å; R271-S274 PolarHBondContact O-OG 3.49Å; T272-S274 VanDerWaalsContact C-N 3.27Å; T272-S274 PolarHBondContact O-N 3.43Å; S274-V336 WeakPolarHBondContact O-CG2 3.44Å; S274-V336 PolarHBondContact O-N 2.99Å
275	D	93.6	Very high	93.1	Very high	97 Å²	97	50.6 Å²	50.6	52%	0.519	27%	0.269	S	S	.	.			trans	-86	130.9	175	-71.1	-3.1	0	0	0	110.2	I333 R334 D335	D275-I333 WeakPolarHBondContact CA-O 3.28Å; D275-R334 VanDerWaalsContact OD1-CA 3.26Å; D275-R334 WeakPolarHBondContact OD1-CA 3.44Å; D275-D335 PolarHBondContact OD1-N 3.01Å
276	V	94	Very high	93.2	Very high	17 Å²	17	50.4 Å²	50.4	10%	0.103	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	140.6	-176.5	175.5	0	0	0	0	110.9	V270 L278 I333 V336	V270-V276 HydrophobicContact CB-CG2 3.95Å; V270-V276 HydrophobicContact CG1-CB 4.32Å; V270-V276 HydrophobicContact CG1-CG1 3.79Å; V270-V276 HydrophobicContact CG1-CG2 3.6Å; V276-L278 HydrophobicContact CG1-CD2 3.95Å; V276-L278 HydrophobicContact CG1-CG 4.42Å; V276-I333 PolarHBondContact N-O 3.44Å; V276-I333 PolarHBondContact O-N 2.73Å; V276-V336 HydrophobicContact CB-CG2 3.95Å; V276-V336 HydrophobicContact CG2-CG2 3.63Å
277	H	94.8	Very high	93.2	Very high	112 Å²	112	48.6 Å²	48.6	52%	0.519	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	109.5	179.7	-54	-73.6	0	0	0	110.5	I330 L331 N332	H277-I330 HydrophobicContact CB-CG2 4Å; H277-L331 WeakPolarHBondContact CA-O 3.34Å; H277-N332 PolarHBondContact ND1-OD1 3.02Å
278	L	95.5	Very high	93	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	114.9	175.2	-55.7	-177.4	0	0	0	109.7	F268 V276 W297 I330 L331 I333 F345 V360 L362	F268-L278 HydrophobicContact CB-CD2 4.22Å; F268-L278 HydrophobicContact CD1-CD2 3.97Å; F268-L278 HydrophobicContact CD2-CD2 4.23Å; F268-L278 HydrophobicContact CE1-CD2 4.35Å; F268-L278 HydrophobicContact CG-CD2 3.88Å; V276-L278 HydrophobicContact CG1-CD2 3.95Å; V276-L278 HydrophobicContact CG1-CG 4.42Å; L278-W297 HydrophobicContact CB-CH2 3.91Å; L278-W297 HydrophobicContact CB-CZ2 3.78Å; L278-W297 HydrophobicContact CD1-CH2 4.44Å; L278-I330 CarbonylContact O-C 3.5Å; L278-I330 WeakPolarHBondContact O-CA 3.43Å; L278-L331 HydrophobicContact CB-CB 4.28Å; L278-L331 HydrophobicContact CD1-CD2 4.33Å; L278-L331 PolarHBondContact N-O 2.84Å; L278-L331 PolarHBondContact O-N 3.01Å; L278-I333 HydrophobicContact CD1-CD1 4.05Å; L278-I333 HydrophobicContact CG-CD1 4.42Å; L278-F345 HydrophobicContact CD1-CB 4.1Å; L278-F345 HydrophobicContact CD1-CD1 4.32Å; L278-F345 HydrophobicContact CD1-CD2 4.48Å; L278-F345 HydrophobicContact CD1-CG 4.03Å; L278-V360 HydrophobicContact CD1-CG1 4.47Å; L278-L362 HydrophobicContact CD1-CD2 4.19Å; L278-L362 HydrophobicContact CD2-CD2 3.94Å
279	T	96.2	Very high	92.8	Very high	36 Å²	36	55.2 Å²	55.2	22%	0.221	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	134.5	179.8	58.4	0	0	0	0	110.5	H261 I330	H261-T279 PolarHBondContact CD2-O 3.44Å; T279-I330 HydrophobicContact CG2-CD1 4.36Å; T279-I330 HydrophobicContact CG2-CG1 4.18Å; T279-I330 HydrophobicContact CG2-CG2 4.43Å
280	C	96.8	Very high	92.8	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	128.2	169.7	-179.1	0	0	0	0	110.2	H261 W297 E328 T329 C347	H261-C280 CarbonylContact O-C 3.59Å; H261-C280 VanDerWaalsContact O-CA 3.26Å; H261-C280 WeakPolarHBondContact O-CA 2.99Å; H261-C280 PolarHBondContact O-SG 3.43Å; H261-C280 VanDerWaalsContact O-SG 3.41Å; C280-W297 HydrophobicContact CB-CH2 4.4Å; C280-W297 HydrophobicContact CB-CZ2 3.54Å; C280-E328 CarbonylContact O-C 3.56Å; C280-E328 VanDerWaalsContact O-CA 3.25Å; C280-E328 WeakPolarHBondContact O-CA 3.27Å; C280-T329 HydrophobicContact CB-CG2 3.75Å; C280-T329 PolarHBondContact N-O 3.14Å; C280-T329 PolarHBondContact O-N 3.27Å; C280-C347 HydrophobicContact CB-CB 3.58Å; C280-C347 WeakPolarHBondContact CB-SG 3.25Å; C280-C347 WeakPolarHBondContact SG-CB 3.47Å; C280-C347 CovalentContact SG-SG 2.01Å; C280-C347 PolarHBondContact SG-SG 2.95Å
281	R	96.8	Very high	92.7	Very high	131 Å²	131	60.3 Å²	60.3	49%	0.494	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123	178.6	-64.9	-179.3	-177.1	170.4	-0	109.2	L260 H261 A327 E328	L260-R281 PolarHBondContact N-O 3.05Å; H261-R281 HydrophobicContact CB-CB 4.16Å; H261-R281 PolarHBondContact N-O 2.95Å; H261-R281 VanDerWaalsContact N-O 3.15Å; H261-R281 PolarHBondContact O-N 2.94Å; R281-A327 CarbonylContact C-O 3.57Å; R281-A327 WeakPolarHBondContact CA-O 3.13Å; R281-E328 HydrophobicContact CG-CB 4.14Å; R281-E328 HydrophobicContact CG-CG 3.91Å; R281-E328 IonicContact CZ-OE1 3.43Å; R281-E328 VanDerWaalsContact CZ-OE1 3.27Å; R281-E328 IonicContact NE-OE1 2.8Å; R281-E328 PolarHBondContact NE-OE1 3.26Å; R281-E328 IonicContact NE-OE2 3.61Å; R281-E328 IonicContact NH2-OE1 3.51Å; R281-E328 PolarHBondContact NH2-OE1 3.26Å
282	G	95.8	Very high	92.8	Very high	3 Å²	3	60.4 Å²	60.4	3%	0.031	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	151.6	178.1	0	0	0	0	0	112.6	T258 A327	T258-G282 CarbonylContact O-C 3.6Å; T258-G282 WeakPolarHBondContact O-CA 3.29Å; G282-A327 PolarHBondContact N-O 2.87Å; G282-A327 PolarHBondContact O-N 2.97Å
283	L	95.6	Very high	93	Very high	49 Å²	49	61.2 Å²	61.2	26%	0.257	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	124	167.3	-178.8	71.7	0	0	0	108.2	P257 T258 P285 K326	P257-L283 WeakPolarHBondContact CA-O 3.49Å; T258-L283 PolarHBondContact N-O 2.96Å; T258-L283 PolarHBondContact O-N 3.43Å; L283-P285 WeakPolarHBondContact O-CD 3.48Å; L283-K326 HydrophobicContact CD1-CG 3.79Å
284	L	95.4	Very high	93.3	Very high	3 Å²	3	58.7 Å²	58.7	2%	0.016	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	94.7	-178.6	-61.9	95.5	0	0	0	110	R293 E294 L325 A327 V349	L284-R293 HydrophobicContact CB-CB 4.34Å; L284-R293 HydrophobicContact CB-CG 4.31Å; L284-R293 HydrophobicContact CD2-CB 3.91Å; L284-R293 PolarHBondContact O-NH1 3.02Å; L284-E294 WeakPolarHBondContact CD2-O 3.34Å; L284-L325 HydrophobicContact CB-CB 4.28Å; L284-L325 PolarHBondContact N-O 2.69Å; L284-L325 PolarHBondContact O-N 2.9Å; L284-A327 HydrophobicContact CD1-CB 3.51Å; L284-V349 HydrophobicContact CD1-CG1 4.37Å; L284-V349 HydrophobicContact CD2-CB 4.28Å; L284-V349 HydrophobicContact CG-CB 4.45Å
285	P	94.2	Very high	93.5	Very high	5 Å²	5	57.5 Å²	57.5	3%	0.032	28%	0.281	C	S	.	.			trans	-61.6	143.7	-178.8	-24.6	35	0	0	0	113.2	K255 L283 R293	K255-P285 HydrophobicContact CB-CB 4.15Å; K255-P285 HydrophobicContact CD-CB 3.6Å; L283-P285 WeakPolarHBondContact O-CD 3.48Å; P285-R293 WeakPolarHBondContact O-CD 3.33Å
286	F	93.1	Very high	93.6	Very high	19 Å²	19	54.6 Å²	54.6	8%	0.083	26%	0.263	C	S	.	.			trans	-74.3	138.9	176.7	-177.1	-107.3	0	0	0	112.2	L155 I248 I288 P291 R293 R323 D324	L155-F286 HydrophobicContact CD1-CE1 3.59Å; L155-F286 HydrophobicContact CD1-CZ 4Å; I248-F286 HydrophobicContact CG2-CD1 4.33Å; F286-I288 HydrophobicContact CD1-CG1 4.4Å; F286-I288 HydrophobicContact CE1-CB 4.37Å; F286-I288 HydrophobicContact CE1-CG1 3.88Å; F286-P291 HydrophobicContact CD2-CB 4.41Å; F286-P291 HydrophobicContact CE2-CB 3.73Å; F286-R293 VanDerWaalsContact CA-NH1 3.3Å; F286-R323 HydrophobicContact CB-CB 3.91Å; F286-R323 WeakPolarHBondContact CB-O 3.33Å; F286-R323 HydrophobicContact CD1-CB 4.03Å; F286-R323 HydrophobicContact CD2-CB 4Å; F286-R323 HydrophobicContact CG-CB 3.7Å; F286-D324 VanDerWaalsContact CB-OD1 3.32Å; F286-D324 WeakPolarHBondContact CB-OD1 3.36Å; F286-D324 PolarHBondContact N-OD1 3.29Å
287	I	91.8	Very high	93.7	Very high	30 Å²	30	53.8 Å²	53.8	15%	0.154	26%	0.258	C	S	.	.			trans	-127.7	121.2	176.5	-59.1	164	0	0	0	107.3	K255 D289 K290 N351 A352 R353	K255-I287 HydrophobicContact CB-CG1 4.33Å; I287-D289 PolarHBondContact O-N 2.98Å; I287-K290 CarbonylContact O-C 3.53Å; I287-K290 VanDerWaalsContact O-C 3.26Å; I287-K290 PolarHBondContact O-N 2.89Å; I287-N351 HydrophobicContact CD1-CB 4.24Å; I287-A352 HydrophobicContact CD1-CB 3.8Å; I287-R353 HydrophobicContact CD1-CB 4.1Å; I287-R353 HydrophobicContact CD1-CG 3.67Å; I287-R353 HydrophobicContact CG1-CG 4.47Å
288	I	89.3	Confident	93.8	Very high	91 Å²	91	49.2 Å²	49.2	47%	0.467	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-50.3	-170.2	-61.5	170	0	0	0	111.5	L155 I248 F286 K290	L155-I288 HydrophobicContact CD1-CG1 4.4Å; I248-I288 HydrophobicContact CD1-CD1 3.97Å; I248-I288 HydrophobicContact CD1-CG1 4.14Å; F286-I288 HydrophobicContact CD1-CG1 4.4Å; F286-I288 HydrophobicContact CE1-CB 4.37Å; F286-I288 HydrophobicContact CE1-CG1 3.88Å; I288-K290 VanDerWaalsContact C-N 3.33Å; I288-K290 PolarHBondContact O-N 3.11Å
289	D	88.5	Confident	93.8	Very high	147 Å²	147	49.2 Å²	49.2	79%	0.786	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-19.3	-174.1	-53.1	-45	0	0	0	113.5	I287	I287-D289 PolarHBondContact O-N 2.98Å
290	K	90.8	Very high	93.6	Very high	137 Å²	137	51.5 Å²	51.5	60%	0.596	25%	0.248	S	C	*	.			trans	-145.6	82.1	-174.2	-67.1	-173.5	179.3	-178.3	0	110.4	I287 I288 E292 A352	I287-K290 CarbonylContact O-C 3.53Å; I287-K290 VanDerWaalsContact O-C 3.26Å; I287-K290 PolarHBondContact O-N 2.89Å; I288-K290 VanDerWaalsContact C-N 3.33Å; I288-K290 PolarHBondContact O-N 3.11Å; K290-E292 VanDerWaalsContact C-N 3.27Å; K290-E292 PolarHBondContact O-N 3.37Å; K290-A352 HydrophobicContact CB-CB 3.4Å; K290-A352 VanDerWaalsContact CB-CB 3.4Å; K290-A352 HydrophobicContact CD-CB 3.81Å; K290-A352 HydrophobicContact CG-CB 4.23Å
291	P	88.9	Confident	93.3	Very high	67 Å²	67	54.6 Å²	54.6	44%	0.435	28%	0.281	S	S	.	.			trans	-78.1	-8.2	-171.8	32	-37.4	0	0	0	114.4	F286 R293	F286-P291 HydrophobicContact CD2-CB 4.41Å; F286-P291 HydrophobicContact CE2-CB 3.73Å; P291-R293 PolarHBondContact O-N 3.22Å; P291-R293 PolarHBondContact O-NE 3.35Å
292	E	90.9	Very high	93.1	Very high	147 Å²	147	54.4 Å²	54.4	69%	0.687	28%	0.284	S	S	*	.			trans	-60.9	126.9	-179.6	-67.1	177.5	-171.1	0	0	112.3	K290	K290-E292 VanDerWaalsContact C-N 3.27Å; K290-E292 PolarHBondContact O-N 3.37Å
293	R	92.9	Very high	93	Very high	59 Å²	59	58.2 Å²	58.2	22%	0.223	30%	0.297	C	S	.	.			trans	-147.9	141.8	-175.1	-72.7	167.2	-70.7	-179	6.6	109.4	L284 P285 F286 P291 R323 R350 N351	L284-R293 HydrophobicContact CB-CB 4.34Å; L284-R293 HydrophobicContact CB-CG 4.31Å; L284-R293 HydrophobicContact CD2-CB 3.91Å; L284-R293 PolarHBondContact O-NH1 3.02Å; P285-R293 WeakPolarHBondContact O-CD 3.33Å; F286-R293 VanDerWaalsContact CA-NH1 3.3Å; P291-R293 PolarHBondContact O-N 3.22Å; P291-R293 PolarHBondContact O-NE 3.35Å; R293-R323 PolarHBondContact NH1-O 3.31Å; R293-R323 PolarHBondContact NH2-O 3.48Å; R293-R350 WeakPolarHBondContact CA-O 3.34Å; R293-N351 HydrophobicContact CG-CB 3.73Å
294	E	93.1	Very high	92.8	Very high	44 Å²	44	56.6 Å²	56.6	21%	0.206	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	145.7	179.8	40.7	164.2	-168.1	0	0	111.8	L284 W296 R303 V349 R350	L284-E294 WeakPolarHBondContact CD2-O 3.34Å; E294-W296 HydrophobicContact CB-CE3 3.92Å; E294-W296 HydrophobicContact CB-CZ3 4.03Å; E294-W296 VanDerWaalsContact CD-CZ3 3.46Å; E294-W296 HydrophobicContact CG-CE3 3.88Å; E294-W296 HydrophobicContact CG-CH2 4.42Å; E294-W296 HydrophobicContact CG-CZ3 3.5Å; E294-W296 VanDerWaalsContact CG-CZ3 3.5Å; E294-W296 WeakPolarHBondContact O-CZ3 3.38Å; E294-R303 IonicContact OE1-NH2 3.83Å; E294-R303 PolarHBondContact OE1-NH2 3.48Å; E294-R303 IonicContact OE2-CZ 3.53Å; E294-R303 IonicContact OE2-NH1 3.28Å; E294-R303 PolarHBondContact OE2-NH1 3.39Å; E294-R303 IonicContact OE2-NH2 2.73Å; E294-R303 PolarHBondContact OE2-NH2 2.99Å; E294-V349 CarbonylContact O-C 3.53Å; E294-V349 WeakPolarHBondContact O-CA 3.49Å; E294-R350 HydrophobicContact CG-CB 4.17Å; E294-R350 PolarHBondContact N-O 2.87Å; E294-R350 PolarHBondContact O-N 2.87Å; E294-R350 IonicContact OE1-CZ 3.8Å; E294-R350 IonicContact OE1-NE 3.55Å; E294-R350 PolarHBondContact OE1-NE 2.88Å; E294-R350 IonicContact OE1-NH2 3.59Å; E294-R350 PolarHBondContact OE1-NH2 2.76Å
295	I	95.4	Very high	92.5	Very high	14 Å²	14	64.7 Å²	64.7	7%	0.072	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	135.4	169.2	-174	169.5	0	0	0	107.8	A327 T329 S348 V349	I295-A327 HydrophobicContact CB-CB 4.35Å; I295-A327 HydrophobicContact CD1-CB 4.17Å; I295-A327 HydrophobicContact CG2-CB 3.71Å; I295-T329 HydrophobicContact CD1-CG2 3.69Å; I295-T329 HydrophobicContact CG1-CG2 3.59Å; I295-S348 WeakPolarHBondContact CA-O 3.49Å; I295-V349 HydrophobicContact CB-CG1 4.02Å; I295-V349 HydrophobicContact CD1-CG1 3.77Å; I295-V349 HydrophobicContact CG1-CG1 3.62Å
296	W	95.8	Very high	92.4	Very high	35 Å²	35	70.2 Å²	70.2	13%	0.133	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	160.7	-177.7	68.1	96.4	0	0	0	112.2	E294 S348 R350	E294-W296 HydrophobicContact CB-CE3 3.92Å; E294-W296 HydrophobicContact CB-CZ3 4.03Å; E294-W296 VanDerWaalsContact CD-CZ3 3.46Å; E294-W296 HydrophobicContact CG-CE3 3.88Å; E294-W296 HydrophobicContact CG-CH2 4.42Å; E294-W296 HydrophobicContact CG-CZ3 3.5Å; E294-W296 VanDerWaalsContact CG-CZ3 3.5Å; E294-W296 WeakPolarHBondContact O-CZ3 3.38Å; W296-S348 VanDerWaalsContact CE2-CB 3.49Å; W296-S348 VanDerWaalsContact CZ2-CB 3.46Å; W296-S348 PolarHBondContact N-O 3.2Å; W296-S348 PolarHBondContact O-N 2.86Å; W296-R350 HydrophobicContact CH2-CB 3.65Å; W296-R350 HydrophobicContact CZ3-CB 3.69Å
297	W	96.9	Very high	92.2	Very high	1 Å²	1	71 Å²	71	0%	0.004	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	146.7	167.1	-77	97.6	0	0	0	111.3	L278 C280 V304 T329 L331 F345 T346 C347 V360	L278-W297 HydrophobicContact CB-CH2 3.91Å; L278-W297 HydrophobicContact CB-CZ2 3.78Å; L278-W297 HydrophobicContact CD1-CH2 4.44Å; C280-W297 HydrophobicContact CB-CH2 4.4Å; C280-W297 HydrophobicContact CB-CZ2 3.54Å; W297-V304 HydrophobicContact CB-CG2 3.97Å; W297-T329 PolarHBondContact NE1-O 3.16Å; W297-L331 HydrophobicContact CB-CB 4.3Å; W297-L331 HydrophobicContact CB-CD1 4.32Å; W297-L331 HydrophobicContact CB-CD2 4.29Å; W297-L331 HydrophobicContact CD2-CB 3.91Å; W297-L331 HydrophobicContact CD2-CD2 4.2Å; W297-L331 HydrophobicContact CE3-CD2 4.25Å; W297-L331 HydrophobicContact CG-CB 3.71Å; W297-L331 HydrophobicContact CG-CD2 4.25Å; W297-L331 HydrophobicContact CG-CG 4.42Å; W297-F345 HydrophobicContact CE3-CB 4.44Å; W297-F345 HydrophobicContact CZ3-CB 4.1Å; W297-T346 CarbonylContact C-O 3.58Å; W297-T346 WeakPolarHBondContact CA-O 3.47Å; W297-T346 VanDerWaalsContact CE3-C 3.42Å; W297-C347 HydrophobicContact CD2-CB 4.07Å; W297-C347 HydrophobicContact CE3-CB 3.97Å; W297-C347 HydrophobicContact CH2-CB 3.91Å; W297-C347 HydrophobicContact CZ2-CB 4.02Å; W297-C347 HydrophobicContact CZ3-CB 3.89Å; W297-V360 HydrophobicContact CH2-CG2 3.96Å; W297-V360 HydrophobicContact CZ3-CG2 4.18Å
298	T	95.8	Very high	91.9	Very high	15 Å²	15	78 Å²	78	9%	0.092	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	137.7	166.3	57.6	0	0	0	0	110.3	K302 R303 T346	T298-K302 CarbonylContact C-O 3.59Å; T298-K302 WeakPolarHBondContact CA-O 3.42Å; T298-K302 WeakPolarHBondContact CB-O 3.36Å; T298-R303 HydrophobicContact CG2-CG 4.35Å; T298-T346 PolarHBondContact N-O 2.94Å; T298-T346 PolarHBondContact O-N 3.15Å; T298-T346 WeakPolarHBondContact OG1-CB 3.38Å; T298-T346 PolarHBondContact OG1-O 2.76Å
299	V	95	Very high	91.8	Very high	1 Å²	1	75.8 Å²	75.8	1%	0.006	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	120.5	170.7	-169	0	0	0	0	107	G301 K302 L307 F312 L331 R343 F345	V299-G301 PolarHBondContact O-N 2.96Å; V299-G301 VanDerWaalsContact O-N 3.15Å; V299-K302 PolarHBondContact N-O 3.16Å; V299-K302 PolarHBondContact O-N 3.27Å; V299-L307 HydrophobicContact CB-CD1 3.9Å; V299-L307 HydrophobicContact CB-CD2 4.42Å; V299-L307 HydrophobicContact CG2-CD1 3.87Å; V299-F312 HydrophobicContact CG2-CD1 4.17Å; V299-F312 HydrophobicContact CG2-CE1 4.32Å; V299-L331 HydrophobicContact CG2-CD2 4.26Å; V299-R343 HydrophobicContact CG1-CB 4.36Å; V299-F345 HydrophobicContact CB-CD1 4.45Å; V299-F345 HydrophobicContact CB-CE1 4.38Å; V299-F345 HydrophobicContact CG1-CD1 4.06Å; V299-F345 HydrophobicContact CG1-CE1 3.65Å; V299-F345 HydrophobicContact CG1-CZ 4.33Å; V299-F345 HydrophobicContact CG2-CD1 3.9Å; V299-F345 HydrophobicContact CG2-CE1 3.92Å
300	D	92.1	Very high	91.8	Very high	83 Å²	83	72.2 Å²	72.2	44%	0.444	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	37.2	-176.7	-56.4	-33	0	0	0	113.3	K302 R343 N344	D300-K302 VanDerWaalsContact C-N 3.3Å; D300-K302 PolarHBondContact O-N 2.97Å; D300-R343 WeakPolarHBondContact OD2-CD 3.42Å; D300-R343 WeakPolarHBondContact OD2-CG 3.48Å; D300-R343 IonicContact OD2-NE 3.68Å; D300-R343 PolarHBondContact OD2-NE 3.27Å; D300-N344 PolarHBondContact N-O 3.36Å; D300-N344 PolarHBondContact OD1-N 3.49Å
301	G	90.7	Very high	91.9	Very high	66 Å²	66	68 Å²	68	68%	0.68	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.3	-2.3	179.2	0	0	0	0	0	115.7	V299	V299-G301 PolarHBondContact O-N 2.96Å; V299-G301 VanDerWaalsContact O-N 3.15Å
302	K	93.7	Very high	92.1	Very high	127 Å²	127	65.3 Å²	65.3	55%	0.552	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	142.2	175.7	-64.3	-179.6	-177.7	177	0	111	T298 V299 D300	T298-K302 CarbonylContact C-O 3.59Å; T298-K302 WeakPolarHBondContact CA-O 3.42Å; T298-K302 WeakPolarHBondContact CB-O 3.36Å; V299-K302 PolarHBondContact N-O 3.16Å; V299-K302 PolarHBondContact O-N 3.27Å; D300-K302 VanDerWaalsContact C-N 3.3Å; D300-K302 PolarHBondContact O-N 2.97Å
303	R	93.2	Very high	92.2	Very high	83 Å²	83	60.3 Å²	60.3	31%	0.313	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	151.7	174.5	-68.6	-169.1	176.5	-159	-4.4	110.3	E294 T298 E305 Q306 L307	E294-R303 IonicContact OE1-NH2 3.83Å; E294-R303 PolarHBondContact OE1-NH2 3.48Å; E294-R303 IonicContact OE2-CZ 3.53Å; E294-R303 IonicContact OE2-NH1 3.28Å; E294-R303 PolarHBondContact OE2-NH1 3.39Å; E294-R303 IonicContact OE2-NH2 2.73Å; E294-R303 PolarHBondContact OE2-NH2 2.99Å; T298-R303 HydrophobicContact CG2-CG 4.35Å; R303-E305 PolarHBondContact O-N 3.14Å; R303-Q306 HydrophobicContact CB-CG 4.22Å; R303-Q306 WeakPolarHBondContact O-CA 3.33Å; R303-Q306 WeakPolarHBondContact O-CB 3.39Å; R303-Q306 PolarHBondContact O-N 3.32Å; R303-L307 PolarHBondContact O-N 3.23Å
304	V	92.1	Very high	92.3	Very high	15 Å²	15	59.9 Å²	59.9	9%	0.091	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-50.8	-41.9	178.2	-176.1	0	0	0	0	112.2	W297 Q306 L307 F312 Q314 L331	W297-V304 HydrophobicContact CB-CG2 3.97Å; V304-Q306 PolarHBondContact O-N 2.96Å; V304-L307 WeakPolarHBondContact O-CB 3.44Å; V304-L307 PolarHBondContact O-N 3.39Å; V304-F312 HydrophobicContact CG1-CB 4.19Å; V304-Q314 HydrophobicContact CB-CB 4.26Å; V304-Q314 HydrophobicContact CG1-CB 4.15Å; V304-Q314 HydrophobicContact CG2-CB 4.22Å; V304-L331 HydrophobicContact CG1-CD1 4.41Å; V304-L331 HydrophobicContact CG2-CD1 3.62Å
305	E	89.4	Confident	92.4	Very high	172 Å²	172	61.5 Å²	61.5	80%	0.804	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-65.9	-21.6	178.2	-62.4	167	-165.8	0	0	114.3	R303	R303-E305 PolarHBondContact O-N 3.14Å
306	Q	91.5	Very high	92.3	Very high	122 Å²	122	64.9 Å²	64.9	57%	0.57	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-92.7	-5.4	179.6	-61.2	172.2	-30.5	0	0	112.3	R303 V304	R303-Q306 HydrophobicContact CB-CG 4.22Å; R303-Q306 WeakPolarHBondContact O-CA 3.33Å; R303-Q306 WeakPolarHBondContact O-CB 3.39Å; R303-Q306 PolarHBondContact O-N 3.32Å; V304-Q306 PolarHBondContact O-N 2.96Å
307	L	88.7	Confident	92.2	Very high	34 Å²	34	66 Å²	66	18%	0.178	37%	0.37	C	S	.	.			trans	-82.1	123.1	174.8	-77	133.3	0	0	0	109	V299 R303 V304 D309	V299-L307 HydrophobicContact CB-CD1 3.9Å; V299-L307 HydrophobicContact CB-CD2 4.42Å; V299-L307 HydrophobicContact CG2-CD1 3.87Å; R303-L307 PolarHBondContact O-N 3.23Å; V304-L307 WeakPolarHBondContact O-CB 3.44Å; V304-L307 PolarHBondContact O-N 3.39Å; L307-D309 PolarHBondContact O-N 3.12Å
308	N	85.6	Confident	92.1	Very high	177 Å²	177	70.2 Å²	70.2	95%	0.947	40%	0.396	S	S	*	.	S	Bend	trans	-78.3	37.4	169.7	-71.2	-11	0	0	0	111.4
309	D	86.7	Confident	92	Very high	45 Å²	45	75.1 Å²	75.1	24%	0.241	42%	0.42	C	S	.	.			trans	-129.7	109.9	-178.2	-173.7	-15	0	0	0	109.1	L307 R311 F312	L307-D309 PolarHBondContact O-N 3.12Å; D309-R311 PolarHBondContact O-N 2.95Å; D309-R311 VanDerWaalsContact OD1-CB 3.25Å; D309-R311 WeakPolarHBondContact OD1-CB 3.44Å; D309-R311 VanDerWaalsContact OD1-CG 3.27Å; D309-R311 WeakPolarHBondContact OD1-CG 3.15Å; D309-R311 PolarHBondContact OD1-N 3.38Å; D309-R311 IonicContact OD1-NE 3.71Å; D309-R311 PolarHBondContact OD1-NE 3.08Å; D309-R311 IonicContact OD2-CZ 3.85Å; D309-R311 IonicContact OD2-NE 2.89Å; D309-R311 PolarHBondContact OD2-NE 2.99Å; D309-R311 VanDerWaalsContact OD2-NE 3.11Å; D309-R311 IonicContact OD2-NH2 3.57Å; D309-R311 PolarHBondContact OD2-NH2 3.09Å; D309-F312 HydrophobicContact CB-CD2 3.94Å; D309-F312 HydrophobicContact CB-CE2 4.27Å; D309-F312 PolarHBondContact O-N 3.47Å; D309-F312 WeakPolarHBondContact OD2-CE2 3.38Å
310	G	87.7	Confident	91.8	Very high	73 Å²	73	79.6 Å²	79.6	75%	0.753	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-3.6	-178.3	0	0	0	0	0	114.8	F312	G310-F312 VanDerWaalsContact C-N 3.32Å
311	R	93.3	Very high	91.7	Very high	47 Å²	47	77 Å²	77	18%	0.177	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-27.1	173.5	-64.3	-177.1	-52.5	120	2.6	112.5	D309 R334 D335 D340	D309-R311 PolarHBondContact O-N 2.95Å; D309-R311 VanDerWaalsContact OD1-CB 3.25Å; D309-R311 WeakPolarHBondContact OD1-CB 3.44Å; D309-R311 VanDerWaalsContact OD1-CG 3.27Å; D309-R311 WeakPolarHBondContact OD1-CG 3.15Å; D309-R311 PolarHBondContact OD1-N 3.38Å; D309-R311 IonicContact OD1-NE 3.71Å; D309-R311 PolarHBondContact OD1-NE 3.08Å; D309-R311 IonicContact OD2-CZ 3.85Å; D309-R311 IonicContact OD2-NE 2.89Å; D309-R311 PolarHBondContact OD2-NE 2.99Å; D309-R311 VanDerWaalsContact OD2-NE 3.11Å; D309-R311 IonicContact OD2-NH2 3.57Å; D309-R311 PolarHBondContact OD2-NH2 3.09Å; R311-R334 HydrophobicContact CB-CB 4.34Å; R311-R334 WeakPolarHBondContact CB-O 3.38Å; R311-R334 WeakPolarHBondContact CD-O 3.02Å; R311-R334 PolarHBondContact NH1-O 2.93Å; R311-R334 PolarHBondContact O-N 3.03Å; R311-D335 PolarHBondContact NH1-O 3.04Å; R311-D340 IonicContact CZ-OD2 3.59Å; R311-D340 IonicContact NH1-OD2 2.7Å; R311-D340 PolarHBondContact NH1-OD2 3.33Å; R311-D340 IonicContact NH2-OD1 3.19Å; R311-D340 PolarHBondContact NH2-OD1 3.4Å; R311-D340 IonicContact NH2-OD2 3.54Å; R311-D340 PolarHBondContact NH2-OD2 2.84Å
312	F	93.9	Very high	91.7	Very high	12 Å²	12	76.3 Å²	76.3	5%	0.053	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	125.5	178.5	-60.9	-83	0	0	0	110.2	V299 V304 D309 G310 L331 N332 I333 F345	V299-F312 HydrophobicContact CG2-CD1 4.17Å; V299-F312 HydrophobicContact CG2-CE1 4.32Å; V304-F312 HydrophobicContact CG1-CB 4.19Å; D309-F312 HydrophobicContact CB-CD2 3.94Å; D309-F312 HydrophobicContact CB-CE2 4.27Å; D309-F312 PolarHBondContact O-N 3.47Å; D309-F312 WeakPolarHBondContact OD2-CE2 3.38Å; G310-F312 VanDerWaalsContact C-N 3.32Å; F312-L331 HydrophobicContact CD1-CD1 4.4Å; F312-N332 WeakPolarHBondContact CA-O 3.34Å; F312-I333 HydrophobicContact CD1-CB 4.39Å; F312-I333 HydrophobicContact CD1-CG1 3.87Å; F312-I333 HydrophobicContact CD1-CG2 4.13Å; F312-I333 HydrophobicContact CE1-CB 4.23Å; F312-I333 HydrophobicContact CE1-CD1 4.1Å; F312-I333 HydrophobicContact CE1-CG1 3.81Å; F312-I333 HydrophobicContact CE1-CG2 3.59Å; F312-I333 HydrophobicContact CZ-CG2 4.17Å; F312-F345 AromaticContact CE1-CE1 3.81Å; F312-F345 HydrophobicContact CE1-CE1 3.81Å; F312-F345 HydrophobicContact CE1-CZ 4.35Å
313	S	93.8	Very high	91.6	Very high	41 Å²	41	73 Å²	73	29%	0.287	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	149.9	170.7	57.6	0	0	0	0	110.3	N332	S313-N332 PolarHBondContact N-O 2.8Å; S313-N332 PolarHBondContact O-N 3.42Å; S313-N332 WeakPolarHBondContact OG-CB 3.38Å; S313-N332 PolarHBondContact OG-ND2 2.99Å
314	Q	94.4	Very high	91.5	Very high	50 Å²	50	69.5 Å²	69.5	23%	0.234	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	131.3	-178.9	-169.6	-174.9	-82.3	0	0	109.8	V304 N316 T329 I330	V304-Q314 HydrophobicContact CB-CB 4.26Å; V304-Q314 HydrophobicContact CG1-CB 4.15Å; V304-Q314 HydrophobicContact CG2-CB 4.22Å; Q314-N316 WeakPolarHBondContact CG-OD1 3.14Å; Q314-N316 PolarHBondContact NE2-ND2 3.16Å; Q314-N316 PolarHBondContact NE2-OD1 3.42Å; Q314-T329 VanDerWaalsContact CG-OG1 3.24Å; Q314-T329 WeakPolarHBondContact CG-OG1 3.38Å; Q314-I330 WeakPolarHBondContact CA-O 3.17Å
315	T	94.3	Very high	91.6	Very high	79 Å²	79	70.5 Å²	70.5	49%	0.485	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	126.9	173.1	-53.8	0	0	0	0	109.1	T329 I330	T315-T329 CarbonylContact O-C 3.58Å; T315-T329 WeakPolarHBondContact O-CA 3.48Å; T315-I330 PolarHBondContact N-O 2.81Å; T315-I330 PolarHBondContact O-N 3.5Å
316	N	94.2	Very high	91.9	Very high	85 Å²	85	67 Å²	67	46%	0.455	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	135.8	-179.7	-67.1	-7.7	0	0	0	110.4	Q314 T329	Q314-N316 WeakPolarHBondContact CG-OD1 3.14Å; Q314-N316 PolarHBondContact NE2-ND2 3.16Å; Q314-N316 PolarHBondContact NE2-OD1 3.42Å; N316-T329 VanDerWaalsContact OD1-CB 3.28Å; N316-T329 WeakPolarHBondContact OD1-CB 3.41Å; N316-T329 PolarHBondContact OD1-OG1 3.37Å
317	S	93.7	Very high	92	Very high	57 Å²	57	61.5 Å²	61.5	40%	0.399	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	142.3	169.7	61.6	0	0	0	0	109.5	A327 E328	S317-A327 WeakPolarHBondContact O-CA 3.49Å; S317-E328 PolarHBondContact N-O 3.17Å; S317-E328 PolarHBondContact O-N 2.99Å; S317-E328 VanDerWaalsContact O-O 3.14Å; S317-E328 WeakPolarHBondContact OG-CB 3.34Å; S317-E328 PolarHBondContact OG-O 3.45Å
318	T	93.9	Very high	92.4	Very high	91 Å²	91	62.2 Å²	62.2	56%	0.558	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.7	137.2	-178.1	56	0	0	0	0	110.2	A327	T318-A327 HydrophobicContact CG2-CB 3.93Å
319	I	93.6	Very high	92.9	Very high	117 Å²	117	53.8 Å²	53.8	60%	0.6	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.6	175	-59.6	172.1	0	0	0	107.3	K326	I319-K326 HydrophobicContact CB-CB 4.43Å; I319-K326 PolarHBondContact N-O 3.23Å; I319-K326 PolarHBondContact O-N 3.35Å
320	D	91.8	Very high	93.4	Very high	96 Å²	96	53.9 Å²	53.9	51%	0.513	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	126.4	170.7	-168.6	95.3	0	0	0	109.3	H322 R323 L325	D320-H322 PolarHBondContact OD2-N 3.18Å; D320-R323 WeakPolarHBondContact OD1-CA 3.48Å; D320-R323 PolarHBondContact OD2-N 3.39Å; D320-L325 HydrophobicContact CB-CD2 4.45Å
321	D	90.1	Very high	93.8	Very high	27 Å²	27	50.4 Å²	50.4	14%	0.144	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	87.9	173.7	-176.7	2.6	0	0	0	107.2	Y249 R323 D324 K326	Y249-D321 VanDerWaalsContact CE2-O 3.32Å; Y249-D321 WeakPolarHBondContact CE2-O 3.42Å; Y249-D321 PolarHBondContact OH-OD1 2.95Å; Y249-D321 PolarHBondContact OH-OD2 3.2Å; D321-R323 VanDerWaalsContact C-N 3.34Å; D321-R323 PolarHBondContact O-N 3.43Å; D321-D324 PolarHBondContact N-O 2.67Å; D321-D324 PolarHBondContact O-N 3.02Å; D321-D324 VanDerWaalsContact O-N 3.11Å; D321-K326 VanDerWaalsContact OD2-CE 3.27Å; D321-K326 WeakPolarHBondContact OD2-CE 3.26Å; D321-K326 IonicContact OD2-NZ 3.93Å; D321-K326 PolarHBondContact OD2-NZ 3.29Å
322	H	91.3	Very high	93.9	Very high	52 Å²	52	49.5 Å²	49.5	24%	0.241	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	51.9	-178.2	-55.2	85.8	0	0	0	112.1	F158 E221 Y249 D320 D324	F158-H322 HydrophobicContact CE2-CB 3.88Å; F158-H322 AromaticContact CE2-CD2 3.59Å; F158-H322 AromaticContact CE2-CG 3.7Å; F158-H322 HydrophobicContact CZ-CB 4.44Å; F158-H322 AromaticContact CZ-CD2 3.36Å; F158-H322 WeakPolarHBondContact CZ-CD2 3.35Å; F158-H322 AromaticContact CZ-CG 3.98Å; F158-H322 AromaticContact CZ-NE2 3.86Å; E221-H322 IonicContact OE1-CD2 3.87Å; E221-H322 PolarHBondContact OE1-CD2 3.33Å; Y249-H322 HydrophobicContact CD2-CB 4.42Å; Y249-H322 HydrophobicContact CE2-CB 4.33Å; D320-H322 PolarHBondContact OD2-N 3.18Å; H322-D324 PolarHBondContact O-N 3.17Å; H322-D324 VanDerWaalsContact O-N 3.14Å
323	R	90.5	Very high	94	Very high	58 Å²	58	49 Å²	49	22%	0.219	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	-22.9	-176.2	-49.8	-64.6	-111.2	-96.8	1.5	116	E153 I248 F286 R293 D320 D321	E153-R323 IonicContact OE1-CZ 2.79Å; E153-R323 VanDerWaalsContact OE1-CZ 3.25Å; E153-R323 IonicContact OE1-NH1 2.58Å; E153-R323 PolarHBondContact OE1-NH1 3.11Å; E153-R323 IonicContact OE1-NH2 2.91Å; E153-R323 PolarHBondContact OE1-NH2 3.33Å; E153-R323 IonicContact OE2-CZ 3.16Å; E153-R323 IonicContact OE2-NH2 3.92Å; E153-R323 PolarHBondContact OE2-NH2 3.25Å; I248-R323 HydrophobicContact CG2-CB 4.04Å; I248-R323 HydrophobicContact CG2-CG 3.72Å; F286-R323 HydrophobicContact CB-CB 3.91Å; F286-R323 WeakPolarHBondContact CB-O 3.33Å; F286-R323 HydrophobicContact CD1-CB 4.03Å; F286-R323 HydrophobicContact CD2-CB 4Å; F286-R323 HydrophobicContact CG-CB 3.7Å; R293-R323 PolarHBondContact NH1-O 3.31Å; R293-R323 PolarHBondContact NH2-O 3.48Å; D320-R323 WeakPolarHBondContact OD1-CA 3.48Å; D320-R323 PolarHBondContact OD2-N 3.39Å; D321-R323 VanDerWaalsContact C-N 3.34Å; D321-R323 PolarHBondContact O-N 3.43Å
324	D	92.2	Very high	93.9	Very high	10 Å²	10	54 Å²	54	5%	0.053	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	141.7	168.9	-77.3	13.5	0	0	0	108.7	Y249 K255 F286 D321 H322	Y249-D324 HydrophobicContact CD2-CB 3.83Å; Y249-D324 WeakPolarHBondContact CD2-OD2 3.46Å; Y249-D324 HydrophobicContact CE2-CB 4.18Å; K255-D324 IonicContact NZ-OD1 3.87Å; F286-D324 VanDerWaalsContact CB-OD1 3.32Å; F286-D324 WeakPolarHBondContact CB-OD1 3.36Å; F286-D324 PolarHBondContact N-OD1 3.29Å; D321-D324 PolarHBondContact N-O 2.67Å; D321-D324 PolarHBondContact O-N 3.02Å; D321-D324 VanDerWaalsContact O-N 3.11Å; H322-D324 PolarHBondContact O-N 3.17Å; H322-D324 VanDerWaalsContact O-N 3.14Å
325	L	93.7	Very high	93.8	Very high	35 Å²	35	55 Å²	55	18%	0.183	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	122.7	-176.3	-70.2	173	0	0	0	110.5	L284 D320	L284-L325 HydrophobicContact CB-CB 4.28Å; L284-L325 PolarHBondContact N-O 2.69Å; L284-L325 PolarHBondContact O-N 2.9Å; D320-L325 HydrophobicContact CB-CD2 4.45Å
326	K	94.6	Very high	93.8	Very high	100 Å²	100	51.2 Å²	51.2	44%	0.435	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	107.6	161.2	-70.6	174.9	-170.9	158.2	0	107.3	L283 I319 D321	L283-K326 HydrophobicContact CD1-CG 3.79Å; I319-K326 HydrophobicContact CB-CB 4.43Å; I319-K326 PolarHBondContact N-O 3.23Å; I319-K326 PolarHBondContact O-N 3.35Å; D321-K326 VanDerWaalsContact OD2-CE 3.27Å; D321-K326 WeakPolarHBondContact OD2-CE 3.26Å; D321-K326 IonicContact OD2-NZ 3.93Å; D321-K326 PolarHBondContact OD2-NZ 3.29Å
327	A	95.3	Very high	93.7	Very high	6 Å²	6	50.5 Å²	50.5	5%	0.05	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	137.9	-176	0	0	0	0	0	110.8	R281 G282 L284 I295 S317 T318	R281-A327 CarbonylContact C-O 3.57Å; R281-A327 WeakPolarHBondContact CA-O 3.13Å; G282-A327 PolarHBondContact N-O 2.87Å; G282-A327 PolarHBondContact O-N 2.97Å; L284-A327 HydrophobicContact CD1-CB 3.51Å; I295-A327 HydrophobicContact CB-CB 4.35Å; I295-A327 HydrophobicContact CD1-CB 4.17Å; I295-A327 HydrophobicContact CG2-CB 3.71Å; S317-A327 WeakPolarHBondContact O-CA 3.49Å; T318-A327 HydrophobicContact CG2-CB 3.93Å
328	E	95.9	Very high	93.4	Very high	48 Å²	48	51.4 Å²	51.4	22%	0.224	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	130.1	173.4	177.8	170.2	-141.7	0	0	108.7	C280 R281 S317 I330	C280-E328 CarbonylContact O-C 3.56Å; C280-E328 VanDerWaalsContact O-CA 3.25Å; C280-E328 WeakPolarHBondContact O-CA 3.27Å; R281-E328 HydrophobicContact CG-CB 4.14Å; R281-E328 HydrophobicContact CG-CG 3.91Å; R281-E328 IonicContact CZ-OE1 3.43Å; R281-E328 VanDerWaalsContact CZ-OE1 3.27Å; R281-E328 IonicContact NE-OE1 2.8Å; R281-E328 PolarHBondContact NE-OE1 3.26Å; R281-E328 IonicContact NE-OE2 3.61Å; R281-E328 IonicContact NH2-OE1 3.51Å; R281-E328 PolarHBondContact NH2-OE1 3.26Å; S317-E328 PolarHBondContact N-O 3.17Å; S317-E328 PolarHBondContact O-N 2.99Å; S317-E328 VanDerWaalsContact O-O 3.14Å; S317-E328 WeakPolarHBondContact OG-CB 3.34Å; S317-E328 PolarHBondContact OG-O 3.45Å; E328-I330 HydrophobicContact CG-CG1 4.45Å
329	T	96.5	Very high	93.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	129.7	176.4	-176.4	0	0	0	0	109.3	C280 I295 W297 Q314 T315 N316	C280-T329 HydrophobicContact CB-CG2 3.75Å; C280-T329 PolarHBondContact N-O 3.14Å; C280-T329 PolarHBondContact O-N 3.27Å; I295-T329 HydrophobicContact CD1-CG2 3.69Å; I295-T329 HydrophobicContact CG1-CG2 3.59Å; W297-T329 PolarHBondContact NE1-O 3.16Å; Q314-T329 VanDerWaalsContact CG-OG1 3.24Å; Q314-T329 WeakPolarHBondContact CG-OG1 3.38Å; T315-T329 CarbonylContact O-C 3.58Å; T315-T329 WeakPolarHBondContact O-CA 3.48Å; N316-T329 VanDerWaalsContact OD1-CB 3.28Å; N316-T329 WeakPolarHBondContact OD1-CB 3.41Å; N316-T329 PolarHBondContact OD1-OG1 3.37Å
330	I	96.7	Very high	93.1	Very high	47 Å²	47	47.6 Å²	47.6	24%	0.241	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	118.4	-178.9	-51.5	-177.2	0	0	0	107.7	H277 L278 T279 Q314 T315 E328 N332	H277-I330 HydrophobicContact CB-CG2 4Å; L278-I330 CarbonylContact O-C 3.5Å; L278-I330 WeakPolarHBondContact O-CA 3.43Å; T279-I330 HydrophobicContact CG2-CD1 4.36Å; T279-I330 HydrophobicContact CG2-CG1 4.18Å; T279-I330 HydrophobicContact CG2-CG2 4.43Å; Q314-I330 WeakPolarHBondContact CA-O 3.17Å; T315-I330 PolarHBondContact N-O 2.81Å; T315-I330 PolarHBondContact O-N 3.5Å; E328-I330 HydrophobicContact CG-CG1 4.45Å; I330-N332 WeakPolarHBondContact CG2-OD1 2.92Å
331	L	96.6	Very high	93.1	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	114.4	168.9	179.4	67.7	0	0	0	108.4	H277 L278 W297 V299 V304 F312 I333 F345	H277-L331 WeakPolarHBondContact CA-O 3.34Å; L278-L331 HydrophobicContact CB-CB 4.28Å; L278-L331 HydrophobicContact CD1-CD2 4.33Å; L278-L331 PolarHBondContact N-O 2.84Å; L278-L331 PolarHBondContact O-N 3.01Å; W297-L331 HydrophobicContact CB-CB 4.3Å; W297-L331 HydrophobicContact CB-CD1 4.32Å; W297-L331 HydrophobicContact CB-CD2 4.29Å; W297-L331 HydrophobicContact CD2-CB 3.91Å; W297-L331 HydrophobicContact CD2-CD2 4.2Å; W297-L331 HydrophobicContact CE3-CD2 4.25Å; W297-L331 HydrophobicContact CG-CB 3.71Å; W297-L331 HydrophobicContact CG-CD2 4.25Å; W297-L331 HydrophobicContact CG-CG 4.42Å; V299-L331 HydrophobicContact CG2-CD2 4.26Å; V304-L331 HydrophobicContact CG1-CD1 4.41Å; V304-L331 HydrophobicContact CG2-CD1 3.62Å; F312-L331 HydrophobicContact CD1-CD1 4.4Å; L331-I333 HydrophobicContact CD2-CD1 4.23Å; L331-I333 HydrophobicContact CD2-CG1 4.24Å; L331-I333 HydrophobicContact CG-CG1 4.08Å; L331-F345 HydrophobicContact CD2-CD1 3.7Å; L331-F345 HydrophobicContact CD2-CE1 4.22Å
332	N	95.1	Very high	93.1	Very high	29 Å²	29	50.2 Å²	50.2	16%	0.155	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	124.1	172.9	-50.4	-44.3	0	0	0	108.5	H277 F312 S313 I330	H277-N332 PolarHBondContact ND1-OD1 3.02Å; F312-N332 WeakPolarHBondContact CA-O 3.34Å; S313-N332 PolarHBondContact N-O 2.8Å; S313-N332 PolarHBondContact O-N 3.42Å; S313-N332 WeakPolarHBondContact OG-CB 3.38Å; S313-N332 PolarHBondContact OG-ND2 2.99Å; I330-N332 WeakPolarHBondContact CG2-OD1 2.92Å
333	I	95.1	Very high	93.1	Very high	1 Å²	1	51 Å²	51	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	109.4	175.9	-49.2	174.8	0	0	0	106.3	D275 V276 L278 F312 L331 V336 F345 L362	D275-I333 WeakPolarHBondContact CA-O 3.28Å; V276-I333 PolarHBondContact N-O 3.44Å; V276-I333 PolarHBondContact O-N 2.73Å; L278-I333 HydrophobicContact CD1-CD1 4.05Å; L278-I333 HydrophobicContact CG-CD1 4.42Å; F312-I333 HydrophobicContact CD1-CB 4.39Å; F312-I333 HydrophobicContact CD1-CG1 3.87Å; F312-I333 HydrophobicContact CD1-CG2 4.13Å; F312-I333 HydrophobicContact CE1-CB 4.23Å; F312-I333 HydrophobicContact CE1-CD1 4.1Å; F312-I333 HydrophobicContact CE1-CG1 3.81Å; F312-I333 HydrophobicContact CE1-CG2 3.59Å; F312-I333 HydrophobicContact CZ-CG2 4.17Å; L331-I333 HydrophobicContact CD2-CD1 4.23Å; L331-I333 HydrophobicContact CD2-CG1 4.24Å; L331-I333 HydrophobicContact CG-CG1 4.08Å; I333-V336 HydrophobicContact CB-CG2 4.14Å; I333-V336 HydrophobicContact CG2-CG2 3.76Å; I333-F345 HydrophobicContact CD1-CD1 4.15Å; I333-F345 HydrophobicContact CD1-CE1 3.58Å; I333-F345 HydrophobicContact CD1-CZ 3.79Å; I333-L362 HydrophobicContact CD1-CD1 4.27Å
334	R	93.6	Very high	93.2	Very high	146 Å²	146	52.4 Å²	52.4	55%	0.551	25%	0.252	S	S	*	.	S	Bend	trans	-84.2	142	175.3	-65.5	-177.7	-179.7	177.1	1.2	110.6	D275 R311	D275-R334 VanDerWaalsContact OD1-CA 3.26Å; D275-R334 WeakPolarHBondContact OD1-CA 3.44Å; R311-R334 HydrophobicContact CB-CB 4.34Å; R311-R334 WeakPolarHBondContact CB-O 3.38Å; R311-R334 WeakPolarHBondContact CD-O 3.02Å; R311-R334 PolarHBondContact NH1-O 2.93Å; R311-R334 PolarHBondContact O-N 3.03Å
335	D	91.9	Very high	93.4	Very high	71 Å²	71	51.9 Å²	51.9	38%	0.38	25%	0.25	S	C	.	.	S	Bend	trans	48	68.5	175.1	-173.4	31	0	0	0	112	S273 D275 R311 Q337	S273-D335 WeakPolarHBondContact CA-OD1 3.43Å; D275-D335 PolarHBondContact OD1-N 3.01Å; R311-D335 PolarHBondContact NH1-O 3.04Å; D335-Q337 VanDerWaalsContact CG-NE2 3.28Å; D335-Q337 PolarHBondContact O-N 3.37Å; D335-Q337 PolarHBondContact O-NE2 3.02Å; D335-Q337 PolarHBondContact OD2-NE2 3.15Å
336	V	92.8	Very high	93.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.25	C	C	.	.			trans	-60.2	122.4	-177.5	172.3	0	0	0	0	110.5	V270 S273 S274 V276 I333 D340	V270-V336 HydrophobicContact CG2-CG1 4.38Å; S273-V336 PolarHBondContact N-O 2.85Å; S274-V336 WeakPolarHBondContact O-CG2 3.44Å; S274-V336 PolarHBondContact O-N 2.99Å; V276-V336 HydrophobicContact CB-CG2 3.95Å; V276-V336 HydrophobicContact CG2-CG2 3.63Å; I333-V336 HydrophobicContact CB-CG2 4.14Å; I333-V336 HydrophobicContact CG2-CG2 3.76Å; V336-D340 HydrophobicContact CG1-CB 4.29Å
337	Q	92.1	Very high	93.6	Very high	70 Å²	70	46.9 Å²	46.9	33%	0.327	23%	0.229	S	C	.	.			trans	-94.6	164.3	-179.9	-57.7	-63.4	-30.2	0	0	111.7	D335 E339 D340	D335-Q337 VanDerWaalsContact CG-NE2 3.28Å; D335-Q337 PolarHBondContact O-N 3.37Å; D335-Q337 PolarHBondContact O-NE2 3.02Å; D335-Q337 PolarHBondContact OD2-NE2 3.15Å; Q337-E339 WeakPolarHBondContact CB-OE2 3.38Å; Q337-E339 PolarHBondContact O-N 2.75Å; Q337-D340 PolarHBondContact N-OD2 3.11Å; Q337-D340 WeakPolarHBondContact O-CB 3.12Å; Q337-D340 PolarHBondContact O-N 3.03Å; Q337-D340 VanDerWaalsContact O-N 3.11Å
338	S	89.3	Confident	93.7	Very high	75 Å²	75	47.3 Å²	47.3	52%	0.524	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-65.2	-29.7	178.8	-61.3	0	0	0	0	112.1	D340 L341	S338-D340 VanDerWaalsContact C-N 3.29Å; S338-D340 PolarHBondContact O-N 2.75Å; S338-L341 WeakPolarHBondContact O-CB 3.34Å; S338-L341 PolarHBondContact O-N 3.28Å
339	E	90.5	Very high	93.7	Very high	127 Å²	127	45 Å²	45	59%	0.593	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-69.3	-28.9	175.8	-55.2	77.2	-165.2	0	0	111.9	Q337 L341 Q342	Q337-E339 WeakPolarHBondContact CB-OE2 3.38Å; Q337-E339 PolarHBondContact O-N 2.75Å; E339-L341 PolarHBondContact O-N 3.43Å; E339-Q342 PolarHBondContact O-N 2.89Å
340	D	90	Very high	93.7	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-68.1	-23.1	179.3	-64.4	-42	0	0	0	111.7	R311 V336 Q337 S338 Q342 R343 F345	R311-D340 IonicContact CZ-OD2 3.59Å; R311-D340 IonicContact NH1-OD2 2.7Å; R311-D340 PolarHBondContact NH1-OD2 3.33Å; R311-D340 IonicContact NH2-OD1 3.19Å; R311-D340 PolarHBondContact NH2-OD1 3.4Å; R311-D340 IonicContact NH2-OD2 3.54Å; R311-D340 PolarHBondContact NH2-OD2 2.84Å; V336-D340 HydrophobicContact CG1-CB 4.29Å; Q337-D340 PolarHBondContact N-OD2 3.11Å; Q337-D340 WeakPolarHBondContact O-CB 3.12Å; Q337-D340 PolarHBondContact O-N 3.03Å; Q337-D340 VanDerWaalsContact O-N 3.11Å; S338-D340 VanDerWaalsContact C-N 3.29Å; S338-D340 PolarHBondContact O-N 2.75Å; D340-Q342 PolarHBondContact O-N 3.27Å; D340-R343 PolarHBondContact O-N 3.06Å; D340-R343 WeakPolarHBondContact OD1-CD 3.42Å; D340-R343 IonicContact OD1-CZ 2.8Å; D340-R343 IonicContact OD1-NE 3.33Å; D340-R343 IonicContact OD1-NH1 2.96Å; D340-R343 PolarHBondContact OD1-NH1 2.87Å; D340-F345 HydrophobicContact CB-CZ 4.44Å; D340-F345 WeakPolarHBondContact O-CE2 3.47Å
341	L	90.9	Very high	93.6	Very high	21 Å²	21	47.8 Å²	47.8	11%	0.11	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-64	-25	174.2	-65.6	165.1	0	0	0	113	V270 T272 S338 E339 Q361 L362 E364	V270-L341 HydrophobicContact CG2-CD2 3.61Å; T272-L341 HydrophobicContact CG2-CD1 4.39Å; S338-L341 WeakPolarHBondContact O-CB 3.34Å; S338-L341 PolarHBondContact O-N 3.28Å; E339-L341 PolarHBondContact O-N 3.43Å; L341-Q361 PolarHBondContact O-NE2 2.96Å; L341-L362 HydrophobicContact CD2-CB 3.97Å; L341-E364 HydrophobicContact CD1-CB 4.44Å
342	Q	90.1	Very high	93.4	Very high	158 Å²	158	50.2 Å²	50.2	74%	0.738	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-98.5	-2.2	179.7	-59.9	-60.8	-36.3	0	0	112.8	E339 D340	E339-Q342 PolarHBondContact O-N 2.89Å; D340-Q342 PolarHBondContact O-N 3.27Å
343	R	91.9	Very high	93.4	Very high	67 Å²	67	57.7 Å²	57.7	25%	0.253	27%	0.274	S	S	.	.	S	Bend	trans	-80	151.5	179.2	-74.4	-171.1	157.6	151.2	-1.3	112	V299 D300 D340 F345	V299-R343 HydrophobicContact CG1-CB 4.36Å; D300-R343 WeakPolarHBondContact OD2-CD 3.42Å; D300-R343 WeakPolarHBondContact OD2-CG 3.48Å; D300-R343 IonicContact OD2-NE 3.68Å; D300-R343 PolarHBondContact OD2-NE 3.27Å; D340-R343 PolarHBondContact O-N 3.06Å; D340-R343 WeakPolarHBondContact OD1-CD 3.42Å; D340-R343 IonicContact OD1-CZ 2.8Å; D340-R343 IonicContact OD1-NE 3.33Å; D340-R343 IonicContact OD1-NH1 2.96Å; D340-R343 PolarHBondContact OD1-NH1 2.87Å; R343-F345 HydrophobicContact CB-CE2 3.91Å; R343-F345 HydrophobicContact CB-CZ 3.93Å
344	N	93.2	Very high	93.3	Very high	88 Å²	88	58.9 Å²	58.9	47%	0.471	29%	0.287	S	S	.	.			trans	-95.9	107.4	177.6	-75.1	-35.1	0	0	0	110.6	D300	D300-N344 PolarHBondContact N-O 3.36Å; D300-N344 PolarHBondContact OD1-N 3.49Å
345	F	95.3	Very high	93.4	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	120.6	173.2	-59.1	-79.8	0	0	0	109.8	L278 W297 V299 F312 L331 I333 D340 R343 W359 V360 L362	L278-F345 HydrophobicContact CD1-CB 4.1Å; L278-F345 HydrophobicContact CD1-CD1 4.32Å; L278-F345 HydrophobicContact CD1-CD2 4.48Å; L278-F345 HydrophobicContact CD1-CG 4.03Å; W297-F345 HydrophobicContact CE3-CB 4.44Å; W297-F345 HydrophobicContact CZ3-CB 4.1Å; V299-F345 HydrophobicContact CB-CD1 4.45Å; V299-F345 HydrophobicContact CB-CE1 4.38Å; V299-F345 HydrophobicContact CG1-CD1 4.06Å; V299-F345 HydrophobicContact CG1-CE1 3.65Å; V299-F345 HydrophobicContact CG1-CZ 4.33Å; V299-F345 HydrophobicContact CG2-CD1 3.9Å; V299-F345 HydrophobicContact CG2-CE1 3.92Å; F312-F345 AromaticContact CE1-CE1 3.81Å; F312-F345 HydrophobicContact CE1-CE1 3.81Å; F312-F345 HydrophobicContact CE1-CZ 4.35Å; L331-F345 HydrophobicContact CD2-CD1 3.7Å; L331-F345 HydrophobicContact CD2-CE1 4.22Å; I333-F345 HydrophobicContact CD1-CD1 4.15Å; I333-F345 HydrophobicContact CD1-CE1 3.58Å; I333-F345 HydrophobicContact CD1-CZ 3.79Å; D340-F345 HydrophobicContact CB-CZ 4.44Å; D340-F345 WeakPolarHBondContact O-CE2 3.47Å; R343-F345 HydrophobicContact CB-CE2 3.91Å; R343-F345 HydrophobicContact CB-CZ 3.93Å; F345-W359 CarbonylContact O-C 3.58Å; F345-W359 VanDerWaalsContact O-CA 3.26Å; F345-W359 WeakPolarHBondContact O-CA 3.26Å; F345-V360 HydrophobicContact CB-CB 4.37Å; F345-V360 PolarHBondContact O-N 3.38Å; F345-L362 HydrophobicContact CD2-CD1 4.09Å; F345-L362 HydrophobicContact CD2-CG 3.97Å; F345-L362 HydrophobicContact CE2-CD1 3.4Å; F345-L362 HydrophobicContact CE2-CG 3.73Å; F345-L362 HydrophobicContact CZ-CD1 3.93Å
346	T	96.8	Very high	93.6	Very high	30 Å²	30	55.7 Å²	55.7	18%	0.184	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.5	-179.3	-55.4	0	0	0	0	110.7	W297 T298 A357 R358	W297-T346 CarbonylContact C-O 3.58Å; W297-T346 WeakPolarHBondContact CA-O 3.47Å; W297-T346 VanDerWaalsContact CE3-C 3.42Å; T298-T346 PolarHBondContact N-O 2.94Å; T298-T346 PolarHBondContact O-N 3.15Å; T298-T346 WeakPolarHBondContact OG1-CB 3.38Å; T298-T346 PolarHBondContact OG1-O 2.76Å; T346-A357 HydrophobicContact CG2-CB 3.87Å; T346-R358 WeakPolarHBondContact CA-O 3.36Å
347	C	96.9	Very high	93.7	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	133.8	167	179.3	0	0	0	0	109.3	I259 C280 W297 A357 R358	I259-C347 WeakPolarHBondContact CD1-O 3.46Å; C280-C347 HydrophobicContact CB-CB 3.58Å; C280-C347 WeakPolarHBondContact CB-SG 3.25Å; C280-C347 WeakPolarHBondContact SG-CB 3.47Å; C280-C347 CovalentContact SG-SG 2.01Å; C280-C347 PolarHBondContact SG-SG 2.95Å; W297-C347 HydrophobicContact CD2-CB 4.07Å; W297-C347 HydrophobicContact CE3-CB 3.97Å; W297-C347 HydrophobicContact CH2-CB 3.91Å; W297-C347 HydrophobicContact CZ2-CB 4.02Å; W297-C347 HydrophobicContact CZ3-CB 3.89Å; C347-A357 CarbonylContact O-C 3.58Å; C347-A357 VanDerWaalsContact O-CA 3.28Å; C347-A357 WeakPolarHBondContact O-CA 3.46Å; C347-R358 PolarHBondContact N-O 3.34Å; C347-R358 PolarHBondContact O-N 2.63Å
348	S	96.4	Very high	93.9	Very high	14 Å²	14	57.4 Å²	57.4	10%	0.098	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	144	179.6	-61.3	0	0	0	0	111.4	I295 W296 M356	I295-S348 WeakPolarHBondContact CA-O 3.49Å; W296-S348 VanDerWaalsContact CE2-CB 3.49Å; W296-S348 VanDerWaalsContact CZ2-CB 3.46Å; W296-S348 PolarHBondContact N-O 3.2Å; W296-S348 PolarHBondContact O-N 2.86Å; S348-M356 WeakPolarHBondContact CA-O 3.37Å
349	V	96.8	Very high	94.2	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	143.1	171.4	-67.4	0	0	0	0	109.4	P257 I259 L284 E294 I295 S355 M356	P257-V349 HydrophobicContact CB-CB 4.22Å; P257-V349 HydrophobicContact CB-CG2 3.81Å; P257-V349 HydrophobicContact CG-CG2 4.29Å; I259-V349 HydrophobicContact CD1-CG2 4.19Å; I259-V349 HydrophobicContact CG1-CB 4.49Å; I259-V349 HydrophobicContact CG1-CG1 4.05Å; I259-V349 HydrophobicContact CG1-CG2 3.65Å; L284-V349 HydrophobicContact CD1-CG1 4.37Å; L284-V349 HydrophobicContact CD2-CB 4.28Å; L284-V349 HydrophobicContact CG-CB 4.45Å; E294-V349 CarbonylContact O-C 3.53Å; E294-V349 WeakPolarHBondContact O-CA 3.49Å; I295-V349 HydrophobicContact CB-CG1 4.02Å; I295-V349 HydrophobicContact CD1-CG1 3.77Å; I295-V349 HydrophobicContact CG1-CG1 3.62Å; V349-S355 CarbonylContact O-C 3.47Å; V349-S355 WeakPolarHBondContact O-CA 3.35Å; V349-S355 WeakPolarHBondContact O-CB 3.43Å; V349-M356 HydrophobicContact CG2-CB 3.82Å; V349-M356 PolarHBondContact N-O 3.07Å; V349-M356 PolarHBondContact O-N 2.92Å
350	R	95.6	Very high	94.5	Very high	102 Å²	102	52.9 Å²	52.9	39%	0.385	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	144.1	175.7	-177.7	178.6	73.7	91.9	1.7	111.5	R293 E294 W296 G354	R293-R350 WeakPolarHBondContact CA-O 3.34Å; E294-R350 HydrophobicContact CG-CB 4.17Å; E294-R350 PolarHBondContact N-O 2.87Å; E294-R350 PolarHBondContact O-N 2.87Å; E294-R350 IonicContact OE1-CZ 3.8Å; E294-R350 IonicContact OE1-NE 3.55Å; E294-R350 PolarHBondContact OE1-NE 2.88Å; E294-R350 IonicContact OE1-NH2 3.59Å; E294-R350 PolarHBondContact OE1-NH2 2.76Å; W296-R350 HydrophobicContact CH2-CB 3.65Å; W296-R350 HydrophobicContact CZ3-CB 3.69Å; R350-G354 WeakPolarHBondContact CA-O 3.47Å
351	N	95.2	Very high	94.6	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.021	28%	0.279	C	S	.	.			trans	-136.3	-172.4	163.3	71.1	5.6	0	0	0	109.3	K255 P257 I287 R293 R353 G354	K255-N351 PolarHBondContact O-ND2 3.46Å; P257-N351 WeakPolarHBondContact CD-OD1 3.27Å; I287-N351 HydrophobicContact CD1-CB 4.24Å; R293-N351 HydrophobicContact CG-CB 3.73Å; N351-R353 PolarHBondContact O-N 3.37Å; N351-R353 WeakPolarHBondContact OD1-CB 3.4Å; N351-R353 PolarHBondContact OD1-N 2.93Å; N351-G354 PolarHBondContact N-O 2.82Å; N351-G354 VanDerWaalsContact O-O 3.14Å; N351-G354 PolarHBondContact OD1-N 3.33Å; N351-G354 PolarHBondContact OD1-O 2.91Å
352	A	93.3	Very high	94.7	Very high	50 Å²	50	54.3 Å²	54.3	41%	0.413	28%	0.275	S	S	.	.	S	Bend	trans	-68.9	-14.5	-179.3	0	0	0	0	0	115.1	I287 K290	I287-A352 HydrophobicContact CD1-CB 3.8Å; K290-A352 HydrophobicContact CB-CB 3.4Å; K290-A352 VanDerWaalsContact CB-CB 3.4Å; K290-A352 HydrophobicContact CD-CB 3.81Å; K290-A352 HydrophobicContact CG-CB 4.23Å
353	R	93.2	Very high	94.8	Very high	186 Å²	186	52.7 Å²	52.7	70%	0.702	27%	0.267	S	S	*	.	S	Bend	trans	-86.3	-40.2	176.7	-82.7	-59	-146.4	-173.1	7.4	112.6	K255 I287 N351	K255-R353 HydrophobicContact CB-CG 4.14Å; I287-R353 HydrophobicContact CD1-CB 4.1Å; I287-R353 HydrophobicContact CD1-CG 3.67Å; I287-R353 HydrophobicContact CG1-CG 4.47Å; N351-R353 PolarHBondContact O-N 3.37Å; N351-R353 WeakPolarHBondContact OD1-CB 3.4Å; N351-R353 PolarHBondContact OD1-N 2.93Å
354	G	93.8	Very high	94.6	Very high	26 Å²	26	54.5 Å²	54.5	27%	0.268	28%	0.278	S	S	.	.			trans	-176.1	-167.8	-176.4	0	0	0	0	0	113.3	P257 R350 N351	P257-G354 WeakPolarHBondContact CG-O 3.48Å; R350-G354 WeakPolarHBondContact CA-O 3.47Å; N351-G354 PolarHBondContact N-O 2.82Å; N351-G354 VanDerWaalsContact O-O 3.14Å; N351-G354 PolarHBondContact OD1-N 3.33Å; N351-G354 PolarHBondContact OD1-O 2.91Å
355	S	95.4	Very high	94.2	Very high	90 Å²	90	54.1 Å²	54.1	63%	0.629	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.8	153.8	176.4	58.8	0	0	0	0	110.9	V349	V349-S355 CarbonylContact O-C 3.47Å; V349-S355 WeakPolarHBondContact O-CA 3.35Å; V349-S355 WeakPolarHBondContact O-CB 3.43Å
356	M	96	Very high	93.3	Very high	61 Å²	61	60 Å²	60	30%	0.3	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	139.2	173.3	-172.3	-178.1	-174.7	0	0	108.4	I259 S348 V349 R358	I259-M356 HydrophobicContact CB-SD 4.25Å; I259-M356 HydrophobicContact CD1-CG 4.37Å; I259-M356 HydrophobicContact CG1-CG 4.37Å; I259-M356 HydrophobicContact CG1-SD 4.31Å; I259-M356 PolarHBondContact N-SD 2.9Å; I259-M356 VanDerWaalsContact N-SD 3.36Å; S348-M356 WeakPolarHBondContact CA-O 3.37Å; V349-M356 HydrophobicContact CG2-CB 3.82Å; V349-M356 PolarHBondContact N-O 3.07Å; V349-M356 PolarHBondContact O-N 2.92Å; M356-R358 HydrophobicContact CE-CG 4.47Å
357	A	96.3	Very high	91.7	Very high	56 Å²	56	62.9 Å²	62.9	46%	0.463	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	144.1	177.9	0	0	0	0	0	110.5	T346 C347	T346-A357 HydrophobicContact CG2-CB 3.87Å; C347-A357 CarbonylContact O-C 3.58Å; C347-A357 VanDerWaalsContact O-CA 3.28Å; C347-A357 WeakPolarHBondContact O-CA 3.46Å
358	R	96.2	Very high	90.1	Very high	49 Å²	49	69.4 Å²	69.4	19%	0.185	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	128.4	173.8	-73.3	-171.6	176.2	170.7	5.7	109.8	I259 P262 N264 T346 C347 M356	I259-R358 HydrophobicContact CB-CG 4.33Å; I259-R358 HydrophobicContact CD1-CB 4.12Å; I259-R358 HydrophobicContact CD1-CG 4.06Å; I259-R358 HydrophobicContact CG2-CG 4.37Å; I259-R358 PolarHBondContact O-NH1 3.41Å; I259-R358 PolarHBondContact O-NH2 2.88Å; I259-R358 VanDerWaalsContact O-NH2 3.15Å; P262-R358 WeakPolarHBondContact O-CD 3.17Å; P262-R358 PolarHBondContact O-NH1 3.17Å; N264-R358 HydrophobicContact CB-CG 4.15Å; T346-R358 WeakPolarHBondContact CA-O 3.36Å; C347-R358 PolarHBondContact N-O 3.34Å; C347-R358 PolarHBondContact O-N 2.63Å; M356-R358 HydrophobicContact CE-CG 4.47Å
359	W	94.9	Very high	88.4	Confident	108 Å²	108	72.3 Å²	72.3	41%	0.409	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	157.5	178	67.9	-88.8	0	0	0	111.3	N264 G265 F345 Q361	N264-W359 PolarHBondContact OD1-N 2.92Å; N264-W359 PolarHBondContact OD1-NE1 3.19Å; G265-W359 PolarHBondContact N-O 3.26Å; F345-W359 CarbonylContact O-C 3.58Å; F345-W359 VanDerWaalsContact O-CA 3.26Å; F345-W359 WeakPolarHBondContact O-CA 3.26Å; W359-Q361 HydrophobicContact CZ3-CB 4.03Å
360	V	95.6	Very high	86.8	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	139.2	-174.1	177	0	0	0	0	109	P262 K266 F268 L278 W297 F345	P262-V360 HydrophobicContact CB-CG2 4.18Å; P262-V360 HydrophobicContact CG-CG2 3.37Å; K266-V360 WeakPolarHBondContact O-CA 3.13Å; K266-V360 WeakPolarHBondContact O-CG1 3.34Å; F268-V360 HydrophobicContact CD2-CG1 3.15Å; F268-V360 HydrophobicContact CE2-CB 4.44Å; F268-V360 HydrophobicContact CE2-CG1 3.35Å; F268-V360 HydrophobicContact CE2-CG2 4.19Å; F268-V360 HydrophobicContact CG-CG1 4.25Å; L278-V360 HydrophobicContact CD1-CG1 4.47Å; W297-V360 HydrophobicContact CH2-CG2 3.96Å; W297-V360 HydrophobicContact CZ3-CG2 4.18Å; F345-V360 HydrophobicContact CB-CB 4.37Å; F345-V360 PolarHBondContact O-N 3.38Å
361	Q	92.9	Very high	85.3	Confident	48 Å²	48	77.3 Å²	77.3	22%	0.224	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	139.9	175.2	-165.1	63.4	27.2	0	0	110.5	K266 V267 F268 L341 W359	K266-Q361 PolarHBondContact O-N 2.98Å; V267-Q361 CarbonylContact C-O 2.97Å; V267-Q361 WeakPolarHBondContact CA-O 3.4Å; V267-Q361 HydrophobicContact CG2-CB 4.32Å; F268-Q361 PolarHBondContact N-O 3.21Å; L341-Q361 PolarHBondContact O-NE2 2.96Å; W359-Q361 HydrophobicContact CZ3-CB 4.03Å
362	L	93.6	Very high	83.8	Confident	4 Å²	4	84.2 Å²	84.2	2%	0.021	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	136.4	166.4	-57	-174.7	0	0	0	109.1	F268 V270 L278 I333 L341 F345	F268-L362 HydrophobicContact CB-CD2 4Å; F268-L362 WeakPolarHBondContact O-CA 3.48Å; V270-L362 HydrophobicContact CG1-CD2 3.94Å; V270-L362 HydrophobicContact CG2-CB 4.01Å; L278-L362 HydrophobicContact CD1-CD2 4.19Å; L278-L362 HydrophobicContact CD2-CD2 3.94Å; I333-L362 HydrophobicContact CD1-CD1 4.27Å; L341-L362 HydrophobicContact CD2-CB 3.97Å; F345-L362 HydrophobicContact CD2-CD1 4.09Å; F345-L362 HydrophobicContact CD2-CG 3.97Å; F345-L362 HydrophobicContact CE2-CD1 3.4Å; F345-L362 HydrophobicContact CE2-CG 3.73Å; F345-L362 HydrophobicContact CZ-CD1 3.93Å
363	E	91.3	Very high	82.6	Confident	123 Å²	123	87.8 Å²	87.8	58%	0.575	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.4	143.3	175.6	-170.4	168.1	-159.8	0	0	109.6	V267 F268 P269 V270 E365	V267-E363 HydrophobicContact CG1-CB 3.53Å; V267-E363 WeakPolarHBondContact CG1-OE2 3.39Å; F268-E363 PolarHBondContact O-N 3.05Å; P269-E363 CarbonylContact C-O 3.5Å; P269-E363 VanDerWaalsContact CA-O 3.27Å; P269-E363 WeakPolarHBondContact CA-O 3.26Å; V270-E363 PolarHBondContact N-O 3.31Å; E363-E365 PolarHBondContact O-N 2.99Å
364	E	88.8	Confident	81.5	Confident	105 Å²	105	81 Å²	81	49%	0.491	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	129.1	-178.1	-171.4	165.2	-147.2	0	0	110.9	V270 T272 L341 V366	V270-E364 CarbonylContact O-C 3.58Å; V270-E364 WeakPolarHBondContact O-CA 3.38Å; T272-E364 PolarHBondContact OG1-OE1 2.73Å; L341-E364 HydrophobicContact CD1-CB 4.44Å; E364-V366 PolarHBondContact O-N 3.18Å
365	E	83.6	Confident	80.6	Confident	81 Å²	81	83.6 Å²	83.6	38%	0.379	47%	0.474	S	S	.	.			trans	-69.6	103.5	177.6	-169.6	-170.3	160.4	0	0	109.7	P269 V270 R271 E363 S367	P269-E365 HydrophobicContact CB-CB 4.27Å; P269-E365 HydrophobicContact CB-CG 4.42Å; V270-E365 PolarHBondContact O-N 3.26Å; R271-E365 HydrophobicContact CG-CB 4.17Å; R271-E365 WeakPolarHBondContact CG-OE2 2.96Å; R271-E365 IonicContact CZ-OE1 3.08Å; R271-E365 IonicContact CZ-OE2 2.8Å; R271-E365 IonicContact NE-OE1 3.49Å; R271-E365 IonicContact NE-OE2 3.81Å; R271-E365 PolarHBondContact NE-OE2 3.35Å; R271-E365 IonicContact NH2-OE1 2.87Å; R271-E365 PolarHBondContact NH2-OE1 2.93Å; R271-E365 IonicContact NH2-OE2 3.94Å; R271-E365 PolarHBondContact NH2-OE2 3Å; E363-E365 PolarHBondContact O-N 2.99Å; E365-S367 PolarHBondContact O-N 2.94Å
366	V	76.9	Confident	79.8	Confident	123 Å²	123	81.2 Å²	81.2	75%	0.745	46%	0.463	S	S	*	.			trans	-75.3	96	174.7	-171.6	0	0	0	0	109.1	E364 L368	E364-V366 PolarHBondContact O-N 3.18Å; V366-L368 PolarHBondContact O-N 3.07Å
367	S	63.8	Low	79.2	Confident	90 Å²	90	83.6 Å²	83.6	63%	0.629	48%	0.477	S	S	*	.			trans	-71.3	95.1	170.6	62.4	0	0	0	0	109.5	E365 P369	E365-S367 PolarHBondContact O-N 2.94Å; S367-P369 WeakPolarHBondContact O-CD 3.46Å
368	L	62.1	Low	78.7	Confident	137 Å²	137	82.5 Å²	82.5	72%	0.717	47%	0.47	S	S	*	.			trans	-61.5	119.3	167.8	-78.1	155.5	0	0	0	108.4	V366 S370	V366-L368 PolarHBondContact O-N 3.07Å; L368-S370 PolarHBondContact O-N 2.79Å; L368-S370 PolarHBondContact O-OG 3.41Å
369	P	61.6	Low	78.3	Confident	75 Å²	75	85.1 Å²	85.1	49%	0.487	49%	0.492	S	S	.	.			trans	-73.5	77.4	-177.9	29.9	-33.3	0	0	0	109.8	S367 V371 E372 L373	S367-P369 WeakPolarHBondContact O-CD 3.46Å; P369-V371 PolarHBondContact O-N 2.81Å; P369-V371 VanDerWaalsContact O-N 3.16Å; P369-E372 HydrophobicContact CB-CB 4.27Å; P369-E372 HydrophobicContact CB-CG 4.15Å; P369-E372 PolarHBondContact O-N 3.15Å; P369-E372 VanDerWaalsContact O-N 3.09Å; P369-L373 PolarHBondContact O-N 2.78Å
370	S	62.9	Low	77.9	Confident	93 Å²	93	83.6 Å²	83.6	65%	0.65	49%	0.494	S	S	*	.	H	α-helix	trans	-61.3	-24.9	-179.5	-57.9	0	0	0	0	111.7	L368 G374	L368-S370 PolarHBondContact O-N 2.79Å; L368-S370 PolarHBondContact O-OG 3.41Å; S370-G374 PolarHBondContact O-N 2.83Å; S370-G374 VanDerWaalsContact O-N 3.16Å
371	V	63.5	Low	77.6	Confident	115 Å²	115	89.2 Å²	89.2	70%	0.697	52%	0.524	S	S	*	.	H	α-helix	trans	-71.6	-37	177	-176.8	0	0	0	0	111.7	P369 G374 C375	P369-V371 PolarHBondContact O-N 2.81Å; P369-V371 VanDerWaalsContact O-N 3.16Å; V371-G374 PolarHBondContact O-N 2.68Å; V371-C375 PolarHBondContact O-N 3.39Å; V371-C375 PolarHBondContact O-SG 2.88Å
372	E	65.1	Low	77.5	Confident	149 Å²	149	91.5 Å²	91.5	70%	0.696	54%	0.541	S	S	*	.	H	α-helix	trans	-73.2	-37.1	179.7	-65.8	-150.2	169.4	0	0	112.2	P369 G374 C375 G376	P369-E372 HydrophobicContact CB-CB 4.27Å; P369-E372 HydrophobicContact CB-CG 4.15Å; P369-E372 PolarHBondContact O-N 3.15Å; P369-E372 VanDerWaalsContact O-N 3.09Å; E372-G374 VanDerWaalsContact C-N 3.33Å; E372-G374 PolarHBondContact O-N 3.24Å; E372-C375 PolarHBondContact O-N 2.96Å; E372-G376 PolarHBondContact O-N 2.01Å
373	L	66.6	Low	77.4	Confident	124 Å²	124	96.3 Å²	96.3	65%	0.649	57%	0.566	S	S	*	*	H	α-helix	trans	-63.6	-39.5	171.1	-98.9	83	0	0	0	112	P369 L377	P369-L373 PolarHBondContact O-N 2.78Å; L373-L377 WeakPolarHBondContact O-CG 3.35Å; L373-L377 PolarHBondContact O-N 2.83Å; L373-L377 VanDerWaalsContact O-N 3.14Å
374	G	70.2	Confident	77.4	Confident	44 Å²	44	96.6 Å²	96.6	45%	0.454	57%	0.569	S	S	.	*	H	α-helix	trans	-63.7	-43.7	176.6	0	0	0	0	0	112.9	S370 V371 E372 G378	S370-G374 PolarHBondContact O-N 2.83Å; S370-G374 VanDerWaalsContact O-N 3.16Å; V371-G374 PolarHBondContact O-N 2.68Å; E372-G374 VanDerWaalsContact C-N 3.33Å; E372-G374 PolarHBondContact O-N 3.24Å; G374-G378 PolarHBondContact O-N 2.86Å
375	C	75.6	Confident	77.6	Confident	81 Å²	81	97 Å²	97	55%	0.547	57%	0.574	S	S	.	*	H	α-helix	trans	-67.4	-41.2	177.9	-74.8	0	0	0	0	112.6	V371 E372 G378 V379	V371-C375 PolarHBondContact O-N 3.39Å; V371-C375 PolarHBondContact O-SG 2.88Å; E372-C375 PolarHBondContact O-N 2.96Å; C375-G378 PolarHBondContact O-N 2.89Å; C375-V379 WeakPolarHBondContact O-CG2 3.4Å; C375-V379 PolarHBondContact O-N 2.79Å
376	G	78.6	Confident	77.9	Confident	39 Å²	39	98 Å²	98	40%	0.402	58%	0.581	S	S	.	*	H	α-helix	trans	-62.6	-43.7	177.2	0	0	0	0	0	112.9	E372 T380	E372-G376 PolarHBondContact O-N 2.01Å; G376-T380 WeakPolarHBondContact O-CG2 3.46Å; G376-T380 PolarHBondContact O-N 2.82Å; G376-T380 PolarHBondContact O-OG1 3.04Å
377	L	83.4	Confident	78.5	Confident	112 Å²	112	96.8 Å²	96.8	59%	0.586	57%	0.57	S	S	*	*	H	α-helix	trans	-68.1	-36.3	175.9	-70.3	170.6	0	0	0	112.2	L373 T380 L381	L373-L377 WeakPolarHBondContact O-CG 3.35Å; L373-L377 PolarHBondContact O-N 2.83Å; L373-L377 VanDerWaalsContact O-N 3.14Å; L377-T380 WeakPolarHBondContact CA-OG1 3.41Å; L377-T380 PolarHBondContact O-OG1 2.89Å; L377-L381 WeakPolarHBondContact O-CB 3.43Å; L377-L381 WeakPolarHBondContact O-CG 3.39Å; L377-L381 PolarHBondContact O-N 2.82Å; L377-L381 VanDerWaalsContact O-N 3.12Å
378	G	85	Confident	79.8	Confident	32 Å²	32	98.4 Å²	98.4	33%	0.33	57%	0.566	S	S	.	*	H	α-helix	trans	-63.2	-48.9	176.3	0	0	0	0	0	113.1	G374 C375 T380 L381 V382	G374-G378 PolarHBondContact O-N 2.86Å; C375-G378 PolarHBondContact O-N 2.89Å; G378-T380 PolarHBondContact O-N 3.33Å; G378-L381 PolarHBondContact O-N 2.9Å; G378-V382 WeakPolarHBondContact O-CG2 3.26Å; G378-V382 PolarHBondContact O-N 2.94Å; G378-V382 VanDerWaalsContact O-N 3.08Å
379	V	88.5	Confident	81.1	Confident	105 Å²	105	95.5 Å²	95.5	64%	0.636	55%	0.554	S	S	*	*	H	α-helix	trans	-64.2	-41.5	-179.2	174	0	0	0	0	111.5	C375 V382 L383	C375-V379 WeakPolarHBondContact O-CG2 3.4Å; C375-V379 PolarHBondContact O-N 2.79Å; V379-V382 PolarHBondContact O-N 2.86Å; V379-L383 WeakPolarHBondContact O-CB 3.49Å; V379-L383 PolarHBondContact O-N 2.93Å
380	T	87	Confident	82.3	Confident	75 Å²	75	95.1 Å²	95.1	46%	0.46	55%	0.55	S	S	.	.	H	α-helix	trans	-65.1	-40.9	178.9	50	0	0	0	0	112.2	G376 L377 G378 L383 M384	G376-T380 WeakPolarHBondContact O-CG2 3.46Å; G376-T380 PolarHBondContact O-N 2.82Å; G376-T380 PolarHBondContact O-OG1 3.04Å; L377-T380 WeakPolarHBondContact CA-OG1 3.41Å; L377-T380 PolarHBondContact O-OG1 2.89Å; G378-T380 PolarHBondContact O-N 3.33Å; T380-L383 PolarHBondContact O-N 2.75Å; T380-M384 WeakPolarHBondContact O-CG 3.25Å; T380-M384 PolarHBondContact O-N 2.81Å
381	L	89.1	Confident	83.4	Confident	119 Å²	119	95.6 Å²	95.6	62%	0.623	54%	0.538	S	S	*	.	H	α-helix	trans	-63.6	-42.7	175	-76.2	170.5	0	0	0	112.5	L377 G378 M384 L385	L377-L381 WeakPolarHBondContact O-CB 3.43Å; L377-L381 WeakPolarHBondContact O-CG 3.39Å; L377-L381 PolarHBondContact O-N 2.82Å; L377-L381 VanDerWaalsContact O-N 3.12Å; G378-L381 PolarHBondContact O-N 2.9Å; L381-M384 PolarHBondContact O-N 2.73Å; L381-L385 PolarHBondContact O-N 2.98Å
382	V	90.6	Very high	84.3	Confident	96 Å²	96	95.3 Å²	95.3	58%	0.582	53%	0.529	S	S	*	.	H	α-helix	trans	-63.6	-43.3	177.5	172.1	0	0	0	0	111.2	G378 V379 M384 L385 L386	G378-V382 WeakPolarHBondContact O-CG2 3.26Å; G378-V382 PolarHBondContact O-N 2.94Å; G378-V382 VanDerWaalsContact O-N 3.08Å; V379-V382 PolarHBondContact O-N 2.86Å; V382-M384 PolarHBondContact O-N 3.43Å; V382-L385 PolarHBondContact O-N 3.26Å; V382-L386 WeakPolarHBondContact O-CB 3.33Å; V382-L386 PolarHBondContact O-N 2.81Å
383	L	91.9	Very high	85.1	Confident	105 Å²	105	93 Å²	93	55%	0.55	53%	0.525	S	S	.	.	H	α-helix	trans	-61.4	-44.4	177.3	-174.8	69.9	0	0	0	111.6	V379 T380 L385 L386 L387	V379-L383 WeakPolarHBondContact O-CB 3.49Å; V379-L383 PolarHBondContact O-N 2.93Å; T380-L383 PolarHBondContact O-N 2.75Å; L383-L385 VanDerWaalsContact C-N 3.35Å; L383-L385 PolarHBondContact O-N 2.82Å; L383-L386 PolarHBondContact O-N 2.82Å; L383-L387 HydrophobicContact CG-CD1 4.34Å; L383-L387 WeakPolarHBondContact O-CG 3.48Å; L383-L387 PolarHBondContact O-N 2.86Å
384	M	91.4	Very high	85.9	Confident	129 Å²	129	92.5 Å²	92.5	64%	0.635	52%	0.517	S	S	*	.	H	α-helix	trans	-61.6	-42.2	177.1	-75.2	-65.1	-68.9	0	0	112.1	T380 L381 V382 L387 F388	T380-M384 WeakPolarHBondContact O-CG 3.25Å; T380-M384 PolarHBondContact O-N 2.81Å; L381-M384 PolarHBondContact O-N 2.73Å; V382-M384 PolarHBondContact O-N 3.43Å; M384-L387 PolarHBondContact O-N 2.67Å; M384-F388 WeakPolarHBondContact O-CB 3.47Å; M384-F388 PolarHBondContact O-N 2.76Å
385	L	92.1	Very high	86.5	Confident	113 Å²	113	95.4 Å²	95.4	59%	0.592	52%	0.515	S	S	*	.	H	α-helix	trans	-62.1	-43.5	175.5	-114.4	160.1	0	0	0	111.8	L381 V382 L383 F388 V389	L381-L385 PolarHBondContact O-N 2.98Å; V382-L385 PolarHBondContact O-N 3.26Å; L383-L385 VanDerWaalsContact C-N 3.35Å; L383-L385 PolarHBondContact O-N 2.82Å; L385-F388 WeakPolarHBondContact O-CB 3.42Å; L385-F388 PolarHBondContact O-N 3.4Å; L385-V389 WeakPolarHBondContact O-CG2 3.24Å; L385-V389 PolarHBondContact O-N 3.4Å
386	L	90.9	Very high	86.7	Confident	103 Å²	103	93.5 Å²	93.5	54%	0.539	50%	0.499	S	S	.	.	H	α-helix	trans	-64.1	-45.8	179	-162	155.8	0	0	0	111	V382 L383 F388 V389 V390	V382-L386 WeakPolarHBondContact O-CB 3.33Å; V382-L386 PolarHBondContact O-N 2.81Å; L383-L386 PolarHBondContact O-N 2.82Å; L386-F388 VanDerWaalsContact C-N 3.32Å; L386-F388 PolarHBondContact O-N 3.24Å; L386-V389 PolarHBondContact O-N 3.23Å; L386-V390 HydrophobicContact CD2-CG2 3.87Å; L386-V390 WeakPolarHBondContact O-CG2 3.28Å; L386-V390 PolarHBondContact O-N 3.13Å
387	L	89	Confident	86.9	Confident	97 Å²	97	94.9 Å²	94.9	51%	0.508	50%	0.495	S	S	.	.	H	α-helix	trans	-60.2	-41.9	175.2	-72.6	172.3	0	0	0	112	L383 M384 V390 Y391	L383-L387 HydrophobicContact CG-CD1 4.34Å; L383-L387 WeakPolarHBondContact O-CG 3.48Å; L383-L387 PolarHBondContact O-N 2.86Å; M384-L387 PolarHBondContact O-N 2.67Å; L387-V390 PolarHBondContact O-N 3.02Å; L387-Y391 VanDerWaalsContact O-CB 3.29Å; L387-Y391 WeakPolarHBondContact O-CB 3.37Å; L387-Y391 PolarHBondContact O-N 2.94Å
388	F	90.4	Very high	86.7	Confident	123 Å²	123	93.8 Å²	93.8	54%	0.539	49%	0.489	S	S	.	.	H	α-helix	trans	-61.5	-44.8	176.2	-179.3	-96.6	0	0	0	112.1	M384 L385 L386 Y391 H392	M384-F388 WeakPolarHBondContact O-CB 3.47Å; M384-F388 PolarHBondContact O-N 2.76Å; L385-F388 WeakPolarHBondContact O-CB 3.42Å; L385-F388 PolarHBondContact O-N 3.4Å; L386-F388 VanDerWaalsContact C-N 3.32Å; L386-F388 PolarHBondContact O-N 3.24Å; F388-Y391 PolarHBondContact O-N 3.43Å; F388-H392 AromaticContact CD1-CD2 3.79Å; F388-H392 AromaticContact CD2-CD2 3.81Å; F388-H392 AromaticContact CD2-NE2 3.89Å; F388-H392 AromaticContact CE1-CD2 3.43Å; F388-H392 VanDerWaalsContact CE1-CD2 3.43Å; F388-H392 WeakPolarHBondContact CE1-CD2 3.45Å; F388-H392 AromaticContact CE1-NE2 3.76Å; F388-H392 AromaticContact CE2-CD2 3.46Å; F388-H392 VanDerWaalsContact CE2-CD2 3.46Å; F388-H392 WeakPolarHBondContact CE2-CD2 3.39Å; F388-H392 AromaticContact CE2-NE2 3.13Å; F388-H392 WeakPolarHBondContact CE2-NE2 3.38Å; F388-H392 AromaticContact CG-CD2 3.98Å; F388-H392 AromaticContact CZ-CD2 3.26Å; F388-H392 WeakPolarHBondContact CZ-CD2 3.46Å; F388-H392 AromaticContact CZ-NE2 3.06Å; F388-H392 WeakPolarHBondContact CZ-NE2 3.44Å; F388-H392 PolarHBondContact O-CD2 3.31Å; F388-H392 VanDerWaalsContact O-CD2 3.3Å; F388-H392 PolarHBondContact O-N 3.45Å
389	V	88.6	Confident	86.5	Confident	76 Å²	76	95 Å²	95	46%	0.461	49%	0.488	S	S	.	.	H	α-helix	trans	-62.9	-47.7	176.4	171.9	0	0	0	0	110.9	L385 L386 Y391 H392 V393	L385-V389 WeakPolarHBondContact O-CG2 3.24Å; L385-V389 PolarHBondContact O-N 3.4Å; L386-V389 PolarHBondContact O-N 3.23Å; V389-Y391 VanDerWaalsContact C-N 3.33Å; V389-Y391 PolarHBondContact O-N 2.77Å; V389-H392 PolarHBondContact O-N 3.3Å; V389-V393 HydrophobicContact CG1-CG2 4.23Å; V389-V393 WeakPolarHBondContact O-CG2 3.46Å; V389-V393 PolarHBondContact O-N 2.72Å
390	V	87.8	Confident	86	Confident	67 Å²	67	90.9 Å²	90.9	41%	0.406	46%	0.462	S	S	.	.	H	α-helix	trans	-58.9	-46	178.1	170.1	0	0	0	0	110.7	L386 L387 H392 V393 F394	L386-V390 HydrophobicContact CD2-CG2 3.87Å; L386-V390 WeakPolarHBondContact O-CG2 3.28Å; L386-V390 PolarHBondContact O-N 3.13Å; L387-V390 PolarHBondContact O-N 3.02Å; V390-H392 PolarHBondContact O-N 3.01Å; V390-V393 PolarHBondContact O-N 2.88Å; V390-F394 HydrophobicContact CG1-CD2 4.13Å; V390-F394 WeakPolarHBondContact O-CB 3.32Å; V390-F394 WeakPolarHBondContact O-CD2 3.27Å; V390-F394 PolarHBondContact O-N 3.25Å
391	Y	86.8	Confident	85.7	Confident	103 Å²	103	92.7 Å²	92.7	40%	0.404	47%	0.468	S	S	.	.	H	α-helix	trans	-56.7	-48.3	176.2	175.4	-89.5	0	0	0	111.9	L387 F388 V389 W395 L398	L387-Y391 VanDerWaalsContact O-CB 3.29Å; L387-Y391 WeakPolarHBondContact O-CB 3.37Å; L387-Y391 PolarHBondContact O-N 2.94Å; F388-Y391 PolarHBondContact O-N 3.43Å; V389-Y391 VanDerWaalsContact C-N 3.33Å; V389-Y391 PolarHBondContact O-N 2.77Å; Y391-W395 HydrophobicContact CD1-CE3 4.47Å; Y391-W395 AromaticContact CD2-CE3 3.94Å; Y391-W395 HydrophobicContact CD2-CE3 3.94Å; Y391-W395 HydrophobicContact CD2-CZ3 4.09Å; Y391-W395 HydrophobicContact CE1-CD2 4.45Å; Y391-W395 AromaticContact CE1-CE3 3.88Å; Y391-W395 HydrophobicContact CE1-CE3 3.88Å; Y391-W395 HydrophobicContact CE1-CZ3 4.19Å; Y391-W395 AromaticContact CE2-CE3 3.31Å; Y391-W395 HydrophobicContact CE2-CE3 3.31Å; Y391-W395 HydrophobicContact CE2-CH2 4.12Å; Y391-W395 AromaticContact CE2-CZ3 3.09Å; Y391-W395 HydrophobicContact CE2-CZ3 3.09Å; Y391-W395 HydrophobicContact CG-CE3 4.49Å; Y391-W395 AromaticContact CZ-CE3 3.26Å; Y391-W395 AromaticContact CZ-CH2 3.85Å; Y391-W395 AromaticContact CZ-CZ3 3.14Å; Y391-W395 WeakPolarHBondContact O-CA 3.39Å; Y391-W395 VanDerWaalsContact O-CB 3.3Å; Y391-W395 WeakPolarHBondContact O-CB 3.29Å; Y391-W395 PolarHBondContact O-N 3.42Å; Y391-W395 WeakPolarHBondContact OH-CH2 3.23Å; Y391-W395 WeakPolarHBondContact OH-CZ3 3.32Å; Y391-L398 HydrophobicContact CD2-CD2 4.18Å
392	H	80.8	Confident	85.2	Confident	109 Å²	109	94.2 Å²	94.2	51%	0.505	47%	0.467	S	S	.	.	H	α-helix	trans	-70	-37	-177.8	-86.7	-69.8	0	0	0	113.9	F388 V389 V390	F388-H392 AromaticContact CD1-CD2 3.79Å; F388-H392 AromaticContact CD2-CD2 3.81Å; F388-H392 AromaticContact CD2-NE2 3.89Å; F388-H392 AromaticContact CE1-CD2 3.43Å; F388-H392 VanDerWaalsContact CE1-CD2 3.43Å; F388-H392 WeakPolarHBondContact CE1-CD2 3.45Å; F388-H392 AromaticContact CE1-NE2 3.76Å; F388-H392 AromaticContact CE2-CD2 3.46Å; F388-H392 VanDerWaalsContact CE2-CD2 3.46Å; F388-H392 WeakPolarHBondContact CE2-CD2 3.39Å; F388-H392 AromaticContact CE2-NE2 3.13Å; F388-H392 WeakPolarHBondContact CE2-NE2 3.38Å; F388-H392 AromaticContact CG-CD2 3.98Å; F388-H392 AromaticContact CZ-CD2 3.26Å; F388-H392 WeakPolarHBondContact CZ-CD2 3.46Å; F388-H392 AromaticContact CZ-NE2 3.06Å; F388-H392 WeakPolarHBondContact CZ-NE2 3.44Å; F388-H392 PolarHBondContact O-CD2 3.31Å; F388-H392 VanDerWaalsContact O-CD2 3.3Å; F388-H392 PolarHBondContact O-N 3.45Å; V389-H392 PolarHBondContact O-N 3.3Å; V390-H392 PolarHBondContact O-N 3.01Å
393	V	83.6	Confident	84.5	Confident	101 Å²	101	93 Å²	93	61%	0.612	45%	0.452	S	S	*	.	H	α-helix	trans	-73.4	-42.1	179.5	174	0	0	0	0	111	V389 V390	V389-V393 HydrophobicContact CG1-CG2 4.23Å; V389-V393 WeakPolarHBondContact O-CG2 3.46Å; V389-V393 PolarHBondContact O-N 2.72Å; V390-V393 PolarHBondContact O-N 2.88Å
394	F	82.4	Confident	83.7	Confident	113 Å²	113	90.8 Å²	90.8	50%	0.496	45%	0.445	S	S	.	.	H	α-helix	trans	-103.9	13.5	-172.6	-63.9	-78.4	0	0	0	114.2	V390 L396 E397 L398	V390-F394 HydrophobicContact CG1-CD2 4.13Å; V390-F394 WeakPolarHBondContact O-CB 3.32Å; V390-F394 WeakPolarHBondContact O-CD2 3.27Å; V390-F394 PolarHBondContact O-N 3.25Å; F394-L396 VanDerWaalsContact C-N 3.28Å; F394-L396 PolarHBondContact O-N 2.85Å; F394-L396 VanDerWaalsContact O-N 3.14Å; F394-E397 HydrophobicContact CB-CB 4.47Å; F394-E397 HydrophobicContact CD1-CG 4.31Å; F394-E397 WeakPolarHBondContact O-CA 3.25Å; F394-E397 WeakPolarHBondContact O-CB 3.49Å; F394-E397 PolarHBondContact O-N 2.92Å; F394-L398 PolarHBondContact O-N 3.11Å
395	W	83.1	Confident	82.8	Confident	106 Å²	106	93.9 Å²	93.9	40%	0.402	45%	0.45	S	S	.	.	H	α-helix	trans	-50.2	-43	-177.3	179.5	-115.5	0	0	0	114.1	Y391 L398 L399	Y391-W395 HydrophobicContact CD1-CE3 4.47Å; Y391-W395 AromaticContact CD2-CE3 3.94Å; Y391-W395 HydrophobicContact CD2-CE3 3.94Å; Y391-W395 HydrophobicContact CD2-CZ3 4.09Å; Y391-W395 HydrophobicContact CE1-CD2 4.45Å; Y391-W395 AromaticContact CE1-CE3 3.88Å; Y391-W395 HydrophobicContact CE1-CE3 3.88Å; Y391-W395 HydrophobicContact CE1-CZ3 4.19Å; Y391-W395 AromaticContact CE2-CE3 3.31Å; Y391-W395 HydrophobicContact CE2-CE3 3.31Å; Y391-W395 HydrophobicContact CE2-CH2 4.12Å; Y391-W395 AromaticContact CE2-CZ3 3.09Å; Y391-W395 HydrophobicContact CE2-CZ3 3.09Å; Y391-W395 HydrophobicContact CG-CE3 4.49Å; Y391-W395 AromaticContact CZ-CE3 3.26Å; Y391-W395 AromaticContact CZ-CH2 3.85Å; Y391-W395 AromaticContact CZ-CZ3 3.14Å; Y391-W395 WeakPolarHBondContact O-CA 3.39Å; Y391-W395 VanDerWaalsContact O-CB 3.3Å; Y391-W395 WeakPolarHBondContact O-CB 3.29Å; Y391-W395 PolarHBondContact O-N 3.42Å; Y391-W395 WeakPolarHBondContact OH-CH2 3.23Å; Y391-W395 WeakPolarHBondContact OH-CZ3 3.32Å; W395-L398 HydrophobicContact CE3-CD2 4.47Å; W395-L398 PolarHBondContact O-N 3.35Å; W395-L399 HydrophobicContact CD2-CD1 3.97Å; W395-L399 HydrophobicContact CD2-CG 4.25Å; W395-L399 HydrophobicContact CG-CD1 4.19Å; W395-L399 HydrophobicContact CH2-CD2 4.46Å; W395-L399 HydrophobicContact CH2-CG 4.37Å; W395-L399 HydrophobicContact CZ2-CD1 3.74Å; W395-L399 HydrophobicContact CZ2-CD2 4.24Å; W395-L399 HydrophobicContact CZ2-CG 4.02Å; W395-L399 VanDerWaalsContact O-CB 3.31Å; W395-L399 WeakPolarHBondContact O-CB 3.42Å; W395-L399 WeakPolarHBondContact O-CG 3.44Å; W395-L399 PolarHBondContact O-N 2.93Å
396	L	79.1	Confident	81.8	Confident	41 Å²	41	94.6 Å²	94.6	22%	0.215	45%	0.449	C	S	.	.	H	α-helix	trans	-65.7	-38	177.7	-71.2	172.9	0	0	0	112.2	F394 L400 R551 K554 V558	F394-L396 VanDerWaalsContact C-N 3.28Å; F394-L396 PolarHBondContact O-N 2.85Å; F394-L396 VanDerWaalsContact O-N 3.14Å; L396-L400 WeakPolarHBondContact O-CB 3.33Å; L396-L400 WeakPolarHBondContact O-CG 3.45Å; L396-L400 PolarHBondContact O-N 2.82Å; L396-R551 HydrophobicContact CD1-CG 3.6Å; L396-K554 HydrophobicContact CB-CB 4.39Å; L396-K554 HydrophobicContact CD1-CB 4.37Å; L396-V558 HydrophobicContact CD2-CG2 4.46Å
397	E	82.8	Confident	80.6	Confident	67 Å²	67	90.3 Å²	90.3	31%	0.313	43%	0.429	S	S	.	.	H	α-helix	trans	-71.7	-42.3	177.8	-61.3	-76.1	-147.2	0	0	111.1	F394 L399 L400 L401 K554	F394-E397 HydrophobicContact CB-CB 4.47Å; F394-E397 HydrophobicContact CD1-CG 4.31Å; F394-E397 WeakPolarHBondContact O-CA 3.25Å; F394-E397 WeakPolarHBondContact O-CB 3.49Å; F394-E397 PolarHBondContact O-N 2.92Å; E397-L399 VanDerWaalsContact C-N 3.35Å; E397-L399 PolarHBondContact O-N 3.02Å; E397-L400 PolarHBondContact O-N 3.14Å; E397-L401 WeakPolarHBondContact O-CB 3.34Å; E397-L401 WeakPolarHBondContact O-CG 3.08Å; E397-L401 PolarHBondContact O-N 3.11Å; E397-K554 VanDerWaalsContact CD-NZ 3.32Å; E397-K554 HydrophobicContact CG-CD 4.46Å; E397-K554 WeakPolarHBondContact OE1-CE 3.5Å; E397-K554 IonicContact OE1-NZ 3.36Å; E397-K554 PolarHBondContact OE1-NZ 2.87Å; E397-K554 WeakPolarHBondContact OE2-CE 3.01Å; E397-K554 IonicContact OE2-NZ 2.73Å
398	L	79.1	Confident	79.5	Confident	90 Å²	90	90.5 Å²	90.5	47%	0.471	44%	0.435	S	S	.	.	H	α-helix	trans	-62.7	-42.3	176.8	-171.5	70	0	0	0	111.1	Y391 F394 W395 L401 Y402	Y391-L398 HydrophobicContact CD2-CD2 4.18Å; F394-L398 PolarHBondContact O-N 3.11Å; W395-L398 HydrophobicContact CE3-CD2 4.47Å; W395-L398 PolarHBondContact O-N 3.35Å; L398-L401 PolarHBondContact O-N 3Å; L398-Y402 VanDerWaalsContact O-CB 3.32Å; L398-Y402 WeakPolarHBondContact O-CB 3.49Å; L398-Y402 PolarHBondContact O-N 3.33Å
399	L	81.1	Confident	78.5	Confident	56 Å²	56	85.9 Å²	85.9	29%	0.293	42%	0.416	S	S	.	.	H	α-helix	trans	-64	-42.9	173.9	-88.7	169	0	0	0	112.5	W395 E397 Y402 R403	W395-L399 HydrophobicContact CD2-CD1 3.97Å; W395-L399 HydrophobicContact CD2-CG 4.25Å; W395-L399 HydrophobicContact CG-CD1 4.19Å; W395-L399 HydrophobicContact CH2-CD2 4.46Å; W395-L399 HydrophobicContact CH2-CG 4.37Å; W395-L399 HydrophobicContact CZ2-CD1 3.74Å; W395-L399 HydrophobicContact CZ2-CD2 4.24Å; W395-L399 HydrophobicContact CZ2-CG 4.02Å; W395-L399 VanDerWaalsContact O-CB 3.31Å; W395-L399 WeakPolarHBondContact O-CB 3.42Å; W395-L399 WeakPolarHBondContact O-CG 3.44Å; W395-L399 PolarHBondContact O-N 2.93Å; E397-L399 VanDerWaalsContact C-N 3.35Å; E397-L399 PolarHBondContact O-N 3.02Å; L399-Y402 PolarHBondContact O-N 2.83Å; L399-R403 VanDerWaalsContact O-CB 3.27Å; L399-R403 WeakPolarHBondContact O-CB 3.39Å; L399-R403 PolarHBondContact O-N 2.98Å
400	L	79.3	Confident	77.5	Confident	20 Å²	20	84.3 Å²	84.3	11%	0.105	40%	0.403	C	S	.	.	H	α-helix	trans	-65.9	-39.3	177.3	-74.3	172.6	0	0	0	111.7	L396 E397 R403 S404 K554 R557 V558	L396-L400 WeakPolarHBondContact O-CB 3.33Å; L396-L400 WeakPolarHBondContact O-CG 3.45Å; L396-L400 PolarHBondContact O-N 2.82Å; E397-L400 PolarHBondContact O-N 3.14Å; L400-R403 PolarHBondContact O-N 2.87Å; L400-S404 WeakPolarHBondContact O-CB 3.36Å; L400-S404 PolarHBondContact O-N 3.31Å; L400-S404 PolarHBondContact O-OG 3.38Å; L400-K554 HydrophobicContact CD1-CB 3.92Å; L400-K554 HydrophobicContact CD1-CG 3.95Å; L400-R557 HydrophobicContact CD2-CB 4.05Å; L400-R557 HydrophobicContact CD2-CG 3.86Å; L400-V558 HydrophobicContact CD2-CG2 3.71Å; L400-V558 HydrophobicContact CG-CG2 4.04Å
401	L	79.8	Confident	76.4	Confident	112 Å²	112	85.4 Å²	85.4	59%	0.586	40%	0.4	S	S	*	.	H	α-helix	trans	-64.7	-43.5	173	-81.2	163.8	0	0	0	112	E397 L398 S404 W405	E397-L401 WeakPolarHBondContact O-CB 3.34Å; E397-L401 WeakPolarHBondContact O-CG 3.08Å; E397-L401 PolarHBondContact O-N 3.11Å; L398-L401 PolarHBondContact O-N 3Å; L401-S404 PolarHBondContact O-N 3.38Å; L401-S404 PolarHBondContact O-OG 3.03Å; L401-W405 WeakPolarHBondContact O-CB 3.3Å; L401-W405 PolarHBondContact O-N 2.7Å
402	Y	77.8	Confident	75.1	Confident	151 Å²	151	88.8 Å²	88.8	59%	0.592	42%	0.419	S	S	*	.	H	α-helix	trans	-61.7	-45.8	175	178.6	-97.8	0	0	0	111.1	L398 L399 W405 F406	L398-Y402 VanDerWaalsContact O-CB 3.32Å; L398-Y402 WeakPolarHBondContact O-CB 3.49Å; L398-Y402 PolarHBondContact O-N 3.33Å; L399-Y402 PolarHBondContact O-N 2.83Å; Y402-W405 PolarHBondContact O-N 3.37Å; Y402-F406 AromaticContact CD2-CD2 3.51Å; Y402-F406 HydrophobicContact CD2-CD2 3.51Å; Y402-F406 AromaticContact CD2-CE2 3.95Å; Y402-F406 HydrophobicContact CD2-CE2 3.95Å; Y402-F406 HydrophobicContact CD2-CG 4.47Å; Y402-F406 HydrophobicContact CE2-CB 4.45Å; Y402-F406 AromaticContact CE2-CD2 3.42Å; Y402-F406 HydrophobicContact CE2-CD2 3.42Å; Y402-F406 VanDerWaalsContact CE2-CD2 3.42Å; Y402-F406 AromaticContact CE2-CE2 3.85Å; Y402-F406 HydrophobicContact CE2-CE2 3.85Å; Y402-F406 HydrophobicContact CE2-CG 4.07Å; Y402-F406 HydrophobicContact CG-CD2 4.28Å; Y402-F406 WeakPolarHBondContact O-CB 3.06Å; Y402-F406 PolarHBondContact O-N 2.85Å
403	R	77.1	Confident	74.1	Confident	70 Å²	70	89 Å²	89	26%	0.264	43%	0.428	S	S	.	.	H	α-helix	trans	-67.8	-33.4	178.7	-174.5	174.9	168.2	82.3	-6	112.5	L399 L400 G407 E410 L560 V562	L399-R403 VanDerWaalsContact O-CB 3.27Å; L399-R403 WeakPolarHBondContact O-CB 3.39Å; L399-R403 PolarHBondContact O-N 2.98Å; L400-R403 PolarHBondContact O-N 2.87Å; R403-G407 WeakPolarHBondContact O-CA 3.47Å; R403-G407 PolarHBondContact O-N 2.99Å; R403-E410 IonicContact NH2-OE1 2.7Å; R403-L560 PolarHBondContact NH2-O 2.9Å; R403-V562 HydrophobicContact CG-CG1 4.3Å; R403-V562 HydrophobicContact CG-CG2 4.06Å
404	S	74.8	Confident	73.5	Confident	59 Å²	59	86.3 Å²	86.3	41%	0.413	41%	0.41	S	S	.	.	H	α-helix	trans	-73.1	-36.6	175.5	69.3	0	0	0	0	112.3	L400 L401	L400-S404 WeakPolarHBondContact O-CB 3.36Å; L400-S404 PolarHBondContact O-N 3.31Å; L400-S404 PolarHBondContact O-OG 3.38Å; L401-S404 PolarHBondContact O-N 3.38Å; L401-S404 PolarHBondContact O-OG 3.03Å
405	W	72.6	Confident	73	Confident	195 Å²	195	89.5 Å²	89.5	74%	0.739	43%	0.433	S	S	*	.	H	α-helix	trans	-77.1	-44.5	-179.8	-168.3	-84.5	0	0	0	112.9	L401 Y402	L401-W405 WeakPolarHBondContact O-CB 3.3Å; L401-W405 PolarHBondContact O-N 2.7Å; Y402-W405 PolarHBondContact O-N 3.37Å
406	F	69.9	Low	73	Confident	127 Å²	127	86.3 Å²	86.3	56%	0.557	42%	0.422	S	S	*	.	H	α-helix	trans	-104	-15.1	-174.8	-69.2	-78.5	0	0	0	114.5	Y402	Y402-F406 AromaticContact CD2-CD2 3.51Å; Y402-F406 HydrophobicContact CD2-CD2 3.51Å; Y402-F406 AromaticContact CD2-CE2 3.95Å; Y402-F406 HydrophobicContact CD2-CE2 3.95Å; Y402-F406 HydrophobicContact CD2-CG 4.47Å; Y402-F406 HydrophobicContact CE2-CB 4.45Å; Y402-F406 AromaticContact CE2-CD2 3.42Å; Y402-F406 HydrophobicContact CE2-CD2 3.42Å; Y402-F406 VanDerWaalsContact CE2-CD2 3.42Å; Y402-F406 AromaticContact CE2-CE2 3.85Å; Y402-F406 HydrophobicContact CE2-CE2 3.85Å; Y402-F406 HydrophobicContact CE2-CG 4.07Å; Y402-F406 HydrophobicContact CG-CD2 4.28Å; Y402-F406 WeakPolarHBondContact O-CB 3.06Å; Y402-F406 PolarHBondContact O-N 2.85Å
407	G	66.9	Low	73.2	Confident	13 Å²	13	89.4 Å²	89.4	13%	0.134	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-69.9	135.1	-179.9	0	0	0	0	0	112.3	R403 R564	R403-G407 WeakPolarHBondContact O-CA 3.47Å; R403-G407 PolarHBondContact O-N 2.99Å; G407-R564 PolarHBondContact O-NE 2.84Å; G407-R564 PolarHBondContact O-NH2 3.22Å
408	T	64.7	Low	73.4	Confident	101 Å²	101	87.8 Å²	87.8	62%	0.62	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-83.7	133.2	166.6	47	0	0	0	0	108.9	E410 V562	T408-E410 PolarHBondContact O-N 3.07Å; T408-V562 WeakPolarHBondContact O-CB 3.41Å
409	D	70.1	Confident	73.8	Confident	27 Å²	27	83.7 Å²	83.7	14%	0.144	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-65.4	121.4	177.8	-162.5	-41.3	0	0	0	109.7	R411 H412 R564	D409-R411 PolarHBondContact O-N 2.94Å; D409-R411 WeakPolarHBondContact OD1-CB 3.46Å; D409-R411 PolarHBondContact OD1-N 2.78Å; D409-R411 VanDerWaalsContact OD1-N 3.12Å; D409-H412 PolarHBondContact O-N 2.62Å; D409-R564 PolarHBondContact OD2-N 3.43Å
410	E	67.7	Low	74.3	Confident	42 Å²	42	81 Å²	81	20%	0.196	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-64.1	-26.5	-175.2	-72.5	174	-139.4	0	0	110.9	R403 T408 H412 T413 D414 R476 V562	R403-E410 IonicContact NH2-OE1 2.7Å; T408-E410 PolarHBondContact O-N 3.07Å; E410-H412 PolarHBondContact O-N 3.09Å; E410-H412 VanDerWaalsContact O-N 3.15Å; E410-T413 PolarHBondContact O-N 3.47Å; E410-T413 PolarHBondContact O-OG1 3.27Å; E410-D414 PolarHBondContact O-N 3.1Å; E410-R476 IonicContact OE1-NH2 3.91Å; E410-R476 PolarHBondContact OE1-NH2 2.96Å; E410-R476 VanDerWaalsContact OE1-NH2 3.13Å; E410-R476 IonicContact OE2-CZ 2.9Å; E410-R476 IonicContact OE2-NH1 2.73Å; E410-R476 PolarHBondContact OE2-NH1 3.5Å; E410-R476 IonicContact OE2-NH2 3.92Å; E410-R476 PolarHBondContact OE2-NH2 2.85Å; E410-V562 PolarHBondContact OE1-N 2.76Å
411	R	64.1	Low	74.9	Confident	91 Å²	91	80 Å²	80	34%	0.343	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-61.7	-23.8	-179.2	-69.5	-175.3	178.1	178.3	5.1	115	D409 T413 D419 G447	D409-R411 PolarHBondContact O-N 2.94Å; D409-R411 WeakPolarHBondContact OD1-CB 3.46Å; D409-R411 PolarHBondContact OD1-N 2.78Å; D409-R411 VanDerWaalsContact OD1-N 3.12Å; R411-T413 VanDerWaalsContact C-N 3.3Å; R411-D419 IonicContact CZ-OD2 2.62Å; R411-D419 IonicContact NE-OD1 3.87Å; R411-D419 PolarHBondContact NE-OD1 3.19Å; R411-D419 IonicContact NE-OD2 3.25Å; R411-D419 PolarHBondContact NE-OD2 3.41Å; R411-D419 IonicContact NH2-OD2 3.5Å; R411-D419 PolarHBondContact NH2-OD2 2.96Å; R411-G447 PolarHBondContact NH2-O 2.75Å; R411-G447 VanDerWaalsContact NH2-O 3.09Å
412	H	59.5	Low	75.5	Confident	174 Å²	174	74.8 Å²	74.8	81%	0.806	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-84.9	-7.8	179.3	-75.3	-60.9	0	0	0	113.2	D409 E410	D409-H412 PolarHBondContact O-N 2.62Å; E410-H412 PolarHBondContact O-N 3.09Å; E410-H412 VanDerWaalsContact O-N 3.15Å
413	T	61.7	Low	76.1	Confident	113 Å²	113	67.6 Å²	67.6	69%	0.693	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	-15.9	-173.3	58.4	0	0	0	0	114.1	E410 R411	E410-T413 PolarHBondContact O-N 3.47Å; E410-T413 PolarHBondContact O-OG1 3.27Å; R411-T413 VanDerWaalsContact C-N 3.3Å
414	D	69.2	Low	76.6	Confident	44 Å²	44	64.5 Å²	64.5	24%	0.235	32%	0.319	C	S	.	.			trans	-133.7	141	-176.8	66.1	-7.4	0	0	0	113.6	E410 K416 R475	E410-D414 PolarHBondContact O-N 3.1Å; D414-K416 HydrophobicContact CB-CG 4.44Å; D414-K416 PolarHBondContact O-N 3.47Å; D414-R475 VanDerWaalsContact CG-NE 3.29Å; D414-R475 IonicContact OD1-CZ 3.04Å; D414-R475 IonicContact OD1-NE 3.39Å; D414-R475 PolarHBondContact OD1-NE 3.01Å; D414-R475 IonicContact OD1-NH2 3.27Å; D414-R475 PolarHBondContact OD1-NH2 3.37Å; D414-R475 WeakPolarHBondContact OD2-CD 3.31Å; D414-R475 WeakPolarHBondContact OD2-CG 3.37Å; D414-R475 IonicContact OD2-CZ 3.24Å; D414-R475 IonicContact OD2-NE 2.68Å; D414-R475 PolarHBondContact OD2-NE 3.26Å; D414-R475 IonicContact OD2-NH2 2.82Å
415	D	73.6	Confident	77	Confident	180 Å²	180	62.1 Å²	62.1	96%	0.963	30%	0.303	S	S	*	.			trans	-78.1	32.5	177.4	-91.2	-16.7	0	0	0	112.8
416	K	82.5	Confident	77.4	Confident	39 Å²	39	57.1 Å²	57.1	17%	0.17	28%	0.284	C	S	.	.			trans	-90.4	130.9	179.5	-70.7	-172	171.4	-167.9	0	111.1	D414 R473 S474 R475 H508	D414-K416 HydrophobicContact CB-CG 4.44Å; D414-K416 PolarHBondContact O-N 3.47Å; K416-R473 WeakPolarHBondContact CB-O 3.49Å; K416-S474 WeakPolarHBondContact CD-O 3.48Å; K416-S474 PolarHBondContact NZ-O 2.92Å; K416-R475 HydrophobicContact CB-CG 3.99Å; K416-R475 HydrophobicContact CD-CB 4.42Å; K416-R475 HydrophobicContact CD-CG 3.67Å; K416-R475 HydrophobicContact CG-CG 4.46Å; K416-R475 PolarHBondContact O-NH1 3.36Å; K416-R475 PolarHBondContact O-NH2 3.32Å; K416-H508 PolarHBondContact NZ-O 2.91Å; K416-H508 VanDerWaalsContact NZ-O 3.09Å
417	E	83.4	Confident	77.9	Confident	106 Å²	106	53.4 Å²	53.4	50%	0.495	27%	0.27	S	S	.	.	S	Bend	trans	-83.5	-30.6	-177.2	-66.7	150.9	130.2	0	0	113	S449 R473	E417-S449 PolarHBondContact O-OG 2.93Å; E417-R473 PolarHBondContact N-O 3.49Å; E417-R473 IonicContact OE1-CZ 3.84Å; E417-R473 IonicContact OE1-NH2 2.8Å; E417-R473 PolarHBondContact OE1-NH2 2.92Å; E417-R473 IonicContact OE2-CZ 2.98Å; E417-R473 IonicContact OE2-NE 3.13Å; E417-R473 PolarHBondContact OE2-NE 3.09Å; E417-R473 IonicContact OE2-NH2 3.93Å; E417-R473 PolarHBondContact OE2-NH2 3.26Å
418	F	87.2	Confident	78.3	Confident	34 Å²	34	57.7 Å²	57.7	15%	0.149	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133	-176.4	-60.7	-74.1	0	0	0	111.9	S449 C451 F470 R473 S474 R475	F418-S449 WeakPolarHBondContact CA-OG 3.4Å; F418-C451 HydrophobicContact CB-CB 3.99Å; F418-C451 HydrophobicContact CD1-CB 3.58Å; F418-C451 HydrophobicContact CD2-CB 3.87Å; F418-C451 HydrophobicContact CE1-CB 3.91Å; F418-C451 HydrophobicContact CE2-CB 4.19Å; F418-C451 HydrophobicContact CG-CB 3.54Å; F418-C451 HydrophobicContact CZ-CB 4.2Å; F418-F470 HydrophobicContact CE2-CD1 4.15Å; F418-F470 HydrophobicContact CE2-CE1 4.42Å; F418-R473 HydrophobicContact CD2-CB 4.35Å; F418-R473 PolarHBondContact N-O 2.73Å; F418-S474 CarbonylContact O-C 3.51Å; F418-S474 VanDerWaalsContact O-CA 3.28Å; F418-S474 WeakPolarHBondContact O-CA 3.25Å; F418-R475 PolarHBondContact O-N 2.69Å
419	D	87.3	Confident	79.1	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.016	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	-38.9	173	-65.8	-43.2	0	0	0	111.2	R411 Y448 S449 R475 R476 P561	R411-D419 IonicContact CZ-OD2 2.62Å; R411-D419 IonicContact NE-OD1 3.87Å; R411-D419 PolarHBondContact NE-OD1 3.19Å; R411-D419 IonicContact NE-OD2 3.25Å; R411-D419 PolarHBondContact NE-OD2 3.41Å; R411-D419 IonicContact NH2-OD2 3.5Å; R411-D419 PolarHBondContact NH2-OD2 2.96Å; D419-Y448 HydrophobicContact CB-CD1 3.78Å; D419-Y448 HydrophobicContact CB-CG 4.45Å; D419-Y448 WeakPolarHBondContact OD2-CA 3.42Å; D419-S449 PolarHBondContact N-O 2.73Å; D419-S449 PolarHBondContact N-OG 3.41Å; D419-S449 PolarHBondContact OD2-N 3.37Å; D419-S449 PolarHBondContact OD2-OG 2.86Å; D419-R475 WeakPolarHBondContact O-CB 3.33Å; D419-R475 IonicContact OD1-CZ 2.66Å; D419-R475 IonicContact OD1-NH1 3.02Å; D419-R475 PolarHBondContact OD1-NH1 3.06Å; D419-R476 PolarHBondContact O-N 3.42Å; D419-P561 HydrophobicContact CB-CG 4.28Å
420	V	91.3	Very high	79.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	124.3	-173.8	-171.9	0	0	0	0	110.5	I422 S449 V450 C451 R476 L478 L560	V420-I422 HydrophobicContact CG1-CG1 4.08Å; V420-S449 PolarHBondContact N-O 3.04Å; V420-V450 CarbonylContact O-C 3.6Å; V420-V450 WeakPolarHBondContact O-CA 3.41Å; V420-C451 PolarHBondContact O-N 3.14Å; V420-R476 CarbonylContact C-O 3.58Å; V420-R476 WeakPolarHBondContact CA-O 3.37Å; V420-L478 HydrophobicContact CG1-CB 3.57Å; V420-L478 HydrophobicContact CG1-CD1 4.23Å; V420-L560 HydrophobicContact CG2-CD2 3.38Å
421	Y	92.1	Very high	80.4	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	130.7	161.2	-175.6	-88.4	0	0	0	109.4	C451 F453 F470 V471 S474 R476 L477 L478 E495	Y421-C451 WeakPolarHBondContact CA-O 3.12Å; Y421-C451 HydrophobicContact CD2-CB 3.88Å; Y421-F453 WeakPolarHBondContact OH-CB 3.43Å; Y421-F470 HydrophobicContact CD2-CB 3.71Å; Y421-F470 HydrophobicContact CE2-CB 3.49Å; Y421-F470 VanDerWaalsContact CE2-CB 3.49Å; Y421-F470 HydrophobicContact CE2-CD2 4.47Å; Y421-F470 HydrophobicContact CE2-CG 4.23Å; Y421-V471 HydrophobicContact CD1-CG2 4.38Å; Y421-V471 HydrophobicContact CE1-CG2 4.37Å; Y421-S474 WeakPolarHBondContact CB-OG 3.41Å; Y421-R476 PolarHBondContact N-O 2.83Å; Y421-L477 HydrophobicContact CD1-CD1 3.3Å; Y421-L477 HydrophobicContact CE1-CD1 4.1Å; Y421-L477 HydrophobicContact CG-CD1 4.16Å; Y421-L477 CarbonylContact O-C 3.58Å; Y421-L477 WeakPolarHBondContact O-CA 3.45Å; Y421-L478 PolarHBondContact O-N 3.4Å; Y421-E495 HydrophobicContact CE1-CB 4.12Å; Y421-E495 HydrophobicContact CE1-CG 3.86Å; Y421-E495 VanDerWaalsContact OH-CD 3.24Å; Y421-E495 WeakPolarHBondContact OH-CG 3.43Å; Y421-E495 PolarHBondContact OH-OE1 3.13Å
422	I	92.3	Very high	81.5	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122.5	178.1	-56.3	175	0	0	0	110.5	V420 Y424 V434 L438 L442 V450 C451 I452 L478 V480	V420-I422 HydrophobicContact CG1-CG1 4.08Å; I422-Y424 HydrophobicContact CG2-CD1 4.21Å; I422-V434 HydrophobicContact CB-CG1 4.46Å; I422-V434 HydrophobicContact CD1-CG1 4.29Å; I422-V434 HydrophobicContact CG2-CG1 3.73Å; I422-V434 HydrophobicContact CG2-CG2 4.33Å; I422-L438 HydrophobicContact CD1-CD2 3.89Å; I422-L438 HydrophobicContact CD1-CG 4.23Å; I422-L438 HydrophobicContact CG2-CD2 4.22Å; I422-L442 HydrophobicContact CD1-CD1 4.07Å; I422-V450 HydrophobicContact CD1-CG1 3.39Å; I422-V450 HydrophobicContact CG1-CG1 3.81Å; I422-C451 PolarHBondContact N-O 3.4Å; I422-I452 HydrophobicContact CB-CG1 4.43Å; I422-L478 CarbonylContact C-O 3.58Å; I422-L478 WeakPolarHBondContact CA-O 3.46Å; I422-L478 HydrophobicContact CG1-CB 4.39Å; I422-L478 HydrophobicContact CG2-CD2 4.22Å; I422-V480 HydrophobicContact CG2-CG2 4.1Å
423	S	89.9	Confident	82.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	127.2	171	-178.3	0	0	0	0	110.3	L478 V479 V480 Y485 A492 E495	S423-L478 PolarHBondContact N-O 2.81Å; S423-V479 CarbonylContact O-C 3.54Å; S423-V479 WeakPolarHBondContact O-CA 3.23Å; S423-V480 PolarHBondContact O-N 2.83Å; S423-Y485 PolarHBondContact OG-OH 2.96Å; S423-A492 PolarHBondContact OG-O 3.29Å; S423-E495 VanDerWaalsContact CA-OE2 3.31Å; S423-E495 WeakPolarHBondContact CA-OE2 3.02Å; S423-E495 WeakPolarHBondContact CB-OE2 3.05Å; S423-E495 PolarHBondContact OG-OE2 3.49Å
424	Y	88.1	Confident	84.1	Confident	6 Å²	6	46.3 Å²	46.3	2%	0.024	23%	0.233	C	C	.	.			trans	-144	161.4	179.9	62.2	-82.6	0	0	0	111.3	I422 R426 E431 V434 I452 D454 A492	I422-Y424 HydrophobicContact CG2-CD1 4.21Å; Y424-R426 HydrophobicContact CE2-CG 4.24Å; Y424-R426 PolarHBondContact O-N 2.99Å; Y424-E431 HydrophobicContact CD2-CB 4.49Å; Y424-E431 HydrophobicContact CE2-CB 3.9Å; Y424-E431 HydrophobicContact CE2-CG 4.03Å; Y424-V434 HydrophobicContact CD1-CB 4.16Å; Y424-V434 HydrophobicContact CD1-CG1 3.82Å; Y424-V434 HydrophobicContact CD1-CG2 3.93Å; Y424-V434 HydrophobicContact CD2-CG2 4.26Å; Y424-V434 HydrophobicContact CE1-CB 4.44Å; Y424-V434 HydrophobicContact CE1-CG1 3.95Å; Y424-V434 HydrophobicContact CG-CB 4.24Å; Y424-V434 HydrophobicContact CG-CG1 4.4Å; Y424-V434 HydrophobicContact CG-CG2 3.69Å; Y424-I452 HydrophobicContact CE1-CG2 3.84Å; Y424-D454 PolarHBondContact OH-OD2 2.92Å; Y424-A492 WeakPolarHBondContact O-CB 3.33Å
425	A	82.7	Confident	84.9	Confident	8 Å²	8	46.8 Å²	46.8	7%	0.066	24%	0.235	C	C	.	.			trans	-76.2	126.5	171.4	0	0	0	0	0	108.3	N427 E430 Y485	A425-N427 PolarHBondContact O-N 3.22Å; A425-E430 WeakPolarHBondContact CB-OE2 3.38Å; A425-E430 PolarHBondContact N-OE2 3.17Å; A425-Y485 HydrophobicContact CB-CD2 4.29Å
426	R	82.5	Confident	85.4	Confident	90 Å²	90	41 Å²	41	34%	0.34	21%	0.208	S	C	.	.			trans	-72	62.7	179.7	-66.4	169.7	173.1	85.3	-4.5	111.6	Y424 D454 Q491 E495	Y424-R426 HydrophobicContact CE2-CG 4.24Å; Y424-R426 PolarHBondContact O-N 2.99Å; R426-D454 IonicContact CZ-OD1 2.97Å; R426-D454 VanDerWaalsContact CZ-OD1 3.29Å; R426-D454 IonicContact CZ-OD2 2.68Å; R426-D454 IonicContact NE-OD1 2.82Å; R426-D454 PolarHBondContact NE-OD1 2.94Å; R426-D454 IonicContact NE-OD2 3.51Å; R426-D454 PolarHBondContact NE-OD2 3Å; R426-D454 VanDerWaalsContact NE-OD2 3.16Å; R426-D454 IonicContact NH2-OD1 3.68Å; R426-D454 PolarHBondContact NH2-OD1 3.09Å; R426-D454 IonicContact NH2-OD2 2.59Å; R426-Q491 VanDerWaalsContact CZ-CD 3.42Å; R426-E495 IonicContact NH1-OE1 2.78Å; R426-E495 IonicContact NH2-OE1 2.85Å
427	N	78.4	Confident	85.6	Confident	50 Å²	50	41 Å²	41	27%	0.267	21%	0.212	S	C	.	.	S	Bend	trans	-114.2	157	171.3	66.9	30.7	0	0	0	109.6	A425 E429 E430 E431	A425-N427 PolarHBondContact O-N 3.22Å; N427-E429 PolarHBondContact O-N 3.36Å; N427-E429 VanDerWaalsContact O-N 3.15Å; N427-E430 PolarHBondContact ND2-OE1 3.4Å; N427-E430 PolarHBondContact O-N 2.57Å; N427-E430 WeakPolarHBondContact OD1-CB 3.31Å; N427-E430 VanDerWaalsContact OD1-CG 3.28Å; N427-E430 WeakPolarHBondContact OD1-CG 3.29Å; N427-E430 PolarHBondContact OD1-N 2.86Å; N427-E430 PolarHBondContact OD1-OE1 2.75Å; N427-E431 WeakPolarHBondContact O-CB 3.41Å; N427-E431 PolarHBondContact O-N 3.16Å
428	S	76.8	Confident	85.9	Confident	103 Å²	103	36 Å²	36	72%	0.72	19%	0.189	S	C	*	.	H	α-helix	trans	-58.5	-31.5	-172.1	53.2	0	0	0	0	114.2	Q432	S428-Q432 WeakPolarHBondContact O-CB 3.44Å; S428-Q432 PolarHBondContact O-N 3.05Å
429	E	80.1	Confident	86	Confident	95 Å²	95	37.7 Å²	37.7	44%	0.444	19%	0.194	S	C	.	.	H	α-helix	trans	-82	-41.1	-178	-65.2	-171.8	134.4	0	0	113.6	N427 F433 R517	N427-E429 PolarHBondContact O-N 3.36Å; N427-E429 VanDerWaalsContact O-N 3.15Å; E429-F433 PolarHBondContact O-N 2.96Å; E429-F433 VanDerWaalsContact O-N 3.16Å; E429-R517 IonicContact OE1-CZ 3.68Å; E429-R517 IonicContact OE1-NH1 3.3Å; E429-R517 IonicContact OE1-NH2 3.36Å; E429-R517 PolarHBondContact OE1-NH2 3.08Å; E429-R517 IonicContact OE2-CZ 3.13Å; E429-R517 IonicContact OE2-NH1 2.64Å; E429-R517 PolarHBondContact OE2-NH1 2.79Å; E429-R517 IonicContact OE2-NH2 2.68Å; E429-R517 PolarHBondContact OE2-NH2 3.49Å
430	E	81.5	Confident	86	Confident	5 Å²	5	39.7 Å²	39.7	2%	0.023	21%	0.208	C	C	.	.	H	α-helix	trans	-76.4	-39.5	178.7	-72.7	167.1	-128.5	0	0	111.8	A425 N427 Q432 F433 V434 S482 Y516	A425-E430 WeakPolarHBondContact CB-OE2 3.38Å; A425-E430 PolarHBondContact N-OE2 3.17Å; N427-E430 PolarHBondContact ND2-OE1 3.4Å; N427-E430 PolarHBondContact O-N 2.57Å; N427-E430 WeakPolarHBondContact OD1-CB 3.31Å; N427-E430 VanDerWaalsContact OD1-CG 3.28Å; N427-E430 WeakPolarHBondContact OD1-CG 3.29Å; N427-E430 PolarHBondContact OD1-N 2.86Å; N427-E430 PolarHBondContact OD1-OE1 2.75Å; E430-Q432 PolarHBondContact O-N 2.89Å; E430-F433 PolarHBondContact O-N 2.79Å; E430-F433 VanDerWaalsContact O-N 3.09Å; E430-V434 WeakPolarHBondContact O-CB 3.44Å; E430-V434 VanDerWaalsContact O-CG2 3.31Å; E430-V434 WeakPolarHBondContact O-CG2 3.48Å; E430-V434 PolarHBondContact O-N 3.46Å; E430-S482 VanDerWaalsContact CD-CB 3.42Å; E430-S482 WeakPolarHBondContact OE1-CB 3.48Å; E430-S482 PolarHBondContact OE1-OG 3.09Å; E430-S482 PolarHBondContact OE2-OG 2.81Å; E430-Y516 HydrophobicContact CG-CD1 4.03Å; E430-Y516 HydrophobicContact CG-CE1 4.37Å
431	E	84.8	Confident	85.8	Confident	78 Å²	78	40.7 Å²	40.7	36%	0.364	21%	0.214	S	C	.	.	H	α-helix	trans	-56.9	-44.3	174.6	-174.8	177.4	175.4	0	0	110	Y424 N427 F433 V434 L435	Y424-E431 HydrophobicContact CD2-CB 4.49Å; Y424-E431 HydrophobicContact CE2-CB 3.9Å; Y424-E431 HydrophobicContact CE2-CG 4.03Å; N427-E431 WeakPolarHBondContact O-CB 3.41Å; N427-E431 PolarHBondContact O-N 3.16Å; E431-F433 PolarHBondContact O-N 2.73Å; E431-V434 PolarHBondContact O-N 2.85Å; E431-L435 HydrophobicContact CG-CD1 3.75Å; E431-L435 HydrophobicContact CG-CG 4.36Å; E431-L435 WeakPolarHBondContact O-CB 3.4Å; E431-L435 WeakPolarHBondContact O-CG 3.45Å; E431-L435 PolarHBondContact O-N 2.97Å
432	Q	86.1	Confident	85.7	Confident	122 Å²	122	40.7 Å²	40.7	57%	0.57	21%	0.214	S	C	*	.	H	α-helix	trans	-61.8	-44.2	174.3	-172.2	65.2	6	0	0	112	S428 E430 S436	S428-Q432 WeakPolarHBondContact O-CB 3.44Å; S428-Q432 PolarHBondContact O-N 3.05Å; E430-Q432 PolarHBondContact O-N 2.89Å; Q432-S436 WeakPolarHBondContact O-CB 3.25Å; Q432-S436 PolarHBondContact O-N 3.41Å; Q432-S436 PolarHBondContact O-OG 2.88Å
433	F	87.3	Confident	85.5	Confident	8 Å²	8	42.8 Å²	42.8	4%	0.035	22%	0.224	C	C	.	.	I	π-helix	trans	-63.9	-43.8	177.5	170.8	-108	0	0	0	112.6	E429 E430 E431 T437 L438 V480 V514 Y516 W540	E429-F433 PolarHBondContact O-N 2.96Å; E429-F433 VanDerWaalsContact O-N 3.16Å; E430-F433 PolarHBondContact O-N 2.79Å; E430-F433 VanDerWaalsContact O-N 3.09Å; E431-F433 PolarHBondContact O-N 2.73Å; F433-T437 HydrophobicContact CD2-CG2 4.34Å; F433-T437 HydrophobicContact CE2-CG2 4.08Å; F433-T437 WeakPolarHBondContact O-CA 3.01Å; F433-T437 VanDerWaalsContact O-CB 3.26Å; F433-T437 WeakPolarHBondContact O-CB 3.44Å; F433-T437 PolarHBondContact O-N 2.82Å; F433-T437 VanDerWaalsContact O-N 3.08Å; F433-L438 PolarHBondContact O-N 3.15Å; F433-V480 HydrophobicContact CD1-CG1 4.16Å; F433-V480 HydrophobicContact CE1-CG1 4.16Å; F433-V514 HydrophobicContact CE1-CG1 4.49Å; F433-Y516 HydrophobicContact CB-CD2 4.29Å; F433-Y516 HydrophobicContact CB-CE1 4.34Å; F433-Y516 HydrophobicContact CB-CE2 3.8Å; F433-Y516 AromaticContact CD1-CD2 3.58Å; F433-Y516 HydrophobicContact CD1-CD2 3.58Å; F433-Y516 AromaticContact CD1-CE2 3.95Å; F433-Y516 HydrophobicContact CD1-CE2 3.95Å; F433-Y516 AromaticContact CD1-CG 3.96Å; F433-Y516 HydrophobicContact CD1-CG 3.96Å; F433-Y516 AromaticContact CD2-CD2 3.74Å; F433-Y516 HydrophobicContact CD2-CD2 3.74Å; F433-Y516 AromaticContact CD2-CE2 3.43Å; F433-Y516 HydrophobicContact CD2-CE2 3.43Å; F433-Y516 VanDerWaalsContact CD2-CE2 3.43Å; F433-Y516 AromaticContact CE1-CD2 3.73Å; F433-Y516 HydrophobicContact CE1-CD2 3.73Å; F433-Y516 HydrophobicContact CE1-CE2 4.41Å; F433-Y516 HydrophobicContact CE1-CG 4.21Å; F433-Y516 AromaticContact CE2-CD2 3.88Å; F433-Y516 HydrophobicContact CE2-CD2 3.88Å; F433-Y516 AromaticContact CE2-CE2 3.95Å; F433-Y516 HydrophobicContact CE2-CE2 3.95Å; F433-Y516 AromaticContact CG-CD2 3.58Å; F433-Y516 HydrophobicContact CG-CD2 3.58Å; F433-Y516 AromaticContact CG-CE2 3.43Å; F433-Y516 HydrophobicContact CG-CE2 3.43Å; F433-Y516 VanDerWaalsContact CG-CE2 3.43Å; F433-Y516 HydrophobicContact CG-CG 4.27Å; F433-Y516 AromaticContact CG-CZ 3.98Å; F433-Y516 AromaticContact CZ-CD2 3.87Å; F433-Y516 HydrophobicContact CZ-CD2 3.87Å; F433-Y516 HydrophobicContact CZ-CE2 4.4Å; F433-W540 AromaticContact CE2-CD2 3.72Å; F433-W540 HydrophobicContact CE2-CD2 3.72Å; F433-W540 AromaticContact CE2-CE2 3.65Å; F433-W540 AromaticContact CE2-CE3 3.94Å; F433-W540 HydrophobicContact CE2-CE3 3.94Å; F433-W540 HydrophobicContact CE2-CG 4.29Å; F433-W540 HydrophobicContact CE2-CH2 4.06Å; F433-W540 AromaticContact CE2-CZ2 3.84Å; F433-W540 HydrophobicContact CE2-CZ2 3.84Å; F433-W540 HydrophobicContact CE2-CZ3 4.1Å; F433-W540 AromaticContact CZ-CD2 3.92Å; F433-W540 HydrophobicContact CZ-CD2 3.92Å; F433-W540 AromaticContact CZ-CE3 3.95Å; F433-W540 HydrophobicContact CZ-CE3 3.95Å; F433-W540 HydrophobicContact CZ-CG 4.27Å; F433-W540 HydrophobicContact CZ-CZ3 4.38Å
434	V	88.7	Confident	85.2	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.255	C	S	.	.	I	π-helix	trans	-65.9	-49	179.6	173.1	0	0	0	0	110.6	I422 Y424 E430 E431 L438 R439 I452 V480	I422-V434 HydrophobicContact CB-CG1 4.46Å; I422-V434 HydrophobicContact CD1-CG1 4.29Å; I422-V434 HydrophobicContact CG2-CG1 3.73Å; I422-V434 HydrophobicContact CG2-CG2 4.33Å; Y424-V434 HydrophobicContact CD1-CB 4.16Å; Y424-V434 HydrophobicContact CD1-CG1 3.82Å; Y424-V434 HydrophobicContact CD1-CG2 3.93Å; Y424-V434 HydrophobicContact CD2-CG2 4.26Å; Y424-V434 HydrophobicContact CE1-CB 4.44Å; Y424-V434 HydrophobicContact CE1-CG1 3.95Å; Y424-V434 HydrophobicContact CG-CB 4.24Å; Y424-V434 HydrophobicContact CG-CG1 4.4Å; Y424-V434 HydrophobicContact CG-CG2 3.69Å; E430-V434 WeakPolarHBondContact O-CB 3.44Å; E430-V434 VanDerWaalsContact O-CG2 3.31Å; E430-V434 WeakPolarHBondContact O-CG2 3.48Å; E430-V434 PolarHBondContact O-N 3.46Å; E431-V434 PolarHBondContact O-N 2.85Å; V434-L438 PolarHBondContact O-N 3.06Å; V434-R439 WeakPolarHBondContact O-CB 3.4Å; V434-R439 PolarHBondContact O-N 2.04Å; V434-I452 HydrophobicContact CG1-CD1 4.21Å; V434-V480 HydrophobicContact CG2-CB 4.38Å; V434-V480 HydrophobicContact CG2-CG1 4.49Å; V434-V480 HydrophobicContact CG2-CG2 3.85Å
435	L	86.1	Confident	85.1	Confident	55 Å²	55	54.4 Å²	54.4	29%	0.288	28%	0.282	S	S	.	.	I	π-helix	trans	-75.3	-44.6	-175.9	-64.8	177.9	0	0	0	112.6	E431 I452	E431-L435 HydrophobicContact CG-CD1 3.75Å; E431-L435 HydrophobicContact CG-CG 4.36Å; E431-L435 WeakPolarHBondContact O-CB 3.4Å; E431-L435 WeakPolarHBondContact O-CG 3.45Å; E431-L435 PolarHBondContact O-N 2.97Å; L435-I452 HydrophobicContact CD2-CD1 3.84Å
436	S	85.3	Confident	85.1	Confident	57 Å²	57	55.3 Å²	55.3	40%	0.399	29%	0.286	S	S	.	.	I	π-helix	trans	-82.2	-34.7	-173.5	83.8	0	0	0	0	113.5	Q432 S440	Q432-S436 WeakPolarHBondContact O-CB 3.25Å; Q432-S436 PolarHBondContact O-N 3.41Å; Q432-S436 PolarHBondContact O-OG 2.88Å; S436-S440 WeakPolarHBondContact O-CB 3.44Å
437	T	86.9	Confident	85.1	Confident	41 Å²	41	52.2 Å²	52.2	25%	0.252	28%	0.283	S	S	.	.	I	π-helix	trans	-108.8	-59.9	-171.7	-51.3	0	0	0	0	110.9	F433 V441 W540 W553	F433-T437 HydrophobicContact CD2-CG2 4.34Å; F433-T437 HydrophobicContact CE2-CG2 4.08Å; F433-T437 WeakPolarHBondContact O-CA 3.01Å; F433-T437 VanDerWaalsContact O-CB 3.26Å; F433-T437 WeakPolarHBondContact O-CB 3.44Å; F433-T437 PolarHBondContact O-N 2.82Å; F433-T437 VanDerWaalsContact O-N 3.08Å; T437-V441 VanDerWaalsContact O-CB 3.32Å; T437-V441 WeakPolarHBondContact O-CB 3.29Å; T437-V441 VanDerWaalsContact O-CG2 3.23Å; T437-V441 WeakPolarHBondContact O-CG2 3.49Å; T437-V441 PolarHBondContact O-N 3.1Å; T437-V441 VanDerWaalsContact O-N 3.09Å; T437-W540 HydrophobicContact CG2-CH2 3.78Å; T437-W540 HydrophobicContact CG2-CZ2 4.3Å; T437-W540 HydrophobicContact CG2-CZ3 4.48Å; T437-W553 HydrophobicContact CG2-CZ2 4.3Å
438	L	87.9	Confident	85.5	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.273	C	S	.	.	I	π-helix	trans	-70.1	-51.4	-170.8	-168.2	68.2	0	0	0	112.3	I422 F433 V434 L442 L478 V480 W553 L556	I422-L438 HydrophobicContact CD1-CD2 3.89Å; I422-L438 HydrophobicContact CD1-CG 4.23Å; I422-L438 HydrophobicContact CG2-CD2 4.22Å; F433-L438 PolarHBondContact O-N 3.15Å; V434-L438 PolarHBondContact O-N 3.06Å; L438-L442 HydrophobicContact CD1-CD1 4.13Å; L438-L442 HydrophobicContact CG-CD1 3.85Å; L438-L442 VanDerWaalsContact O-CB 3.27Å; L438-L442 WeakPolarHBondContact O-CB 3.01Å; L438-L442 WeakPolarHBondContact O-CD1 3.1Å; L438-L442 WeakPolarHBondContact O-CG 3.48Å; L438-L442 PolarHBondContact O-N 3.05Å; L438-L478 HydrophobicContact CD2-CD1 4.23Å; L438-L478 HydrophobicContact CD2-CD2 3.5Å; L438-V480 HydrophobicContact CD2-CG2 3.94Å; L438-W553 HydrophobicContact CD1-CH2 3.99Å; L438-W553 HydrophobicContact CD1-CZ3 3.99Å; L438-L556 HydrophobicContact CD1-CD2 4.13Å
439	R	89.8	Confident	86.1	Confident	70 Å²	70	47.4 Å²	47.4	26%	0.264	25%	0.25	S	S	.	.	I	π-helix	trans	-62.5	-51.4	177.1	176.7	-168.2	166.3	-176.4	-6.4	111	V434 V441 L442 E443 I452	V434-R439 WeakPolarHBondContact O-CB 3.4Å; V434-R439 PolarHBondContact O-N 2.04Å; R439-V441 VanDerWaalsContact C-N 3.31Å; R439-V441 PolarHBondContact O-N 3.11Å; R439-L442 PolarHBondContact O-N 3.44Å; R439-L442 VanDerWaalsContact O-N 3.16Å; R439-E443 HydrophobicContact CG-CG 4.14Å; R439-E443 VanDerWaalsContact CG-OE2 3.31Å; R439-E443 WeakPolarHBondContact CG-OE2 3.39Å; R439-E443 IonicContact CZ-OE2 3.83Å; R439-E443 IonicContact NE-OE1 2.75Å; R439-E443 IonicContact NE-OE2 3.63Å; R439-E443 PolarHBondContact NE-OE2 2.88Å; R439-E443 IonicContact NH2-OE2 2.78Å; R439-E443 WeakPolarHBondContact O-CB 3.42Å; R439-E443 PolarHBondContact O-N 2.99Å; R439-I452 HydrophobicContact CB-CD1 4.31Å; R439-I452 HydrophobicContact CG-CD1 4.23Å
440	S	87.3	Confident	86.6	Confident	45 Å²	45	43 Å²	43	32%	0.315	23%	0.23	S	C	.	.	H	α-helix	trans	-55.3	-46.6	-178.9	-174.4	0	0	0	0	111.8	S436 N444	S436-S440 WeakPolarHBondContact O-CB 3.44Å; S440-N444 WeakPolarHBondContact O-CB 3.42Å; S440-N444 PolarHBondContact O-N 2.8Å; S440-N444 PolarHBondContact O-ND2 3.17Å; S440-N444 PolarHBondContact OG-ND2 3.31Å
441	V	88.4	Confident	87	Confident	21 Å²	21	42.8 Å²	42.8	13%	0.127	23%	0.229	C	C	.	.	I	π-helix	trans	-68.8	-41.9	177.7	170.9	0	0	0	0	111.9	T437 R439 E445 L446 L548 W553	T437-V441 VanDerWaalsContact O-CB 3.32Å; T437-V441 WeakPolarHBondContact O-CB 3.29Å; T437-V441 VanDerWaalsContact O-CG2 3.23Å; T437-V441 WeakPolarHBondContact O-CG2 3.49Å; T437-V441 PolarHBondContact O-N 3.1Å; T437-V441 VanDerWaalsContact O-N 3.09Å; R439-V441 VanDerWaalsContact C-N 3.31Å; R439-V441 PolarHBondContact O-N 3.11Å; V441-E445 HydrophobicContact CG1-CB 4.36Å; V441-E445 WeakPolarHBondContact O-CB 3.29Å; V441-E445 PolarHBondContact O-N 3.46Å; V441-L446 HydrophobicContact CG1-CD1 3.96Å; V441-L446 HydrophobicContact CG1-CG 4.25Å; V441-L446 WeakPolarHBondContact O-CG 3.43Å; V441-L446 PolarHBondContact O-N 3.48Å; V441-L548 HydrophobicContact CB-CD2 4.41Å; V441-L548 HydrophobicContact CG1-CD2 3.37Å; V441-L548 HydrophobicContact CG2-CD2 4.14Å; V441-W553 HydrophobicContact CB-CH2 3.65Å; V441-W553 HydrophobicContact CB-CZ2 4.13Å; V441-W553 HydrophobicContact CB-CZ3 4.01Å; V441-W553 HydrophobicContact CG1-CD2 4.21Å; V441-W553 HydrophobicContact CG1-CE3 3.85Å; V441-W553 HydrophobicContact CG1-CH2 3.59Å; V441-W553 HydrophobicContact CG1-CZ2 3.97Å; V441-W553 HydrophobicContact CG1-CZ3 3.52Å; V441-W553 HydrophobicContact CG2-CH2 4.03Å; V441-W553 HydrophobicContact CG2-CZ2 4.03Å
442	L	88.5	Confident	87.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.212	C	C	.	.	I	π-helix	trans	-66.9	-41.5	-179.7	-72.6	171.2	0	0	0	112.5	I422 L438 R439 L446 G447 Y448 V450 L478 L560	I422-L442 HydrophobicContact CD1-CD1 4.07Å; L438-L442 HydrophobicContact CD1-CD1 4.13Å; L438-L442 HydrophobicContact CG-CD1 3.85Å; L438-L442 VanDerWaalsContact O-CB 3.27Å; L438-L442 WeakPolarHBondContact O-CB 3.01Å; L438-L442 WeakPolarHBondContact O-CD1 3.1Å; L438-L442 WeakPolarHBondContact O-CG 3.48Å; L438-L442 PolarHBondContact O-N 3.05Å; R439-L442 PolarHBondContact O-N 3.44Å; R439-L442 VanDerWaalsContact O-N 3.16Å; L442-L446 HydrophobicContact CD2-CD1 4.03Å; L442-L446 CarbonylContact O-C 3.26Å; L442-G447 PolarHBondContact O-N 2.79Å; L442-Y448 HydrophobicContact CD2-CD2 3.87Å; L442-Y448 HydrophobicContact CD2-CE2 4.39Å; L442-Y448 PolarHBondContact O-N 3.43Å; L442-V450 HydrophobicContact CB-CG2 3.66Å; L442-V450 HydrophobicContact CD1-CG2 4.24Å; L442-L478 HydrophobicContact CD1-CD1 4.41Å; L442-L560 HydrophobicContact CD2-CD1 3.57Å
443	E	87.9	Confident	87.2	Confident	45 Å²	45	34 Å²	34	21%	0.21	19%	0.188	C	C	.	.	I	π-helix	trans	-82.8	-46.8	-178.1	-66.9	-174.8	153.2	0	0	112.6	R439 G447 V450 R455	R439-E443 HydrophobicContact CG-CG 4.14Å; R439-E443 VanDerWaalsContact CG-OE2 3.31Å; R439-E443 WeakPolarHBondContact CG-OE2 3.39Å; R439-E443 IonicContact CZ-OE2 3.83Å; R439-E443 IonicContact NE-OE1 2.75Å; R439-E443 IonicContact NE-OE2 3.63Å; R439-E443 PolarHBondContact NE-OE2 2.88Å; R439-E443 IonicContact NH2-OE2 2.78Å; R439-E443 WeakPolarHBondContact O-CB 3.42Å; R439-E443 PolarHBondContact O-N 2.99Å; E443-G447 WeakPolarHBondContact O-CA 3.46Å; E443-G447 PolarHBondContact O-N 2.97Å; E443-V450 HydrophobicContact CG-CB 3.89Å; E443-V450 HydrophobicContact CG-CG2 3.67Å; E443-R455 IonicContact OE1-CZ 3.66Å; E443-R455 IonicContact OE1-NH1 2.71Å; E443-R455 PolarHBondContact OE1-NH1 2.8Å; E443-R455 IonicContact OE1-NH2 3.18Å; E443-R455 IonicContact OE2-NH1 3.94Å; E443-R455 PolarHBondContact OE2-NH1 3.2Å
444	N	85.2	Confident	87	Confident	120 Å²	120	37.2 Å²	37.2	64%	0.642	21%	0.205	S	C	*	.	I	π-helix	trans	-89.2	-45.3	-171	-57.8	-38.5	0	0	0	112.7	S440	S440-N444 WeakPolarHBondContact O-CB 3.42Å; S440-N444 PolarHBondContact O-N 2.8Å; S440-N444 PolarHBondContact O-ND2 3.17Å; S440-N444 PolarHBondContact OG-ND2 3.31Å
445	E	84.6	Confident	86.8	Confident	129 Å²	129	41.5 Å²	41.5	60%	0.603	22%	0.221	S	C	*	.	I	π-helix	trans	-88.5	-31.5	-175	-60	-70.9	169.1	0	0	112.4	V441 L548	V441-E445 HydrophobicContact CG1-CB 4.36Å; V441-E445 WeakPolarHBondContact O-CB 3.29Å; V441-E445 PolarHBondContact O-N 3.46Å; E445-L548 HydrophobicContact CB-CD1 4.3Å; E445-L548 HydrophobicContact CG-CD1 4.19Å
446	L	82.4	Confident	86.7	Confident	27 Å²	27	41 Å²	41	14%	0.141	22%	0.219	C	C	.	.	S	Bend	trans	-110.8	-13.9	-177	-55.9	175.1	0	0	0	113.4	V441 L442 Y448 R563	V441-L446 HydrophobicContact CG1-CD1 3.96Å; V441-L446 HydrophobicContact CG1-CG 4.25Å; V441-L446 WeakPolarHBondContact O-CG 3.43Å; V441-L446 PolarHBondContact O-N 3.48Å; L442-L446 HydrophobicContact CD2-CD1 4.03Å; L442-L446 CarbonylContact O-C 3.26Å; L446-Y448 VanDerWaalsContact C-N 3.33Å; L446-Y448 HydrophobicContact CB-CD2 3.59Å; L446-Y448 HydrophobicContact CB-CE2 3.69Å; L446-Y448 HydrophobicContact CD1-CD2 4.47Å; L446-Y448 HydrophobicContact CD1-CE2 4.23Å; L446-Y448 PolarHBondContact O-N 2.04Å; L446-R563 PolarHBondContact O-NH1 3.3Å; L446-R563 VanDerWaalsContact O-NH1 3.09Å
447	G	82.9	Confident	86.6	Confident	26 Å²	26	39.9 Å²	39.9	27%	0.268	21%	0.211	S	C	.	.			trans	66.4	21.6	174.1	0	0	0	0	0	116.3	R411 L442 E443 R563	R411-G447 PolarHBondContact NH2-O 2.75Å; R411-G447 VanDerWaalsContact NH2-O 3.09Å; L442-G447 PolarHBondContact O-N 2.79Å; E443-G447 WeakPolarHBondContact O-CA 3.46Å; E443-G447 PolarHBondContact O-N 2.97Å; G447-R563 PolarHBondContact O-NH1 3.09Å
448	Y	87.7	Confident	86.2	Confident	16 Å²	16	44.6 Å²	44.6	6%	0.063	23%	0.234	C	C	.	.			trans	-72.3	144.6	174.2	-70.5	-73.6	0	0	0	111.1	D419 L442 L446 V450 L560 P561	D419-Y448 HydrophobicContact CB-CD1 3.78Å; D419-Y448 HydrophobicContact CB-CG 4.45Å; D419-Y448 WeakPolarHBondContact OD2-CA 3.42Å; L442-Y448 HydrophobicContact CD2-CD2 3.87Å; L442-Y448 HydrophobicContact CD2-CE2 4.39Å; L442-Y448 PolarHBondContact O-N 3.43Å; L446-Y448 VanDerWaalsContact C-N 3.33Å; L446-Y448 HydrophobicContact CB-CD2 3.59Å; L446-Y448 HydrophobicContact CB-CE2 3.69Å; L446-Y448 HydrophobicContact CD1-CD2 4.47Å; L446-Y448 HydrophobicContact CD1-CE2 4.23Å; L446-Y448 PolarHBondContact O-N 2.04Å; Y448-V450 PolarHBondContact O-N 2.93Å; Y448-L560 HydrophobicContact CD2-CD1 4.24Å; Y448-L560 HydrophobicContact CE1-CB 4.3Å; Y448-L560 HydrophobicContact CE2-CB 4.47Å; Y448-L560 HydrophobicContact CE2-CD1 3.71Å; Y448-P561 PolarHBondContact OH-O 3.1Å
449	S	88.5	Confident	85.5	Confident	36 Å²	36	51 Å²	51	25%	0.252	28%	0.276	S	S	.	.			trans	-80.1	108.7	168.3	55	0	0	0	0	109.4	E417 F418 D419 V420	E417-S449 PolarHBondContact O-OG 2.93Å; F418-S449 WeakPolarHBondContact CA-OG 3.4Å; D419-S449 PolarHBondContact N-O 2.73Å; D419-S449 PolarHBondContact N-OG 3.41Å; D419-S449 PolarHBondContact OD2-N 3.37Å; D419-S449 PolarHBondContact OD2-OG 2.86Å; V420-S449 PolarHBondContact N-O 3.04Å
450	V	90.6	Very high	84.5	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.012	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	132	-178.1	-179.7	0	0	0	0	109.4	V420 I422 L442 E443 Y448 I452 R455	V420-V450 CarbonylContact O-C 3.6Å; V420-V450 WeakPolarHBondContact O-CA 3.41Å; I422-V450 HydrophobicContact CD1-CG1 3.39Å; I422-V450 HydrophobicContact CG1-CG1 3.81Å; L442-V450 HydrophobicContact CB-CG2 3.66Å; L442-V450 HydrophobicContact CD1-CG2 4.24Å; E443-V450 HydrophobicContact CG-CB 3.89Å; E443-V450 HydrophobicContact CG-CG2 3.67Å; Y448-V450 PolarHBondContact O-N 2.93Å; V450-I452 HydrophobicContact CG1-CD1 4.38Å; V450-I452 HydrophobicContact CG1-CG1 4.07Å; V450-R455 PolarHBondContact O-NH2 2.88Å
451	C	90.1	Very high	83.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	129.9	170.9	-174	0	0	0	0	110.6	F418 V420 Y421 I422 D456 F470	F418-C451 HydrophobicContact CB-CB 3.99Å; F418-C451 HydrophobicContact CD1-CB 3.58Å; F418-C451 HydrophobicContact CD2-CB 3.87Å; F418-C451 HydrophobicContact CE1-CB 3.91Å; F418-C451 HydrophobicContact CE2-CB 4.19Å; F418-C451 HydrophobicContact CG-CB 3.54Å; F418-C451 HydrophobicContact CZ-CB 4.2Å; V420-C451 PolarHBondContact O-N 3.14Å; Y421-C451 WeakPolarHBondContact CA-O 3.12Å; Y421-C451 HydrophobicContact CD2-CB 3.88Å; I422-C451 PolarHBondContact N-O 3.4Å; C451-D456 VanDerWaalsContact CA-OD2 3.29Å; C451-D456 WeakPolarHBondContact CA-OD2 3.48Å; C451-F470 WeakPolarHBondContact SG-CD1 3.34Å
452	I	89.3	Confident	83.5	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.01	33%	0.327	C	S	.	.			trans	-130.9	125.2	173.5	-60	175.5	0	0	0	107.9	I422 Y424 V434 L435 R439 V450 D454 R455 D456	I422-I452 HydrophobicContact CB-CG1 4.43Å; Y424-I452 HydrophobicContact CE1-CG2 3.84Å; V434-I452 HydrophobicContact CG1-CD1 4.21Å; L435-I452 HydrophobicContact CD2-CD1 3.84Å; R439-I452 HydrophobicContact CB-CD1 4.31Å; R439-I452 HydrophobicContact CG-CD1 4.23Å; V450-I452 HydrophobicContact CG1-CD1 4.38Å; V450-I452 HydrophobicContact CG1-CG1 4.07Å; I452-D454 VanDerWaalsContact C-N 3.3Å; I452-D454 PolarHBondContact O-N 3.32Å; I452-R455 PolarHBondContact O-N 3.23Å; I452-R455 VanDerWaalsContact O-N 3.07Å; I452-D456 PolarHBondContact N-OD2 3.49Å; I452-D456 PolarHBondContact O-N 3.07Å
453	F	86.4	Confident	83.1	Confident	15 Å²	15	58.7 Å²	58.7	7%	0.066	35%	0.35	C	S	.	.	H	α-helix	trans	-51.4	-48.3	-176.9	-170.9	-86.1	0	0	0	113	Y421 R455 D456 S457 I463 E466 T467 F470 Q491	Y421-F453 WeakPolarHBondContact OH-CB 3.43Å; F453-R455 PolarHBondContact O-N 2.85Å; F453-R455 VanDerWaalsContact O-N 3.1Å; F453-D456 PolarHBondContact O-N 2.89Å; F453-S457 WeakPolarHBondContact O-CB 3.18Å; F453-S457 PolarHBondContact O-N 2.8Å; F453-S457 PolarHBondContact O-OG 2.84Å; F453-I463 HydrophobicContact CE1-CG2 4.48Å; F453-I463 HydrophobicContact CE2-CG2 4.41Å; F453-I463 HydrophobicContact CZ-CB 4.38Å; F453-I463 HydrophobicContact CZ-CG1 4.45Å; F453-I463 HydrophobicContact CZ-CG2 3.9Å; F453-E466 HydrophobicContact CE2-CB 3.96Å; F453-T467 WeakPolarHBondContact CE2-OG1 3.28Å; F453-F470 HydrophobicContact CD2-CD2 4.18Å; F453-F470 HydrophobicContact CD2-CE2 4.39Å; F453-Q491 VanDerWaalsContact CD2-NE2 3.27Å; F453-Q491 VanDerWaalsContact CZ-NE2 3.34Å
454	D	82.9	Confident	82.8	Confident	74 Å²	74	59.7 Å²	59.7	40%	0.396	36%	0.359	S	S	.	.	H	α-helix	trans	-67.2	-14.8	-173.7	-58.7	-23	0	0	0	113.3	Y424 R426 I452	Y424-D454 PolarHBondContact OH-OD2 2.92Å; R426-D454 IonicContact CZ-OD1 2.97Å; R426-D454 VanDerWaalsContact CZ-OD1 3.29Å; R426-D454 IonicContact CZ-OD2 2.68Å; R426-D454 IonicContact NE-OD1 2.82Å; R426-D454 PolarHBondContact NE-OD1 2.94Å; R426-D454 IonicContact NE-OD2 3.51Å; R426-D454 PolarHBondContact NE-OD2 3Å; R426-D454 VanDerWaalsContact NE-OD2 3.16Å; R426-D454 IonicContact NH2-OD1 3.68Å; R426-D454 PolarHBondContact NH2-OD1 3.09Å; R426-D454 IonicContact NH2-OD2 2.59Å; I452-D454 VanDerWaalsContact C-N 3.3Å; I452-D454 PolarHBondContact O-N 3.32Å
455	R	83.8	Confident	82.7	Confident	91 Å²	91	58.8 Å²	58.8	34%	0.343	35%	0.354	S	S	.	.	H	α-helix	trans	-104.5	-41.6	177.9	-172.9	-168.6	70.7	-167.5	-11	112.6	E443 V450 I452 F453	E443-R455 IonicContact OE1-CZ 3.66Å; E443-R455 IonicContact OE1-NH1 2.71Å; E443-R455 PolarHBondContact OE1-NH1 2.8Å; E443-R455 IonicContact OE1-NH2 3.18Å; E443-R455 IonicContact OE2-NH1 3.94Å; E443-R455 PolarHBondContact OE2-NH1 3.2Å; V450-R455 PolarHBondContact O-NH2 2.88Å; I452-R455 PolarHBondContact O-N 3.23Å; I452-R455 VanDerWaalsContact O-N 3.07Å; F453-R455 PolarHBondContact O-N 2.85Å; F453-R455 VanDerWaalsContact O-N 3.1Å
456	D	84.5	Confident	82.7	Confident	43 Å²	43	54.2 Å²	54.2	23%	0.23	33%	0.333	C	S	.	.	H	α-helix	trans	-99.8	-9	-166.3	-57.4	-40.4	0	0	0	113.2	C451 I452 F453 F470	C451-D456 VanDerWaalsContact CA-OD2 3.29Å; C451-D456 WeakPolarHBondContact CA-OD2 3.48Å; I452-D456 PolarHBondContact N-OD2 3.49Å; I452-D456 PolarHBondContact O-N 3.07Å; F453-D456 PolarHBondContact O-N 2.89Å; D456-F470 HydrophobicContact CB-CE1 4.32Å; D456-F470 HydrophobicContact CB-CZ 4.33Å; D456-F470 VanDerWaalsContact O-CZ 3.28Å; D456-F470 WeakPolarHBondContact O-CZ 3.33Å
457	S	83.4	Confident	82.8	Confident	35 Å²	35	53 Å²	53	25%	0.245	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-71.1	139.3	172.3	56.5	0	0	0	0	111.7	F453 E466	F453-S457 WeakPolarHBondContact O-CB 3.18Å; F453-S457 PolarHBondContact O-N 2.8Å; F453-S457 PolarHBondContact O-OG 2.84Å; S457-E466 WeakPolarHBondContact CB-OE2 3.33Å
458	L	78.6	Confident	83	Confident	139 Å²	139	56.1 Å²	56.1	73%	0.728	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-92	139.2	175.7	-68.3	171.1	0	0	0	109.1	G460	L458-G460 PolarHBondContact O-N 2.71Å; L458-G460 VanDerWaalsContact O-N 3.16Å
459	P	72.5	Confident	82.9	Confident	136 Å²	136	57.5 Å²	57.5	88%	0.883	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	117.6	178.4	25.6	-32.1	0	0	0	110.8
460	G	69	Low	82.9	Confident	84 Å²	84	56.3 Å²	56.3	87%	0.866	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	135.8	-9.9	170.9	0	0	0	0	0	117	L458	L458-G460 PolarHBondContact O-N 2.71Å; L458-G460 VanDerWaalsContact O-N 3.16Å
461	G	74.6	Confident	82.7	Confident	43 Å²	43	56.4 Å²	56.4	44%	0.443	34%	0.339	S	S	.	.	S	Bend	trans	-88.8	171.9	176.9	0	0	0	0	0	114.8	E466	G461-E466 VanDerWaalsContact CA-OE1 3.29Å; G461-E466 WeakPolarHBondContact CA-OE1 3.5Å; G461-E466 PolarHBondContact N-OE1 3.25Å
462	T	79.9	Confident	82.5	Confident	75 Å²	75	59.2 Å²	59.2	46%	0.46	36%	0.363	S	S	.	.			trans	-79.3	130.8	169.9	57.5	0	0	0	0	109	T464 D465 E466	T462-T464 PolarHBondContact O-N 3.24Å; T462-T464 VanDerWaalsContact O-N 3.08Å; T462-D465 PolarHBondContact O-N 2.93Å; T462-D465 VanDerWaalsContact OG1-CB 3.26Å; T462-D465 WeakPolarHBondContact OG1-CB 3.02Å; T462-D465 PolarHBondContact OG1-OD2 3.12Å; T462-E466 PolarHBondContact O-N 3.44Å; T462-E466 VanDerWaalsContact O-N 3.12Å
463	I	80.1	Confident	82.5	Confident	94 Å²	94	63.5 Å²	63.5	48%	0.482	38%	0.379	S	S	.	.	H	α-helix	trans	-55	-34.3	-177.8	-62.1	170.4	0	0	0	111.4	F453 T467 Q491	F453-I463 HydrophobicContact CE1-CG2 4.48Å; F453-I463 HydrophobicContact CE2-CG2 4.41Å; F453-I463 HydrophobicContact CZ-CB 4.38Å; F453-I463 HydrophobicContact CZ-CG1 4.45Å; F453-I463 HydrophobicContact CZ-CG2 3.9Å; I463-T467 VanDerWaalsContact O-CB 3.27Å; I463-T467 WeakPolarHBondContact O-CB 3.36Å; I463-T467 PolarHBondContact O-N 3.47Å; I463-T467 VanDerWaalsContact O-N 3.12Å; I463-T467 PolarHBondContact O-OG1 2.78Å; I463-Q491 HydrophobicContact CG2-CG 4.11Å
464	T	81.8	Confident	82.6	Confident	67 Å²	67	62.8 Å²	62.8	41%	0.411	38%	0.376	S	S	.	.	H	α-helix	trans	-69.1	-47.2	-179.5	51.3	0	0	0	0	113.1	T462 T467 L468 L494	T462-T464 PolarHBondContact O-N 3.24Å; T462-T464 VanDerWaalsContact O-N 3.08Å; T464-T467 PolarHBondContact O-N 3.05Å; T464-L468 WeakPolarHBondContact O-CG 2.94Å; T464-L468 PolarHBondContact O-N 2.88Å; T464-L468 VanDerWaalsContact O-N 3.07Å; T464-L494 HydrophobicContact CG2-CD2 3.86Å
465	D	82.9	Confident	82.9	Confident	100 Å²	100	59.6 Å²	59.6	54%	0.535	36%	0.358	S	S	.	.	H	α-helix	trans	-75	-37	-174.6	-59.9	-22.9	0	0	0	110.4	T462 L468 S469	T462-D465 PolarHBondContact O-N 2.93Å; T462-D465 VanDerWaalsContact OG1-CB 3.26Å; T462-D465 WeakPolarHBondContact OG1-CB 3.02Å; T462-D465 PolarHBondContact OG1-OD2 3.12Å; D465-L468 PolarHBondContact O-N 2.97Å; D465-S469 WeakPolarHBondContact O-CB 3.29Å; D465-S469 PolarHBondContact O-N 3.38Å
466	E	84.1	Confident	83.2	Confident	34 Å²	34	55.9 Å²	55.9	16%	0.159	34%	0.344	C	S	.	.	H	α-helix	trans	-62.5	-45.5	173.2	-72.6	-172.6	176.5	0	0	111.7	F453 S457 G461 T462 L468 S469 F470	F453-E466 HydrophobicContact CE2-CB 3.96Å; S457-E466 WeakPolarHBondContact CB-OE2 3.33Å; G461-E466 VanDerWaalsContact CA-OE1 3.29Å; G461-E466 WeakPolarHBondContact CA-OE1 3.5Å; G461-E466 PolarHBondContact N-OE1 3.25Å; T462-E466 PolarHBondContact O-N 3.44Å; T462-E466 VanDerWaalsContact O-N 3.12Å; E466-L468 PolarHBondContact O-N 3.46Å; E466-S469 PolarHBondContact O-N 3.21Å; E466-S469 VanDerWaalsContact O-N 3.16Å; E466-S469 PolarHBondContact O-OG 3.31Å; E466-F470 HydrophobicContact CB-CD2 4.49Å; E466-F470 HydrophobicContact CB-CE2 4.23Å; E466-F470 WeakPolarHBondContact O-CD2 3.34Å; E466-F470 PolarHBondContact O-N 2.67Å
467	T	85.4	Confident	83.5	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-58.8	-46.9	176.6	-62.2	0	0	0	0	111.4	F453 I463 T464 S469 F470 V471 E495	F453-T467 WeakPolarHBondContact CE2-OG1 3.28Å; I463-T467 VanDerWaalsContact O-CB 3.27Å; I463-T467 WeakPolarHBondContact O-CB 3.36Å; I463-T467 PolarHBondContact O-N 3.47Å; I463-T467 VanDerWaalsContact O-N 3.12Å; I463-T467 PolarHBondContact O-OG1 2.78Å; T464-T467 PolarHBondContact O-N 3.05Å; T467-S469 VanDerWaalsContact C-N 3.3Å; T467-S469 PolarHBondContact O-N 2.74Å; T467-F470 PolarHBondContact O-N 2.87Å; T467-V471 HydrophobicContact CG2-CG2 4.44Å; T467-V471 WeakPolarHBondContact O-CB 3.46Å; T467-V471 VanDerWaalsContact O-CG2 3.25Å; T467-V471 WeakPolarHBondContact O-CG2 3.05Å; T467-V471 PolarHBondContact O-N 3.29Å; T467-E495 HydrophobicContact CG2-CB 4.2Å; T467-E495 HydrophobicContact CG2-CG 3.49Å; T467-E495 VanDerWaalsContact CG2-CG 3.49Å
468	L	86.1	Confident	83.9	Confident	92 Å²	92	52.1 Å²	52.1	48%	0.482	32%	0.321	S	S	.	.	H	α-helix	trans	-62	-39.5	177.1	-72.1	169.5	0	0	0	111.6	T464 D465 E466 A472 A498	T464-L468 WeakPolarHBondContact O-CG 2.94Å; T464-L468 PolarHBondContact O-N 2.88Å; T464-L468 VanDerWaalsContact O-N 3.07Å; D465-L468 PolarHBondContact O-N 2.97Å; E466-L468 PolarHBondContact O-N 3.46Å; L468-A472 VanDerWaalsContact O-CB 3.31Å; L468-A472 WeakPolarHBondContact O-CB 3.45Å; L468-A472 PolarHBondContact O-N 2.83Å; L468-A498 HydrophobicContact CD2-CB 3.65Å
469	S	86.1	Confident	84.4	Confident	45 Å²	45	45.5 Å²	45.5	32%	0.315	29%	0.287	S	S	.	.	H	α-helix	trans	-65.1	-45.6	178.1	82	0	0	0	0	112.4	D465 E466 T467 A472 R473	D465-S469 WeakPolarHBondContact O-CB 3.29Å; D465-S469 PolarHBondContact O-N 3.38Å; E466-S469 PolarHBondContact O-N 3.21Å; E466-S469 VanDerWaalsContact O-N 3.16Å; E466-S469 PolarHBondContact O-OG 3.31Å; T467-S469 VanDerWaalsContact C-N 3.3Å; T467-S469 PolarHBondContact O-N 2.74Å; S469-A472 PolarHBondContact O-N 3.41Å; S469-R473 WeakPolarHBondContact O-CB 3.22Å; S469-R473 VanDerWaalsContact O-CD 3.23Å; S469-R473 WeakPolarHBondContact O-CD 3.41Å; S469-R473 WeakPolarHBondContact O-CG 3.48Å; S469-R473 PolarHBondContact O-N 3.23Å
470	F	88.3	Confident	85.2	Confident	12 Å²	12	39 Å²	39	5%	0.053	25%	0.245	C	C	.	.	H	α-helix	trans	-67.2	-39.6	179.1	-72	-54.6	0	0	0	112	F418 Y421 C451 F453 D456 E466 T467 A472 R473 S474	F418-F470 HydrophobicContact CE2-CD1 4.15Å; F418-F470 HydrophobicContact CE2-CE1 4.42Å; Y421-F470 HydrophobicContact CD2-CB 3.71Å; Y421-F470 HydrophobicContact CE2-CB 3.49Å; Y421-F470 VanDerWaalsContact CE2-CB 3.49Å; Y421-F470 HydrophobicContact CE2-CD2 4.47Å; Y421-F470 HydrophobicContact CE2-CG 4.23Å; C451-F470 WeakPolarHBondContact SG-CD1 3.34Å; F453-F470 HydrophobicContact CD2-CD2 4.18Å; F453-F470 HydrophobicContact CD2-CE2 4.39Å; D456-F470 HydrophobicContact CB-CE1 4.32Å; D456-F470 HydrophobicContact CB-CZ 4.33Å; D456-F470 VanDerWaalsContact O-CZ 3.28Å; D456-F470 WeakPolarHBondContact O-CZ 3.33Å; E466-F470 HydrophobicContact CB-CD2 4.49Å; E466-F470 HydrophobicContact CB-CE2 4.23Å; E466-F470 WeakPolarHBondContact O-CD2 3.34Å; E466-F470 PolarHBondContact O-N 2.67Å; T467-F470 PolarHBondContact O-N 2.87Å; F470-A472 VanDerWaalsContact C-N 3.33Å; F470-R473 PolarHBondContact O-N 3.05Å; F470-S474 WeakPolarHBondContact O-CB 3.24Å; F470-S474 PolarHBondContact O-N 3.33Å; F470-S474 PolarHBondContact O-OG 2.82Å
471	V	87.6	Confident	85.9	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.018	21%	0.205	C	C	.	.	H	α-helix	trans	-63.4	-40.8	174.4	171.9	0	0	0	0	110.7	Y421 T467 S474 A498 L509	Y421-V471 HydrophobicContact CD1-CG2 4.38Å; Y421-V471 HydrophobicContact CE1-CG2 4.37Å; T467-V471 HydrophobicContact CG2-CG2 4.44Å; T467-V471 WeakPolarHBondContact O-CB 3.46Å; T467-V471 VanDerWaalsContact O-CG2 3.25Å; T467-V471 WeakPolarHBondContact O-CG2 3.05Å; T467-V471 PolarHBondContact O-N 3.29Å; V471-S474 PolarHBondContact O-N 3.03Å; V471-A498 HydrophobicContact CG1-CB 4.46Å; V471-A498 HydrophobicContact CG2-CB 4.34Å; V471-L509 HydrophobicContact CG1-CD2 3.55Å
472	A	85.4	Confident	86.1	Confident	60 Å²	60	33.3 Å²	33.3	50%	0.496	18%	0.184	S	C	.	.	H	α-helix	trans	-66.6	-38	177.7	0	0	0	0	0	113	L468 S469 F470 S474	L468-A472 VanDerWaalsContact O-CB 3.31Å; L468-A472 WeakPolarHBondContact O-CB 3.45Å; L468-A472 PolarHBondContact O-N 2.83Å; S469-A472 PolarHBondContact O-N 3.41Å; F470-A472 VanDerWaalsContact C-N 3.33Å; A472-S474 PolarHBondContact O-N 3.14Å
473	R	88.1	Confident	85.7	Confident	91 Å²	91	33.2 Å²	33.2	34%	0.343	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-2.1	179	-65.6	158.8	71.1	-176.4	7.4	113.7	K416 E417 F418 S469 F470	K416-R473 WeakPolarHBondContact CB-O 3.49Å; E417-R473 PolarHBondContact N-O 3.49Å; E417-R473 IonicContact OE1-CZ 3.84Å; E417-R473 IonicContact OE1-NH2 2.8Å; E417-R473 PolarHBondContact OE1-NH2 2.92Å; E417-R473 IonicContact OE2-CZ 2.98Å; E417-R473 IonicContact OE2-NE 3.13Å; E417-R473 PolarHBondContact OE2-NE 3.09Å; E417-R473 IonicContact OE2-NH2 3.93Å; E417-R473 PolarHBondContact OE2-NH2 3.26Å; F418-R473 HydrophobicContact CD2-CB 4.35Å; F418-R473 PolarHBondContact N-O 2.73Å; S469-R473 WeakPolarHBondContact O-CB 3.22Å; S469-R473 VanDerWaalsContact O-CD 3.23Å; S469-R473 WeakPolarHBondContact O-CD 3.41Å; S469-R473 WeakPolarHBondContact O-CG 3.48Å; S469-R473 PolarHBondContact O-N 3.23Å; F470-R473 PolarHBondContact O-N 3.05Å
474	S	89.7	Confident	85	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	144.2	-175.8	-62.2	0	0	0	0	113.5	K416 F418 Y421 F470 V471 A472 L509	K416-S474 WeakPolarHBondContact CD-O 3.48Å; K416-S474 PolarHBondContact NZ-O 2.92Å; F418-S474 CarbonylContact O-C 3.51Å; F418-S474 VanDerWaalsContact O-CA 3.28Å; F418-S474 WeakPolarHBondContact O-CA 3.25Å; Y421-S474 WeakPolarHBondContact CB-OG 3.41Å; F470-S474 WeakPolarHBondContact O-CB 3.24Å; F470-S474 PolarHBondContact O-N 3.33Å; F470-S474 PolarHBondContact O-OG 2.82Å; V471-S474 PolarHBondContact O-N 3.03Å; A472-S474 PolarHBondContact O-N 3.14Å; S474-L509 WeakPolarHBondContact O-CD1 3.38Å
475	R	88.4	Confident	84.5	Confident	7 Å²	7	27.3 Å²	27.3	3%	0.026	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-36.6	177.1	-67.1	179.5	-175.2	87.1	13.9	112.8	D414 K416 F418 D419 P561	D414-R475 VanDerWaalsContact CG-NE 3.29Å; D414-R475 IonicContact OD1-CZ 3.04Å; D414-R475 IonicContact OD1-NE 3.39Å; D414-R475 PolarHBondContact OD1-NE 3.01Å; D414-R475 IonicContact OD1-NH2 3.27Å; D414-R475 PolarHBondContact OD1-NH2 3.37Å; D414-R475 WeakPolarHBondContact OD2-CD 3.31Å; D414-R475 WeakPolarHBondContact OD2-CG 3.37Å; D414-R475 IonicContact OD2-CZ 3.24Å; D414-R475 IonicContact OD2-NE 2.68Å; D414-R475 PolarHBondContact OD2-NE 3.26Å; D414-R475 IonicContact OD2-NH2 2.82Å; K416-R475 HydrophobicContact CB-CG 3.99Å; K416-R475 HydrophobicContact CD-CB 4.42Å; K416-R475 HydrophobicContact CD-CG 3.67Å; K416-R475 HydrophobicContact CG-CG 4.46Å; K416-R475 PolarHBondContact O-NH1 3.36Å; K416-R475 PolarHBondContact O-NH2 3.32Å; F418-R475 PolarHBondContact O-N 2.69Å; D419-R475 WeakPolarHBondContact O-CB 3.33Å; D419-R475 IonicContact OD1-CZ 2.66Å; D419-R475 IonicContact OD1-NH1 3.02Å; D419-R475 PolarHBondContact OD1-NH1 3.06Å; R475-P561 HydrophobicContact CB-CG 3.94Å
476	R	90.8	Very high	83.4	Confident	13 Å²	13	24.2 Å²	24.2	5%	0.049	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	147.6	176.7	-57	-63.6	179.8	-90.4	-7.1	110.5	E410 D419 V420 Y421 R510 I512 E559 P561	E410-R476 IonicContact OE1-NH2 3.91Å; E410-R476 PolarHBondContact OE1-NH2 2.96Å; E410-R476 VanDerWaalsContact OE1-NH2 3.13Å; E410-R476 IonicContact OE2-CZ 2.9Å; E410-R476 IonicContact OE2-NH1 2.73Å; E410-R476 PolarHBondContact OE2-NH1 3.5Å; E410-R476 IonicContact OE2-NH2 3.92Å; E410-R476 PolarHBondContact OE2-NH2 2.85Å; D419-R476 PolarHBondContact O-N 3.42Å; V420-R476 CarbonylContact C-O 3.58Å; V420-R476 WeakPolarHBondContact CA-O 3.37Å; Y421-R476 PolarHBondContact N-O 2.83Å; R476-R510 CarbonylContact C-O 3.53Å; R476-R510 VanDerWaalsContact CA-O 3.3Å; R476-R510 WeakPolarHBondContact CA-O 3.31Å; R476-I512 HydrophobicContact CB-CD1 4.19Å; R476-I512 HydrophobicContact CG-CD1 4.25Å; R476-E559 PolarHBondContact NE-O 2.99Å; R476-P561 HydrophobicContact CG-CG 3.77Å
477	L	91.1	Very high	82.5	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	114.5	168	170.6	62.9	0	0	0	108.4	Y421 V479 L509 R510 V511 I512	Y421-L477 HydrophobicContact CD1-CD1 3.3Å; Y421-L477 HydrophobicContact CE1-CD1 4.1Å; Y421-L477 HydrophobicContact CG-CD1 4.16Å; Y421-L477 CarbonylContact O-C 3.58Å; Y421-L477 WeakPolarHBondContact O-CA 3.45Å; L477-V479 HydrophobicContact CD1-CG2 4.35Å; L477-V479 HydrophobicContact CD2-CG2 4.05Å; L477-V479 HydrophobicContact CG-CG2 3.85Å; L477-L509 HydrophobicContact CB-CD1 4.29Å; L477-L509 HydrophobicContact CB-CD2 4.1Å; L477-L509 HydrophobicContact CB-CG 4.36Å; L477-R510 PolarHBondContact N-O 2.87Å; L477-V511 HydrophobicContact CB-CG2 4.07Å; L477-V511 HydrophobicContact CD2-CG1 4.23Å; L477-V511 HydrophobicContact CD2-CG2 4Å; L477-V511 HydrophobicContact CG-CG1 4.27Å; L477-V511 HydrophobicContact CG-CG2 4.37Å; L477-V511 CarbonylContact O-C 3.49Å; L477-V511 VanDerWaalsContact O-CA 3.26Å; L477-V511 WeakPolarHBondContact O-CA 3.12Å; L477-I512 PolarHBondContact O-N 3.3Å
478	L	91.8	Very high	81.2	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	115.3	177.6	-169.9	158.7	0	0	0	109.2	V420 Y421 I422 S423 L438 L442 V480 I512 V514 L556	V420-L478 HydrophobicContact CG1-CB 3.57Å; V420-L478 HydrophobicContact CG1-CD1 4.23Å; Y421-L478 PolarHBondContact O-N 3.4Å; I422-L478 CarbonylContact C-O 3.58Å; I422-L478 WeakPolarHBondContact CA-O 3.46Å; I422-L478 HydrophobicContact CG1-CB 4.39Å; I422-L478 HydrophobicContact CG2-CD2 4.22Å; S423-L478 PolarHBondContact N-O 2.81Å; L438-L478 HydrophobicContact CD2-CD1 4.23Å; L438-L478 HydrophobicContact CD2-CD2 3.5Å; L442-L478 HydrophobicContact CD1-CD1 4.41Å; L478-V480 HydrophobicContact CD2-CG2 3.7Å; L478-I512 WeakPolarHBondContact CA-O 2.91Å; L478-V514 HydrophobicContact CD1-CG2 4.01Å; L478-V514 HydrophobicContact CD2-CB 3.97Å; L478-V514 HydrophobicContact CD2-CG2 3.56Å; L478-V514 HydrophobicContact CG-CG2 3.72Å; L478-L556 HydrophobicContact CD1-CD1 3.96Å; L478-L556 HydrophobicContact CD1-CD2 4.44Å
479	V	89.3	Confident	80.2	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	113	-176.2	175.1	0	0	0	0	109.4	S423 L477 V481 Y485 L496 V511 I512 L513 V514	S423-V479 CarbonylContact O-C 3.54Å; S423-V479 WeakPolarHBondContact O-CA 3.23Å; L477-V479 HydrophobicContact CD1-CG2 4.35Å; L477-V479 HydrophobicContact CD2-CG2 4.05Å; L477-V479 HydrophobicContact CG-CG2 3.85Å; V479-V481 HydrophobicContact CG1-CG2 3.99Å; V479-V481 PolarHBondContact O-N 3.01Å; V479-Y485 HydrophobicContact CG1-CE1 3.89Å; V479-Y485 HydrophobicContact CG1-CE2 3.86Å; V479-Y485 VanDerWaalsContact CG1-OH 3.22Å; V479-Y485 WeakPolarHBondContact CG1-OH 3.45Å; V479-L496 HydrophobicContact CG1-CD1 4.39Å; V479-L496 HydrophobicContact CG2-CD1 3.92Å; V479-V511 HydrophobicContact CG2-CG1 3.83Å; V479-I512 PolarHBondContact N-O 2.88Å; V479-L513 HydrophobicContact CB-CD2 4.01Å; V479-L513 HydrophobicContact CG1-CD2 4.13Å; V479-V514 PolarHBondContact O-N 2.84Å
480	V	88.4	Confident	79.6	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	108.2	177.5	-176.1	0	0	0	0	109	I422 S423 F433 V434 L438 L478 Y485 V514	I422-V480 HydrophobicContact CG2-CG2 4.1Å; S423-V480 PolarHBondContact O-N 2.83Å; F433-V480 HydrophobicContact CD1-CG1 4.16Å; F433-V480 HydrophobicContact CE1-CG1 4.16Å; V434-V480 HydrophobicContact CG2-CB 4.38Å; V434-V480 HydrophobicContact CG2-CG1 4.49Å; V434-V480 HydrophobicContact CG2-CG2 3.85Å; L438-V480 HydrophobicContact CD2-CG2 3.94Å; L478-V480 HydrophobicContact CD2-CG2 3.7Å; V480-Y485 WeakPolarHBondContact O-CD2 3.47Å; V480-Y485 WeakPolarHBondContact O-CE2 3.05Å; V480-V514 CarbonylContact C-O 3.44Å; V480-V514 WeakPolarHBondContact CA-O 3.01Å; V480-V514 HydrophobicContact CG2-CB 4.48Å
481	V	83.9	Confident	79.2	Confident	4 Å²	4	35 Å²	35	2%	0.024	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	128.2	-175.2	-175	0	0	0	0	110.8	V479 L513 V514 Y516 V519 L524 L528	V479-V481 HydrophobicContact CG1-CG2 3.99Å; V479-V481 PolarHBondContact O-N 3.01Å; V481-L513 HydrophobicContact CG2-CB 4.46Å; V481-L513 HydrophobicContact CG2-CD2 3.91Å; V481-V514 PolarHBondContact N-O 2.87Å; V481-Y516 PolarHBondContact O-N 2.81Å; V481-Y516 VanDerWaalsContact O-N 3.14Å; V481-V519 HydrophobicContact CG1-CG2 4.11Å; V481-L524 HydrophobicContact CG1-CD1 3.87Å; V481-L528 HydrophobicContact CG1-CD2 4.38Å; V481-L528 HydrophobicContact CG2-CD2 4.19Å
482	S	77.9	Confident	78.9	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.021	22%	0.222	C	C	.	.			trans	-141.2	173.7	175.9	80	0	0	0	0	111	E430 G484 Y485	E430-S482 VanDerWaalsContact CD-CB 3.42Å; E430-S482 WeakPolarHBondContact OE1-CB 3.48Å; E430-S482 PolarHBondContact OE1-OG 3.09Å; E430-S482 PolarHBondContact OE2-OG 2.81Å; S482-G484 PolarHBondContact O-N 2.83Å; S482-G484 PolarHBondContact OG-N 2.86Å; S482-Y485 WeakPolarHBondContact O-CB 3.48Å; S482-Y485 PolarHBondContact O-N 3Å; S482-Y485 PolarHBondContact OG-N 2.8Å
483	P	71.5	Confident	78.7	Confident	73 Å²	73	33.7 Å²	33.7	47%	0.474	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-59.6	-28.6	170.3	-22.9	34.6	0	0	0	113.9	V519	P483-V519 HydrophobicContact CG-CG2 4.27Å
484	G	66.6	Low	78.5	Confident	33 Å²	33	32.4 Å²	32.4	34%	0.34	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-82	-14.6	-179	0	0	0	0	0	114.8	S482 A486	S482-G484 PolarHBondContact O-N 2.83Å; S482-G484 PolarHBondContact OG-N 2.86Å; G484-A486 PolarHBondContact O-N 2.7Å; G484-A486 VanDerWaalsContact O-N 3.13Å
485	Y	71.3	Confident	78.4	Confident	4 Å²	4	32.5 Å²	32.5	2%	0.016	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-65.3	-13.4	178.7	-160.4	-90	0	0	0	113.6	S423 A425 V479 V480 S482 A492 L496 L528	S423-Y485 PolarHBondContact OG-OH 2.96Å; A425-Y485 HydrophobicContact CB-CD2 4.29Å; V479-Y485 HydrophobicContact CG1-CE1 3.89Å; V479-Y485 HydrophobicContact CG1-CE2 3.86Å; V479-Y485 VanDerWaalsContact CG1-OH 3.22Å; V479-Y485 WeakPolarHBondContact CG1-OH 3.45Å; V480-Y485 WeakPolarHBondContact O-CD2 3.47Å; V480-Y485 WeakPolarHBondContact O-CE2 3.05Å; S482-Y485 WeakPolarHBondContact O-CB 3.48Å; S482-Y485 PolarHBondContact O-N 3Å; S482-Y485 PolarHBondContact OG-N 2.8Å; Y485-A492 HydrophobicContact CD2-CB 4.26Å; Y485-A492 HydrophobicContact CE2-CB 3.69Å; Y485-A492 PolarHBondContact OH-O 2.94Å; Y485-L496 HydrophobicContact CE1-CD2 4.12Å; Y485-L528 HydrophobicContact CD1-CD2 4.35Å; Y485-L528 HydrophobicContact CE1-CD2 4.45Å
486	A	60.4	Low	78.3	Confident	35 Å²	35	32.2 Å²	32.2	29%	0.289	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-93.9	10.5	-173.5	0	0	0	0	0	115.1	G484 Q488 S523 V525	G484-A486 PolarHBondContact O-N 2.7Å; G484-A486 VanDerWaalsContact O-N 3.13Å; A486-Q488 PolarHBondContact O-N 2.89Å; A486-S523 WeakPolarHBondContact CB-O 3.35Å; A486-V525 HydrophobicContact CB-CG2 4.28Å
487	S	64.6	Low	78.1	Confident	65 Å²	65	36.9 Å²	36.9	46%	0.455	23%	0.227	S	C	.	.			trans	-65.7	119.7	175.4	52.1	0	0	0	0	110.3	G489 S490	S487-G489 PolarHBondContact O-N 2.95Å; S487-S490 WeakPolarHBondContact O-CB 3.44Å; S487-S490 PolarHBondContact O-N 2.94Å; S487-S490 PolarHBondContact O-OG 3.15Å; S487-S490 WeakPolarHBondContact OG-CB 3.37Å
488	Q	58	Low	77.8	Confident	192 Å²	192	37.3 Å²	37.3	90%	0.897	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	132.7	177.7	-76.1	-176.9	-13.5	0	0	110	A486	A486-Q488 PolarHBondContact O-N 2.89Å
489	G	64.7	Low	77.6	Confident	79 Å²	79	37.3 Å²	37.3	81%	0.814	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	83	6.8	178.5	0	0	0	0	0	115.5	S487	S487-G489 PolarHBondContact O-N 2.95Å
490	S	73.9	Confident	77.5	Confident	30 Å²	30	39 Å²	39	21%	0.21	24%	0.239	C	C	.	.			trans	-73.1	147.7	174.6	61.2	0	0	0	0	112.3	S487 A492 L493	S487-S490 WeakPolarHBondContact O-CB 3.44Å; S487-S490 PolarHBondContact O-N 2.94Å; S487-S490 PolarHBondContact O-OG 3.15Å; S487-S490 WeakPolarHBondContact OG-CB 3.37Å; S490-A492 PolarHBondContact O-N 2.93Å; S490-L493 WeakPolarHBondContact O-CB 3.39Å; S490-L493 PolarHBondContact O-N 2.82Å; S490-L493 VanDerWaalsContact O-N 3.11Å
491	Q	79.4	Confident	77.3	Confident	42 Å²	42	42.6 Å²	42.6	20%	0.196	26%	0.259	C	S	.	.	H	α-helix	trans	-61.4	-29.9	176.1	175	178.4	-9.3	0	0	112.8	R426 F453 I463 L493 L494 E495	R426-Q491 VanDerWaalsContact CZ-CD 3.42Å; F453-Q491 VanDerWaalsContact CD2-NE2 3.27Å; F453-Q491 VanDerWaalsContact CZ-NE2 3.34Å; I463-Q491 HydrophobicContact CG2-CG 4.11Å; Q491-L493 VanDerWaalsContact C-N 3.26Å; Q491-L493 PolarHBondContact O-N 2.95Å; Q491-L494 WeakPolarHBondContact O-CB 3.34Å; Q491-L494 PolarHBondContact O-N 2.88Å; Q491-L494 VanDerWaalsContact O-N 3.11Å; Q491-E495 PolarHBondContact NE2-OE1 3.41Å; Q491-E495 WeakPolarHBondContact O-CG 3.49Å; Q491-E495 PolarHBondContact O-N 3.03Å
492	A	81.4	Confident	77.3	Confident	2 Å²	2	44.2 Å²	44.2	2%	0.017	27%	0.27	C	S	.	.	H	α-helix	trans	-60.2	-35	174.4	0	0	0	0	0	112.8	S423 Y424 Y485 S490 E495 L496	S423-A492 PolarHBondContact OG-O 3.29Å; Y424-A492 WeakPolarHBondContact O-CB 3.33Å; Y485-A492 HydrophobicContact CD2-CB 4.26Å; Y485-A492 HydrophobicContact CE2-CB 3.69Å; Y485-A492 PolarHBondContact OH-O 2.94Å; S490-A492 PolarHBondContact O-N 2.93Å; A492-E495 PolarHBondContact O-N 3.29Å; A492-L496 WeakPolarHBondContact O-CB 3.32Å; A492-L496 PolarHBondContact O-N 3.08Å
493	L	82.5	Confident	77.6	Confident	35 Å²	35	46.5 Å²	46.5	18%	0.183	28%	0.281	C	S	.	.	H	α-helix	trans	-70.1	-35.1	176	-175.6	61.9	0	0	0	112.1	S490 Q491 L496 K497 V525	S490-L493 WeakPolarHBondContact O-CB 3.39Å; S490-L493 PolarHBondContact O-N 2.82Å; S490-L493 VanDerWaalsContact O-N 3.11Å; Q491-L493 VanDerWaalsContact C-N 3.26Å; Q491-L493 PolarHBondContact O-N 2.95Å; L493-L496 HydrophobicContact CD1-CD2 4.27Å; L493-K497 WeakPolarHBondContact O-CB 3.13Å; L493-K497 PolarHBondContact O-N 3.38Å; L493-V525 HydrophobicContact CD1-CB 4.17Å; L493-V525 HydrophobicContact CD1-CG1 4.06Å; L493-V525 HydrophobicContact CD1-CG2 4.05Å; L493-V525 HydrophobicContact CD2-CG1 4.3Å
494	L	83.1	Confident	78.1	Confident	63 Å²	63	47 Å²	47	33%	0.33	29%	0.291	S	S	.	.	H	α-helix	trans	-64.9	-46.2	173.8	178.9	69.4	0	0	0	110.9	T464 Q491 L496 K497 A498	T464-L494 HydrophobicContact CG2-CD2 3.86Å; Q491-L494 WeakPolarHBondContact O-CB 3.34Å; Q491-L494 PolarHBondContact O-N 2.88Å; Q491-L494 VanDerWaalsContact O-N 3.11Å; L494-L496 VanDerWaalsContact C-N 3.34Å; L494-L496 PolarHBondContact O-N 2.83Å; L494-K497 PolarHBondContact O-N 2.04Å; L494-A498 WeakPolarHBondContact O-CB 3.19Å; L494-A498 PolarHBondContact O-N 2.94Å
495	E	87.6	Confident	78.6	Confident	3 Å²	3	53 Å²	53	1%	0.014	31%	0.314	C	S	.	.	H	α-helix	trans	-58.2	-45	175.5	-68.6	165.8	-176.3	0	0	111.8	Y421 S423 R426 T467 Q491 A492 G499	Y421-E495 HydrophobicContact CE1-CB 4.12Å; Y421-E495 HydrophobicContact CE1-CG 3.86Å; Y421-E495 VanDerWaalsContact OH-CD 3.24Å; Y421-E495 WeakPolarHBondContact OH-CG 3.43Å; Y421-E495 PolarHBondContact OH-OE1 3.13Å; S423-E495 VanDerWaalsContact CA-OE2 3.31Å; S423-E495 WeakPolarHBondContact CA-OE2 3.02Å; S423-E495 WeakPolarHBondContact CB-OE2 3.05Å; S423-E495 PolarHBondContact OG-OE2 3.49Å; R426-E495 IonicContact NH1-OE1 2.78Å; R426-E495 IonicContact NH2-OE1 2.85Å; T467-E495 HydrophobicContact CG2-CB 4.2Å; T467-E495 HydrophobicContact CG2-CG 3.49Å; T467-E495 VanDerWaalsContact CG2-CG 3.49Å; Q491-E495 PolarHBondContact NE2-OE1 3.41Å; Q491-E495 WeakPolarHBondContact O-CG 3.49Å; Q491-E495 PolarHBondContact O-N 3.03Å; A492-E495 PolarHBondContact O-N 3.29Å; E495-G499 PolarHBondContact O-N 2.85Å
496	L	86.6	Confident	78.5	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-61	-45.9	175.3	174	66.3	0	0	0	111.8	V479 Y485 A492 L493 L494 G499 I500 L528	V479-L496 HydrophobicContact CG1-CD1 4.39Å; V479-L496 HydrophobicContact CG2-CD1 3.92Å; Y485-L496 HydrophobicContact CE1-CD2 4.12Å; A492-L496 WeakPolarHBondContact O-CB 3.32Å; A492-L496 PolarHBondContact O-N 3.08Å; L493-L496 HydrophobicContact CD1-CD2 4.27Å; L494-L496 VanDerWaalsContact C-N 3.34Å; L494-L496 PolarHBondContact O-N 2.83Å; L496-G499 PolarHBondContact O-N 3.33Å; L496-I500 HydrophobicContact CD1-CD1 3.72Å; L496-I500 HydrophobicContact CD1-CG1 4.09Å; L496-I500 HydrophobicContact CD2-CD1 4.41Å; L496-I500 HydrophobicContact CG-CD1 3.8Å; L496-I500 HydrophobicContact CG-CG1 4.48Å; L496-I500 WeakPolarHBondContact O-CG1 3.11Å; L496-I500 PolarHBondContact O-N 3.35Å; L496-L528 HydrophobicContact CD1-CD1 3.78Å; L496-L528 HydrophobicContact CD2-CB 3.84Å; L496-L528 HydrophobicContact CD2-CD1 3.67Å; L496-L528 HydrophobicContact CD2-CD2 4.21Å; L496-L528 HydrophobicContact CD2-CG 4.11Å; L496-L528 HydrophobicContact CG-CD1 4.37Å
497	K	85.9	Confident	78.8	Confident	110 Å²	110	55.6 Å²	55.6	48%	0.478	35%	0.346	S	S	.	.	H	α-helix	trans	-64	-47.9	-179.4	-175.3	171.2	-179.4	176.9	0	110.9	L493 L494 G499 I500 D501	L493-K497 WeakPolarHBondContact O-CB 3.13Å; L493-K497 PolarHBondContact O-N 3.38Å; L494-K497 PolarHBondContact O-N 2.04Å; K497-G499 VanDerWaalsContact C-N 3.25Å; K497-G499 PolarHBondContact O-N 2.92Å; K497-I500 PolarHBondContact O-N 2.79Å; K497-D501 WeakPolarHBondContact O-CB 3.49Å; K497-D501 VanDerWaalsContact O-CG 3.24Å; K497-D501 PolarHBondContact O-N 3.41Å
498	A	85.8	Confident	79.1	Confident	9 Å²	9	59.7 Å²	59.7	7%	0.074	36%	0.358	C	S	.	.	H	α-helix	trans	-54.1	-42.8	173.6	0	0	0	0	0	112.1	L468 V471 L494 S502	L468-A498 HydrophobicContact CD2-CB 3.65Å; V471-A498 HydrophobicContact CG1-CB 4.46Å; V471-A498 HydrophobicContact CG2-CB 4.34Å; L494-A498 WeakPolarHBondContact O-CB 3.19Å; L494-A498 PolarHBondContact O-N 2.94Å; A498-S502 WeakPolarHBondContact O-CB 3.48Å; A498-S502 PolarHBondContact O-N 2.84Å
499	G	86.8	Confident	80.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-70.6	-41.2	178.4	0	0	0	0	0	114.9	E495 L496 K497 S502 M503	E495-G499 PolarHBondContact O-N 2.85Å; L496-G499 PolarHBondContact O-N 3.33Å; K497-G499 VanDerWaalsContact C-N 3.25Å; K497-G499 PolarHBondContact O-N 2.92Å; G499-S502 PolarHBondContact O-N 3.21Å; G499-M503 WeakPolarHBondContact O-CB 3.35Å; G499-M503 PolarHBondContact O-N 3.33Å
500	I	86.2	Confident	81.3	Confident	35 Å²	35	53.7 Å²	53.7	18%	0.179	30%	0.302	C	S	.	.	H	α-helix	trans	-64.4	-44.1	175.6	-68.9	167.5	0	0	0	109.9	L496 K497 M503 A504 A531	L496-I500 HydrophobicContact CD1-CD1 3.72Å; L496-I500 HydrophobicContact CD1-CG1 4.09Å; L496-I500 HydrophobicContact CD2-CD1 4.41Å; L496-I500 HydrophobicContact CG-CD1 3.8Å; L496-I500 HydrophobicContact CG-CG1 4.48Å; L496-I500 WeakPolarHBondContact O-CG1 3.11Å; L496-I500 PolarHBondContact O-N 3.35Å; K497-I500 PolarHBondContact O-N 2.79Å; I500-M503 PolarHBondContact O-N 2.86Å; I500-A504 WeakPolarHBondContact O-CB 3.39Å; I500-A504 PolarHBondContact O-N 2.92Å; I500-A531 HydrophobicContact CD1-CB 3.64Å; I500-A531 HydrophobicContact CG1-CB 4.14Å
501	D	85	Confident	82	Confident	77 Å²	77	52.5 Å²	52.5	41%	0.412	29%	0.294	S	S	.	.	H	α-helix	trans	-65.5	-42.1	179.5	-67.8	-19.4	0	0	0	110.7	K497 A504 L505	K497-D501 WeakPolarHBondContact O-CB 3.49Å; K497-D501 VanDerWaalsContact O-CG 3.24Å; K497-D501 PolarHBondContact O-N 3.41Å; D501-A504 PolarHBondContact O-N 3.43Å; D501-L505 WeakPolarHBondContact O-CB 3.42Å; D501-L505 WeakPolarHBondContact O-CD1 3.37Å; D501-L505 WeakPolarHBondContact O-CG 3.22Å; D501-L505 PolarHBondContact O-N 3.46Å
502	S	83.9	Confident	82.5	Confident	38 Å²	38	50.5 Å²	50.5	27%	0.266	28%	0.284	S	S	.	.	H	α-helix	trans	-63.3	-40.8	174.3	-178.1	0	0	0	0	112.9	A498 G499 A504 G506	A498-S502 WeakPolarHBondContact O-CB 3.48Å; A498-S502 PolarHBondContact O-N 2.84Å; G499-S502 PolarHBondContact O-N 3.21Å; S502-A504 VanDerWaalsContact C-N 3.34Å; S502-A504 PolarHBondContact O-N 3.45Å; S502-G506 PolarHBondContact O-N 3.24Å; S502-G506 VanDerWaalsContact O-N 3.11Å
503	M	84.3	Confident	82.8	Confident	50 Å²	50	50.5 Å²	50.5	25%	0.246	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-44.2	172	-177.7	-169.1	-54.7	0	0	111.4	G499 I500 G507 L509 V511 L535	G499-M503 WeakPolarHBondContact O-CB 3.35Å; G499-M503 PolarHBondContact O-N 3.33Å; I500-M503 PolarHBondContact O-N 2.86Å; M503-G507 VanDerWaalsContact O-CA 3.31Å; M503-G507 WeakPolarHBondContact O-CA 3.36Å; M503-G507 PolarHBondContact O-N 3.32Å; M503-L509 WeakPolarHBondContact CA-O 3.38Å; M503-L509 VanDerWaalsContact CB-O 3.31Å; M503-L509 WeakPolarHBondContact CB-O 3.37Å; M503-L509 WeakPolarHBondContact CG-O 3.27Å; M503-V511 HydrophobicContact CE-CB 3.32Å; M503-V511 HydrophobicContact CE-CG2 3.29Å; M503-L535 HydrophobicContact CE-CD2 3.36Å; M503-L535 HydrophobicContact SD-CD2 4.02Å
504	A	82.1	Confident	83.1	Confident	83 Å²	83	48.8 Å²	48.8	69%	0.686	28%	0.275	S	S	*	.	H	α-helix	trans	-72.4	-36.5	-175.9	0	0	0	0	0	113.3	I500 D501 S502	I500-A504 WeakPolarHBondContact O-CB 3.39Å; I500-A504 PolarHBondContact O-N 2.92Å; D501-A504 PolarHBondContact O-N 3.43Å; S502-A504 VanDerWaalsContact C-N 3.34Å; S502-A504 PolarHBondContact O-N 3.45Å
505	L	77.8	Confident	83.3	Confident	159 Å²	159	47 Å²	47	83%	0.832	27%	0.265	S	S	*	.	H	α-helix	trans	-80.8	-43.5	-176.7	-74.5	161.8	0	0	0	113	D501	D501-L505 WeakPolarHBondContact O-CB 3.42Å; D501-L505 WeakPolarHBondContact O-CD1 3.37Å; D501-L505 WeakPolarHBondContact O-CG 3.22Å; D501-L505 PolarHBondContact O-N 3.46Å
506	G	67.6	Low	83	Confident	42 Å²	42	49.2 Å²	49.2	43%	0.433	27%	0.274	S	S	.	.	H	α-helix	trans	-119.6	-13.4	-169.9	0	0	0	0	0	115.2	S502 H508	S502-G506 PolarHBondContact O-N 3.24Å; S502-G506 VanDerWaalsContact O-N 3.11Å; G506-H508 PolarHBondContact O-CD2 2.81Å; G506-H508 PolarHBondContact O-N 2.8Å
507	G	66.7	Low	82.6	Confident	52 Å²	52	54.1 Å²	54.1	54%	0.536	29%	0.292	S	S	.	.	S	Bend	trans	64.7	-10.9	179.8	0	0	0	0	0	116.4	M503	M503-G507 VanDerWaalsContact O-CA 3.31Å; M503-G507 WeakPolarHBondContact O-CA 3.36Å; M503-G507 PolarHBondContact O-N 3.32Å
508	H	70.9	Confident	82.1	Confident	151 Å²	151	54.5 Å²	54.5	70%	0.699	31%	0.306	S	S	*	.			trans	-79.9	-14.3	-175.6	-68.7	-72.3	0	0	0	114.4	K416 G506	K416-H508 PolarHBondContact NZ-O 2.91Å; K416-H508 VanDerWaalsContact NZ-O 3.09Å; G506-H508 PolarHBondContact O-CD2 2.81Å; G506-H508 PolarHBondContact O-N 2.8Å
509	L	83.3	Confident	81.3	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	31%	0.309	C	S	.	.			trans	-108.9	125.4	173.5	-177.6	83.6	0	0	0	108.8	V471 S474 L477 M503	V471-L509 HydrophobicContact CG1-CD2 3.55Å; S474-L509 WeakPolarHBondContact O-CD1 3.38Å; L477-L509 HydrophobicContact CB-CD1 4.29Å; L477-L509 HydrophobicContact CB-CD2 4.1Å; L477-L509 HydrophobicContact CB-CG 4.36Å; M503-L509 WeakPolarHBondContact CA-O 3.38Å; M503-L509 VanDerWaalsContact CB-O 3.31Å; M503-L509 WeakPolarHBondContact CB-O 3.37Å; M503-L509 WeakPolarHBondContact CG-O 3.27Å
510	R	86.2	Confident	80.3	Confident	145 Å²	145	62.6 Å²	62.6	55%	0.547	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	136.2	170.2	-61	-176.4	178.3	-171.9	0.2	110.7	R476 L477	R476-R510 CarbonylContact C-O 3.53Å; R476-R510 VanDerWaalsContact CA-O 3.3Å; R476-R510 WeakPolarHBondContact CA-O 3.31Å; L477-R510 PolarHBondContact N-O 2.87Å
511	V	88.4	Confident	79.1	Confident	4 Å²	4	71.1 Å²	71.1	2%	0.024	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.6	-179.8	-177.3	0	0	0	0	108.5	L477 V479 M503 L535	L477-V511 HydrophobicContact CB-CG2 4.07Å; L477-V511 HydrophobicContact CD2-CG1 4.23Å; L477-V511 HydrophobicContact CD2-CG2 4Å; L477-V511 HydrophobicContact CG-CG1 4.27Å; L477-V511 HydrophobicContact CG-CG2 4.37Å; L477-V511 CarbonylContact O-C 3.49Å; L477-V511 VanDerWaalsContact O-CA 3.26Å; L477-V511 WeakPolarHBondContact O-CA 3.12Å; V479-V511 HydrophobicContact CG2-CG1 3.83Å; M503-V511 HydrophobicContact CE-CB 3.32Å; M503-V511 HydrophobicContact CE-CG2 3.29Å; V511-L535 HydrophobicContact CB-CD1 4.3Å; V511-L535 HydrophobicContact CB-CD2 3.74Å; V511-L535 HydrophobicContact CG1-CD1 3.91Å; V511-L535 HydrophobicContact CG1-CD2 4.29Å
512	I	90.4	Very high	78	Confident	1 Å²	1	75.4 Å²	75.4	1%	0.005	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.6	-177.3	-55	166	0	0	0	107.6	R476 L477 L478 V479 V538 L556 E559 L560	R476-I512 HydrophobicContact CB-CD1 4.19Å; R476-I512 HydrophobicContact CG-CD1 4.25Å; L477-I512 PolarHBondContact O-N 3.3Å; L478-I512 WeakPolarHBondContact CA-O 2.91Å; V479-I512 PolarHBondContact N-O 2.88Å; I512-V538 HydrophobicContact CG2-CG2 4.13Å; I512-L556 HydrophobicContact CG2-CD1 4.14Å; I512-E559 HydrophobicContact CD1-CB 3.67Å; I512-E559 HydrophobicContact CG1-CB 4.05Å; I512-E559 HydrophobicContact CG2-CB 4.35Å; I512-L560 HydrophobicContact CD1-CD2 4.29Å
513	L	87.9	Confident	76.9	Confident	1 Å²	1	76.1 Å²	76.1	1%	0.005	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	119.3	177.3	-60.9	175.4	0	0	0	109.8	V479 V481 L528 R532 L535 A536 L537 V538	V479-L513 HydrophobicContact CB-CD2 4.01Å; V479-L513 HydrophobicContact CG1-CD2 4.13Å; V481-L513 HydrophobicContact CG2-CB 4.46Å; V481-L513 HydrophobicContact CG2-CD2 3.91Å; L513-L528 HydrophobicContact CD1-CD1 4.35Å; L513-L528 HydrophobicContact CD2-CD1 3.49Å; L513-L528 VanDerWaalsContact CD2-CD1 3.49Å; L513-R532 HydrophobicContact CD1-CB 4.28Å; L513-R532 HydrophobicContact CD1-CG 4.17Å; L513-L535 HydrophobicContact CD1-CB 3.79Å; L513-L535 HydrophobicContact CD1-CD1 3.87Å; L513-L535 HydrophobicContact CD1-CG 4.44Å; L513-L535 HydrophobicContact CD2-CD1 3.85Å; L513-L535 HydrophobicContact CG-CB 3.92Å; L513-L535 HydrophobicContact CG-CD1 3.8Å; L513-A536 PolarHBondContact N-O 3.36Å; L513-L537 HydrophobicContact CB-CD1 3.63Å; L513-L537 HydrophobicContact CD1-CD1 4.37Å; L513-L537 CarbonylContact O-C 3.4Å; L513-L537 WeakPolarHBondContact O-CA 3.24Å; L513-V538 PolarHBondContact O-N 2.89Å
514	V	89.4	Confident	76.2	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	109.7	171.5	173.9	0	0	0	0	108.7	F433 L478 V479 V480 V481 Y516 V538 F552 L556	F433-V514 HydrophobicContact CE1-CG1 4.49Å; L478-V514 HydrophobicContact CD1-CG2 4.01Å; L478-V514 HydrophobicContact CD2-CB 3.97Å; L478-V514 HydrophobicContact CD2-CG2 3.56Å; L478-V514 HydrophobicContact CG-CG2 3.72Å; V479-V514 PolarHBondContact O-N 2.84Å; V480-V514 CarbonylContact C-O 3.44Å; V480-V514 WeakPolarHBondContact CA-O 3.01Å; V480-V514 HydrophobicContact CG2-CB 4.48Å; V481-V514 PolarHBondContact N-O 2.87Å; V514-Y516 PolarHBondContact O-N 3.33Å; V514-V538 CarbonylContact C-O 3.59Å; V514-V538 WeakPolarHBondContact CA-O 3.39Å; V514-F552 HydrophobicContact CG1-CE2 3.97Å; V514-F552 HydrophobicContact CG1-CZ 3.95Å; V514-L556 HydrophobicContact CG2-CD1 3.97Å
515	Q	86.5	Confident	75.7	Confident	24 Å²	24	72 Å²	72	11%	0.112	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	102.4	179.3	-177	171.3	12	0	0	110.1	R517 L537 V538 R539 W540	Q515-R517 WeakPolarHBondContact CG-O 3.44Å; Q515-R517 PolarHBondContact NE2-O 2.81Å; Q515-L537 HydrophobicContact CB-CD1 4.04Å; Q515-V538 PolarHBondContact N-O 3.48Å; Q515-R539 HydrophobicContact CB-CG 4.36Å; Q515-W540 WeakPolarHBondContact O-CB 3.16Å; Q515-W540 PolarHBondContact O-N 2.85Å
516	Y	82.1	Confident	75.4	Confident	51 Å²	51	71.8 Å²	71.8	20%	0.2	35%	0.353	C	S	.	.	S	Bend	trans	-77.8	-41.1	178.6	177.3	-124.3	0	0	0	112.5	E430 F433 V481 V514 W540	E430-Y516 HydrophobicContact CG-CD1 4.03Å; E430-Y516 HydrophobicContact CG-CE1 4.37Å; F433-Y516 HydrophobicContact CB-CD2 4.29Å; F433-Y516 HydrophobicContact CB-CE1 4.34Å; F433-Y516 HydrophobicContact CB-CE2 3.8Å; F433-Y516 AromaticContact CD1-CD2 3.58Å; F433-Y516 HydrophobicContact CD1-CD2 3.58Å; F433-Y516 AromaticContact CD1-CE2 3.95Å; F433-Y516 HydrophobicContact CD1-CE2 3.95Å; F433-Y516 AromaticContact CD1-CG 3.96Å; F433-Y516 HydrophobicContact CD1-CG 3.96Å; F433-Y516 AromaticContact CD2-CD2 3.74Å; F433-Y516 HydrophobicContact CD2-CD2 3.74Å; F433-Y516 AromaticContact CD2-CE2 3.43Å; F433-Y516 HydrophobicContact CD2-CE2 3.43Å; F433-Y516 VanDerWaalsContact CD2-CE2 3.43Å; F433-Y516 AromaticContact CE1-CD2 3.73Å; F433-Y516 HydrophobicContact CE1-CD2 3.73Å; F433-Y516 HydrophobicContact CE1-CE2 4.41Å; F433-Y516 HydrophobicContact CE1-CG 4.21Å; F433-Y516 AromaticContact CE2-CD2 3.88Å; F433-Y516 HydrophobicContact CE2-CD2 3.88Å; F433-Y516 AromaticContact CE2-CE2 3.95Å; F433-Y516 HydrophobicContact CE2-CE2 3.95Å; F433-Y516 AromaticContact CG-CD2 3.58Å; F433-Y516 HydrophobicContact CG-CD2 3.58Å; F433-Y516 AromaticContact CG-CE2 3.43Å; F433-Y516 HydrophobicContact CG-CE2 3.43Å; F433-Y516 VanDerWaalsContact CG-CE2 3.43Å; F433-Y516 HydrophobicContact CG-CG 4.27Å; F433-Y516 AromaticContact CG-CZ 3.98Å; F433-Y516 AromaticContact CZ-CD2 3.87Å; F433-Y516 HydrophobicContact CZ-CD2 3.87Å; F433-Y516 HydrophobicContact CZ-CE2 4.4Å; V481-Y516 PolarHBondContact O-N 2.81Å; V481-Y516 VanDerWaalsContact O-N 3.14Å; V514-Y516 PolarHBondContact O-N 3.33Å; Y516-W540 AromaticContact CD2-CD1 3.83Å; Y516-W540 HydrophobicContact CD2-CG 4.28Å
517	R	77.9	Confident	75.7	Confident	104 Å²	104	73.3 Å²	73.3	39%	0.392	35%	0.348	S	S	.	.	S	Bend	trans	-129.2	154.6	174.1	-77.6	-170	178.8	162.9	4.6	111.9	E429 Q515 V519	E429-R517 IonicContact OE1-CZ 3.68Å; E429-R517 IonicContact OE1-NH1 3.3Å; E429-R517 IonicContact OE1-NH2 3.36Å; E429-R517 PolarHBondContact OE1-NH2 3.08Å; E429-R517 IonicContact OE2-CZ 3.13Å; E429-R517 IonicContact OE2-NH1 2.64Å; E429-R517 PolarHBondContact OE2-NH1 2.79Å; E429-R517 IonicContact OE2-NH2 2.68Å; E429-R517 PolarHBondContact OE2-NH2 3.49Å; Q515-R517 WeakPolarHBondContact CG-O 3.44Å; Q515-R517 PolarHBondContact NE2-O 2.81Å; R517-V519 WeakPolarHBondContact O-CG2 3.25Å; R517-V519 PolarHBondContact O-N 3.02Å
518	P	74	Confident	76	Confident	117 Å²	117	70.9 Å²	70.9	76%	0.76	32%	0.323	S	S	*	.			trans	-61.5	123.3	173	24.8	-31.7	0	0	0	110.4
519	V	69.4	Low	76.2	Confident	24 Å²	24	69.6 Å²	69.6	15%	0.145	31%	0.312	C	S	.	.			trans	-115.6	130.6	177.8	-171.5	0	0	0	0	108.4	V481 P483 R517 S523 L524	V481-V519 HydrophobicContact CG1-CG2 4.11Å; P483-V519 HydrophobicContact CG-CG2 4.27Å; R517-V519 WeakPolarHBondContact O-CG2 3.25Å; R517-V519 PolarHBondContact O-N 3.02Å; V519-S523 WeakPolarHBondContact CG1-OG 3.34Å; V519-L524 HydrophobicContact CG1-CD1 4.37Å
520	Q	65.6	Low	75.7	Confident	155 Å²	155	77.5 Å²	77.5	72%	0.724	34%	0.342	S	S	*	.			trans	-68.2	142.1	175.4	-74.6	177.3	1.9	0	0	110.3	Q522 S523	Q520-Q522 PolarHBondContact O-N 3.21Å; Q520-S523 PolarHBondContact O-N 2.84Å; Q520-S523 VanDerWaalsContact O-N 3.14Å; Q520-S523 PolarHBondContact O-OG 2.94Å
521	R	61.9	Low	75.1	Confident	214 Å²	214	71.3 Å²	71.3	81%	0.808	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-57.2	-28	-175.3	-74.7	-178.9	179.5	171.1	-0.8	113.8	R529	R521-R529 PolarHBondContact O-NE 2.01Å; R521-R529 PolarHBondContact O-NH2 2.87Å
522	Q	60.7	Low	74.4	Confident	167 Å²	167	74.7 Å²	74.7	78%	0.78	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-77	-28.2	-176.7	-66.5	179.4	-5.5	0	0	113.1	Q520 L524 R529	Q520-Q522 PolarHBondContact O-N 3.21Å; Q522-L524 VanDerWaalsContact C-N 3.28Å; Q522-L524 PolarHBondContact O-N 3.4Å; Q522-R529 PolarHBondContact O-NH2 3.45Å
523	S	62.6	Low	73.7	Confident	54 Å²	54	81.4 Å²	81.4	38%	0.378	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-83.3	-2.4	-179.3	64	0	0	0	0	113.5	A486 V519 Q520	A486-S523 WeakPolarHBondContact CB-O 3.35Å; V519-S523 WeakPolarHBondContact CG1-OG 3.34Å; Q520-S523 PolarHBondContact O-N 2.84Å; Q520-S523 VanDerWaalsContact O-N 3.14Å; Q520-S523 PolarHBondContact O-OG 2.94Å
524	L	68.6	Low	73	Confident	14 Å²	14	85.4 Å²	85.4	7%	0.073	41%	0.408	C	S	.	.	S	Bend	trans	-85.3	135.9	178.1	-149.2	73.5	0	0	0	111.2	V481 V519 Q522 L528 R529	V481-L524 HydrophobicContact CG1-CD1 3.87Å; V519-L524 HydrophobicContact CG1-CD1 4.37Å; Q522-L524 VanDerWaalsContact C-N 3.28Å; Q522-L524 PolarHBondContact O-N 3.4Å; L524-L528 HydrophobicContact CD1-CD2 3.4Å; L524-L528 HydrophobicContact CD1-CG 4.13Å; L524-L528 HydrophobicContact CD2-CB 3.94Å; L524-L528 HydrophobicContact CD2-CD2 3.92Å; L524-L528 HydrophobicContact CD2-CG 3.67Å; L524-L528 HydrophobicContact CG-CB 3.9Å; L524-L528 HydrophobicContact CG-CD2 3.61Å; L524-L528 HydrophobicContact CG-CG 3.83Å; L524-R529 PolarHBondContact O-NH2 3.11Å
525	V	71.5	Confident	72.7	Confident	32 Å²	32	86.1 Å²	86.1	19%	0.194	41%	0.412	C	S	.	.			trans	-59.6	151.7	177.4	-152.2	0	0	0	0	110.9	A486 L493 E527 L528 R529	A486-V525 HydrophobicContact CB-CG2 4.28Å; L493-V525 HydrophobicContact CD1-CB 4.17Å; L493-V525 HydrophobicContact CD1-CG1 4.06Å; L493-V525 HydrophobicContact CD1-CG2 4.05Å; L493-V525 HydrophobicContact CD2-CG1 4.3Å; V525-E527 VanDerWaalsContact C-N 3.27Å; V525-E527 WeakPolarHBondContact CG1-OE2 3.14Å; V525-E527 PolarHBondContact O-N 2.98Å; V525-L528 PolarHBondContact O-N 3Å; V525-R529 PolarHBondContact O-N 2.89Å
526	R	72.8	Confident	72.5	Confident	154 Å²	154	86 Å²	86	58%	0.581	42%	0.415	S	S	*	.	H	α-helix	trans	-58.9	-38.3	-170.2	-162.2	177.4	94	172.9	5.9	112.5	R529 R530	R526-R529 PolarHBondContact O-N 2.84Å; R526-R530 WeakPolarHBondContact O-CG 3.42Å; R526-R530 PolarHBondContact O-N 3.16Å
527	E	72.3	Confident	72.7	Confident	74 Å²	74	85.2 Å²	85.2	35%	0.346	41%	0.414	S	S	.	.	H	α-helix	trans	-62.7	-51.7	179.2	-66.1	71.6	-160.4	0	0	110.3	V525 R529 R530 A531	V525-E527 VanDerWaalsContact C-N 3.27Å; V525-E527 WeakPolarHBondContact CG1-OE2 3.14Å; V525-E527 PolarHBondContact O-N 2.98Å; E527-R529 VanDerWaalsContact C-N 3.34Å; E527-R529 PolarHBondContact O-N 2.84Å; E527-R530 PolarHBondContact O-N 3.07Å; E527-A531 WeakPolarHBondContact O-CB 3.11Å; E527-A531 PolarHBondContact O-N 2.9Å
528	L	73.5	Confident	73.2	Confident	1 Å²	1	80.3 Å²	80.3	1%	0.005	40%	0.396	C	S	.	.	H	α-helix	trans	-67.5	-34.1	179.7	-165.3	58.2	0	0	0	112.1	V481 Y485 L496 L513 L524 V525 R532 L535	V481-L528 HydrophobicContact CG1-CD2 4.38Å; V481-L528 HydrophobicContact CG2-CD2 4.19Å; Y485-L528 HydrophobicContact CD1-CD2 4.35Å; Y485-L528 HydrophobicContact CE1-CD2 4.45Å; L496-L528 HydrophobicContact CD1-CD1 3.78Å; L496-L528 HydrophobicContact CD2-CB 3.84Å; L496-L528 HydrophobicContact CD2-CD1 3.67Å; L496-L528 HydrophobicContact CD2-CD2 4.21Å; L496-L528 HydrophobicContact CD2-CG 4.11Å; L496-L528 HydrophobicContact CG-CD1 4.37Å; L513-L528 HydrophobicContact CD1-CD1 4.35Å; L513-L528 HydrophobicContact CD2-CD1 3.49Å; L513-L528 VanDerWaalsContact CD2-CD1 3.49Å; L524-L528 HydrophobicContact CD1-CD2 3.4Å; L524-L528 HydrophobicContact CD1-CG 4.13Å; L524-L528 HydrophobicContact CD2-CB 3.94Å; L524-L528 HydrophobicContact CD2-CD2 3.92Å; L524-L528 HydrophobicContact CD2-CG 3.67Å; L524-L528 HydrophobicContact CG-CB 3.9Å; L524-L528 HydrophobicContact CG-CD2 3.61Å; L524-L528 HydrophobicContact CG-CG 3.83Å; V525-L528 PolarHBondContact O-N 3Å; L528-R532 WeakPolarHBondContact O-CB 3.33Å; L528-R532 PolarHBondContact O-N 2.93Å; L528-L535 HydrophobicContact CD1-CD1 4.5Å
529	R	74.8	Confident	73.8	Confident	125 Å²	125	81.7 Å²	81.7	47%	0.472	39%	0.386	S	S	.	.	H	α-helix	trans	-64.8	-38.5	176.7	-167.1	-177.7	-57	172.9	5.8	112.3	R521 Q522 L524 V525 R526 E527	R521-R529 PolarHBondContact O-NE 2.01Å; R521-R529 PolarHBondContact O-NH2 2.87Å; Q522-R529 PolarHBondContact O-NH2 3.45Å; L524-R529 PolarHBondContact O-NH2 3.11Å; V525-R529 PolarHBondContact O-N 2.89Å; R526-R529 PolarHBondContact O-N 2.84Å; E527-R529 VanDerWaalsContact C-N 3.34Å; E527-R529 PolarHBondContact O-N 2.84Å
530	R	73.9	Confident	74.6	Confident	166 Å²	166	82.3 Å²	82.3	63%	0.626	39%	0.385	S	S	*	.	H	α-helix	trans	-74.1	-46.8	175.6	-70.9	177.6	-177	179.7	-2.4	111.3	R526 E527 R532	R526-R530 WeakPolarHBondContact O-CG 3.42Å; R526-R530 PolarHBondContact O-N 3.16Å; E527-R530 PolarHBondContact O-N 3.07Å; R530-R532 VanDerWaalsContact C-N 3.33Å; R530-R532 PolarHBondContact O-N 3.34Å
531	A	72.8	Confident	75.4	Confident	16 Å²	16	80.5 Å²	80.5	13%	0.132	38%	0.377	C	S	.	.	H	α-helix	trans	-66.2	-34.3	-177.4	0	0	0	0	0	112.4	I500 E527 V533 A534 L535	I500-A531 HydrophobicContact CD1-CB 3.64Å; I500-A531 HydrophobicContact CG1-CB 4.14Å; E527-A531 WeakPolarHBondContact O-CB 3.11Å; E527-A531 PolarHBondContact O-N 2.9Å; A531-V533 PolarHBondContact O-N 2.91Å; A531-A534 WeakPolarHBondContact O-CA 3.47Å; A531-A534 PolarHBondContact O-N 2.87Å; A531-L535 HydrophobicContact CB-CD1 3.81Å; A531-L535 HydrophobicContact CB-CG 4.13Å; A531-L535 WeakPolarHBondContact O-CG 3.43Å; A531-L535 PolarHBondContact O-N 3.32Å; A531-L535 VanDerWaalsContact O-N 3.17Å
532	R	74.7	Confident	76.4	Confident	75 Å²	75	71.9 Å²	71.9	28%	0.283	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-31	-176.4	-178.9	177.8	178.1	120.5	-2	115.6	L513 L528 R530 A534	L513-R532 HydrophobicContact CD1-CB 4.28Å; L513-R532 HydrophobicContact CD1-CG 4.17Å; L528-R532 WeakPolarHBondContact O-CB 3.33Å; L528-R532 PolarHBondContact O-N 2.93Å; R530-R532 VanDerWaalsContact C-N 3.33Å; R530-R532 PolarHBondContact O-N 3.34Å; R532-A534 VanDerWaalsContact C-N 3.26Å; R532-A534 PolarHBondContact O-N 2.67Å
533	V	74.1	Confident	77.1	Confident	141 Å²	141	69.5 Å²	69.5	86%	0.855	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-30.5	178.2	-179.8	0	0	0	0	111.7	A531	A531-V533 PolarHBondContact O-N 2.91Å
534	A	73.6	Confident	77.8	Confident	85 Å²	85	74.9 Å²	74.9	70%	0.702	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-9.3	179.8	0	0	0	0	0	113.6	A531 R532	A531-A534 WeakPolarHBondContact O-CA 3.47Å; A531-A534 PolarHBondContact O-N 2.87Å; R532-A534 VanDerWaalsContact C-N 3.26Å; R532-A534 PolarHBondContact O-N 2.67Å
535	L	83.4	Confident	78.5	Confident	15 Å²	15	74.4 Å²	74.4	8%	0.079	36%	0.362	C	S	.	.	S	Bend	trans	-97.3	140.6	-177	-60	-175	0	0	0	112.2	M503 V511 L513 L528 A531 L537	M503-L535 HydrophobicContact CE-CD2 3.36Å; M503-L535 HydrophobicContact SD-CD2 4.02Å; V511-L535 HydrophobicContact CB-CD1 4.3Å; V511-L535 HydrophobicContact CB-CD2 3.74Å; V511-L535 HydrophobicContact CG1-CD1 3.91Å; V511-L535 HydrophobicContact CG1-CD2 4.29Å; L513-L535 HydrophobicContact CD1-CB 3.79Å; L513-L535 HydrophobicContact CD1-CD1 3.87Å; L513-L535 HydrophobicContact CD1-CG 4.44Å; L513-L535 HydrophobicContact CD2-CD1 3.85Å; L513-L535 HydrophobicContact CG-CB 3.92Å; L513-L535 HydrophobicContact CG-CD1 3.8Å; L528-L535 HydrophobicContact CD1-CD1 4.5Å; A531-L535 HydrophobicContact CB-CD1 3.81Å; A531-L535 HydrophobicContact CB-CG 4.13Å; A531-L535 WeakPolarHBondContact O-CG 3.43Å; A531-L535 PolarHBondContact O-N 3.32Å; A531-L535 VanDerWaalsContact O-N 3.17Å; L535-L537 PolarHBondContact O-N 3.33Å
536	A	83.4	Confident	78.9	Confident	22 Å²	22	79.5 Å²	79.5	18%	0.182	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	127.1	171.2	0	0	0	0	0	110.1	L513 E559	L513-A536 PolarHBondContact N-O 3.36Å; A536-E559 HydrophobicContact CB-CG 3.75Å; A536-E559 WeakPolarHBondContact CB-OE1 3.28Å
537	L	84.9	Confident	79.3	Confident	35 Å²	35	78.7 Å²	78.7	18%	0.183	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	117.9	178.8	-179.2	74.7	0	0	0	110.8	L513 Q515 L535 R539 Q555	L513-L537 HydrophobicContact CB-CD1 3.63Å; L513-L537 HydrophobicContact CD1-CD1 4.37Å; L513-L537 CarbonylContact O-C 3.4Å; L513-L537 WeakPolarHBondContact O-CA 3.24Å; Q515-L537 HydrophobicContact CB-CD1 4.04Å; L535-L537 PolarHBondContact O-N 3.33Å; L537-R539 HydrophobicContact CD2-CG 4.44Å; L537-R539 HydrophobicContact CG-CG 4.45Å; L537-Q555 PolarHBondContact O-NE2 2.82Å
538	V	88.1	Confident	79.7	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	127.8	175.5	-166	0	0	0	0	108.9	I512 L513 V514 Q515 F552 Q555 L556	I512-V538 HydrophobicContact CG2-CG2 4.13Å; L513-V538 PolarHBondContact O-N 2.89Å; V514-V538 CarbonylContact C-O 3.59Å; V514-V538 WeakPolarHBondContact CA-O 3.39Å; Q515-V538 PolarHBondContact N-O 3.48Å; V538-F552 HydrophobicContact CB-CE2 4.29Å; V538-F552 HydrophobicContact CG1-CD2 3.47Å; V538-F552 VanDerWaalsContact CG1-CD2 3.47Å; V538-F552 HydrophobicContact CG1-CE2 3.6Å; V538-F552 HydrophobicContact CG1-CG 4.29Å; V538-Q555 HydrophobicContact CG1-CB 4.26Å; V538-Q555 HydrophobicContact CG1-CG 4.4Å; V538-Q555 HydrophobicContact CG2-CG 4.28Å; V538-L556 HydrophobicContact CG1-CB 4.32Å; V538-L556 HydrophobicContact CG2-CD1 4.14Å
539	R	87	Confident	80	Confident	147 Å²	147	82.4 Å²	82.4	56%	0.555	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.2	-173	-64.4	-177.5	-178.2	159.8	5.5	112	Q515 L537 F552	Q515-R539 HydrophobicContact CB-CG 4.36Å; L537-R539 HydrophobicContact CD2-CG 4.44Å; L537-R539 HydrophobicContact CG-CG 4.45Å; R539-F552 WeakPolarHBondContact O-CD2 3.32Å
540	W	86.3	Confident	80.5	Confident	36 Å²	36	77.1 Å²	77.1	14%	0.136	39%	0.391	C	S	.	.			trans	-76	124.5	170.6	-173.4	-104.5	0	0	0	110.1	F433 T437 Q515 Y516 S545 K546 F552 W553	F433-W540 AromaticContact CE2-CD2 3.72Å; F433-W540 HydrophobicContact CE2-CD2 3.72Å; F433-W540 AromaticContact CE2-CE2 3.65Å; F433-W540 AromaticContact CE2-CE3 3.94Å; F433-W540 HydrophobicContact CE2-CE3 3.94Å; F433-W540 HydrophobicContact CE2-CG 4.29Å; F433-W540 HydrophobicContact CE2-CH2 4.06Å; F433-W540 AromaticContact CE2-CZ2 3.84Å; F433-W540 HydrophobicContact CE2-CZ2 3.84Å; F433-W540 HydrophobicContact CE2-CZ3 4.1Å; F433-W540 AromaticContact CZ-CD2 3.92Å; F433-W540 HydrophobicContact CZ-CD2 3.92Å; F433-W540 AromaticContact CZ-CE3 3.95Å; F433-W540 HydrophobicContact CZ-CE3 3.95Å; F433-W540 HydrophobicContact CZ-CG 4.27Å; F433-W540 HydrophobicContact CZ-CZ3 4.38Å; T437-W540 HydrophobicContact CG2-CH2 3.78Å; T437-W540 HydrophobicContact CG2-CZ2 4.3Å; T437-W540 HydrophobicContact CG2-CZ3 4.48Å; Q515-W540 WeakPolarHBondContact O-CB 3.16Å; Q515-W540 PolarHBondContact O-N 2.85Å; Y516-W540 AromaticContact CD2-CD1 3.83Å; Y516-W540 HydrophobicContact CD2-CG 4.28Å; W540-S545 VanDerWaalsContact CE3-CB 3.45Å; W540-S545 VanDerWaalsContact CH2-O 3.31Å; W540-S545 WeakPolarHBondContact CH2-O 3.32Å; W540-S545 WeakPolarHBondContact CZ3-O 3.4Å; W540-K546 HydrophobicContact CZ2-CG 4.36Å; W540-F552 HydrophobicContact CB-CE2 4.31Å; W540-F552 AromaticContact CE3-CD1 3.58Å; W540-F552 HydrophobicContact CE3-CD1 3.58Å; W540-F552 HydrophobicContact CE3-CD2 4.03Å; W540-F552 AromaticContact CE3-CE1 3.45Å; W540-F552 HydrophobicContact CE3-CE1 3.45Å; W540-F552 VanDerWaalsContact CE3-CE1 3.45Å; W540-F552 AromaticContact CE3-CE2 3.91Å; W540-F552 HydrophobicContact CE3-CE2 3.91Å; W540-F552 AromaticContact CE3-CG 3.89Å; W540-F552 HydrophobicContact CE3-CG 3.89Å; W540-F552 AromaticContact CE3-CZ 3.63Å; W540-F552 HydrophobicContact CE3-CZ 3.63Å; W540-F552 AromaticContact CZ3-CD1 3.58Å; W540-F552 HydrophobicContact CZ3-CD1 3.58Å; W540-F552 AromaticContact CZ3-CE1 3.51Å; W540-F552 HydrophobicContact CZ3-CE1 3.51Å; W540-F552 HydrophobicContact CZ3-CG 4.28Å; W540-F552 HydrophobicContact CZ3-CZ 4.14Å; W540-W553 HydrophobicContact CH2-CZ2 4.22Å; W540-W553 AromaticContact CZ3-CZ2 3.79Å; W540-W553 HydrophobicContact CZ3-CZ2 3.79Å
541	Q	82.8	Confident	80.9	Confident	118 Å²	118	78.2 Å²	78.2	55%	0.551	40%	0.395	S	S	*	.			trans	-112.9	38.8	-177.8	-62	-174	10.1	0	0	112.2	D543 K544 S545	Q541-D543 PolarHBondContact O-N 3.35Å; Q541-K544 HydrophobicContact CB-CB 4.25Å; Q541-K544 PolarHBondContact O-N 2.86Å; Q541-S545 PolarHBondContact N-OG 2.86Å
542	G	81.7	Confident	81.6	Confident	32 Å²	32	77.7 Å²	77.7	33%	0.33	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	60.2	-128.1	177.4	0	0	0	0	0	112	K544 S545	G542-K544 PolarHBondContact O-N 3.24Å; G542-S545 PolarHBondContact O-N 3.07Å
543	D	76.3	Confident	82.2	Confident	118 Å²	118	74.3 Å²	74.3	63%	0.631	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-59.3	-32.9	-176.2	-63	-41.9	0	0	0	113.5	Q541 S545 K546	Q541-D543 PolarHBondContact O-N 3.35Å; D543-S545 PolarHBondContact O-N 2.85Å; D543-S545 VanDerWaalsContact O-N 3.11Å; D543-K546 PolarHBondContact O-N 2.82Å; D543-K546 VanDerWaalsContact O-N 3.16Å; D543-K546 WeakPolarHBondContact OD1-CE 3.47Å; D543-K546 IonicContact OD1-NZ 3.37Å; D543-K546 PolarHBondContact OD1-NZ 3.01Å
544	K	77.1	Confident	82.8	Confident	166 Å²	166	69.3 Å²	69.3	72%	0.722	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-66.1	-13.9	177	-63.1	-174.6	-179.6	-178	0	113.6	Q541 G542 S550	Q541-K544 HydrophobicContact CB-CB 4.25Å; Q541-K544 PolarHBondContact O-N 2.86Å; G542-K544 PolarHBondContact O-N 3.24Å; K544-S550 WeakPolarHBondContact O-CB 3.27Å
545	S	83.5	Confident	83.4	Confident	4 Å²	4	68.5 Å²	68.5	3%	0.028	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-106.7	-3	179.5	-58.1	0	0	0	0	113.2	W540 Q541 G542 D543 W553	W540-S545 VanDerWaalsContact CE3-CB 3.45Å; W540-S545 VanDerWaalsContact CH2-O 3.31Å; W540-S545 WeakPolarHBondContact CH2-O 3.32Å; W540-S545 WeakPolarHBondContact CZ3-O 3.4Å; Q541-S545 PolarHBondContact N-OG 2.86Å; G542-S545 PolarHBondContact O-N 3.07Å; D543-S545 PolarHBondContact O-N 2.85Å; D543-S545 VanDerWaalsContact O-N 3.11Å; S545-W553 PolarHBondContact O-NE1 2.79Å
546	K	79	Confident	83.6	Confident	140 Å²	140	67.9 Å²	67.9	61%	0.609	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-39.4	179.7	-73.8	-179.1	174.4	169.2	0	112.5	W540 D543	W540-K546 HydrophobicContact CZ2-CG 4.36Å; D543-K546 PolarHBondContact O-N 2.82Å; D543-K546 VanDerWaalsContact O-N 3.16Å; D543-K546 WeakPolarHBondContact OD1-CE 3.47Å; D543-K546 IonicContact OD1-NZ 3.37Å; D543-K546 PolarHBondContact OD1-NZ 3.01Å
547	E	83	Confident	83.7	Confident	137 Å²	137	71 Å²	71	64%	0.64	33%	0.33	S	S	*	.	S	Bend	trans	-71.2	134.9	178.2	-67.4	178.7	-170	0	0	111.9	T549 S550	E547-T549 PolarHBondContact O-N 2.82Å; E547-S550 WeakPolarHBondContact O-CB 3.49Å; E547-S550 PolarHBondContact O-N 2.73Å; E547-S550 PolarHBondContact O-OG 3.02Å
548	L	79.6	Confident	83.7	Confident	63 Å²	63	71.4 Å²	71.4	33%	0.33	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.6	179	-67.5	171.5	0	0	0	113.7	V441 E445 S550 W553	V441-L548 HydrophobicContact CB-CD2 4.41Å; V441-L548 HydrophobicContact CG1-CD2 3.37Å; V441-L548 HydrophobicContact CG2-CD2 4.14Å; E445-L548 HydrophobicContact CB-CD1 4.3Å; E445-L548 HydrophobicContact CG-CD1 4.19Å; L548-S550 VanDerWaalsContact C-N 3.27Å; L548-S550 PolarHBondContact O-N 3.05Å; L548-W553 WeakPolarHBondContact O-CB 3.32Å
549	T	79.4	Confident	83.6	Confident	89 Å²	89	74.1 Å²	74.1	55%	0.546	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-1.4	177.1	55.4	0	0	0	0	113.1	E547 K554	E547-T549 PolarHBondContact O-N 2.82Å; T549-K554 WeakPolarHBondContact O-CE 3.45Å; T549-K554 PolarHBondContact O-NZ 2.62Å
550	S	85.1	Confident	83.6	Confident	14 Å²	14	67.1 Å²	67.1	10%	0.098	32%	0.32	C	S	.	.	S	Bend	trans	-67.9	160.1	-179	68.9	0	0	0	0	112.7	K544 E547 L548 F552 W553 K554	K544-S550 WeakPolarHBondContact O-CB 3.27Å; E547-S550 WeakPolarHBondContact O-CB 3.49Å; E547-S550 PolarHBondContact O-N 2.73Å; E547-S550 PolarHBondContact O-OG 3.02Å; L548-S550 VanDerWaalsContact C-N 3.27Å; L548-S550 PolarHBondContact O-N 3.05Å; S550-F552 PolarHBondContact O-N 3Å; S550-W553 PolarHBondContact O-N 2.86Å; S550-W553 VanDerWaalsContact OG-CD1 3.29Å; S550-K554 PolarHBondContact O-N 3.1Å
551	R	83.4	Confident	83.5	Confident	189 Å²	189	65.5 Å²	65.5	71%	0.713	31%	0.314	S	S	*	.	H	α-helix	trans	-57.8	-31.6	177.7	-154.9	-175.1	-148.3	-176.1	7.1	112.4	L396 Q555	L396-R551 HydrophobicContact CD1-CG 3.6Å; R551-Q555 WeakPolarHBondContact O-CB 3.44Å; R551-Q555 PolarHBondContact O-N 2.69Å
552	F	87.6	Confident	83.3	Confident	5 Å²	5	60.5 Å²	60.5	2%	0.022	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-56.2	178.8	171.6	-96.5	0	0	0	111.3	V514 V538 R539 W540 S550 K554 Q555 L556	V514-F552 HydrophobicContact CG1-CE2 3.97Å; V514-F552 HydrophobicContact CG1-CZ 3.95Å; V538-F552 HydrophobicContact CB-CE2 4.29Å; V538-F552 HydrophobicContact CG1-CD2 3.47Å; V538-F552 VanDerWaalsContact CG1-CD2 3.47Å; V538-F552 HydrophobicContact CG1-CE2 3.6Å; V538-F552 HydrophobicContact CG1-CG 4.29Å; R539-F552 WeakPolarHBondContact O-CD2 3.32Å; W540-F552 HydrophobicContact CB-CE2 4.31Å; W540-F552 AromaticContact CE3-CD1 3.58Å; W540-F552 HydrophobicContact CE3-CD1 3.58Å; W540-F552 HydrophobicContact CE3-CD2 4.03Å; W540-F552 AromaticContact CE3-CE1 3.45Å; W540-F552 HydrophobicContact CE3-CE1 3.45Å; W540-F552 VanDerWaalsContact CE3-CE1 3.45Å; W540-F552 AromaticContact CE3-CE2 3.91Å; W540-F552 HydrophobicContact CE3-CE2 3.91Å; W540-F552 AromaticContact CE3-CG 3.89Å; W540-F552 HydrophobicContact CE3-CG 3.89Å; W540-F552 AromaticContact CE3-CZ 3.63Å; W540-F552 HydrophobicContact CE3-CZ 3.63Å; W540-F552 AromaticContact CZ3-CD1 3.58Å; W540-F552 HydrophobicContact CZ3-CD1 3.58Å; W540-F552 AromaticContact CZ3-CE1 3.51Å; W540-F552 HydrophobicContact CZ3-CE1 3.51Å; W540-F552 HydrophobicContact CZ3-CG 4.28Å; W540-F552 HydrophobicContact CZ3-CZ 4.14Å; S550-F552 PolarHBondContact O-N 3Å; F552-K554 PolarHBondContact O-N 2.86Å; F552-Q555 PolarHBondContact O-N 3.16Å; F552-L556 HydrophobicContact CE1-CD2 4.13Å; F552-L556 HydrophobicContact CZ-CD2 4.18Å; F552-L556 WeakPolarHBondContact O-CB 3.27Å; F552-L556 PolarHBondContact O-N 2.88Å
553	W	87.3	Confident	82.8	Confident	5 Å²	5	63.4 Å²	63.4	2%	0.019	29%	0.292	C	S	.	.	H	α-helix	trans	-69.5	-34.7	-177.8	-65.1	108.8	0	0	0	112.6	T437 L438 V441 W540 S545 L548 S550 L556 R557	T437-W553 HydrophobicContact CG2-CZ2 4.3Å; L438-W553 HydrophobicContact CD1-CH2 3.99Å; L438-W553 HydrophobicContact CD1-CZ3 3.99Å; V441-W553 HydrophobicContact CB-CH2 3.65Å; V441-W553 HydrophobicContact CB-CZ2 4.13Å; V441-W553 HydrophobicContact CB-CZ3 4.01Å; V441-W553 HydrophobicContact CG1-CD2 4.21Å; V441-W553 HydrophobicContact CG1-CE3 3.85Å; V441-W553 HydrophobicContact CG1-CH2 3.59Å; V441-W553 HydrophobicContact CG1-CZ2 3.97Å; V441-W553 HydrophobicContact CG1-CZ3 3.52Å; V441-W553 HydrophobicContact CG2-CH2 4.03Å; V441-W553 HydrophobicContact CG2-CZ2 4.03Å; W540-W553 HydrophobicContact CH2-CZ2 4.22Å; W540-W553 AromaticContact CZ3-CZ2 3.79Å; W540-W553 HydrophobicContact CZ3-CZ2 3.79Å; S545-W553 PolarHBondContact O-NE1 2.79Å; L548-W553 WeakPolarHBondContact O-CB 3.32Å; S550-W553 PolarHBondContact O-N 2.86Å; S550-W553 VanDerWaalsContact OG-CD1 3.29Å; W553-L556 HydrophobicContact CE3-CD2 3.86Å; W553-L556 HydrophobicContact CZ3-CD2 3.84Å; W553-L556 PolarHBondContact O-N 3.25Å; W553-R557 VanDerWaalsContact O-CB 3.23Å; W553-R557 WeakPolarHBondContact O-CB 2.97Å; W553-R557 PolarHBondContact O-N 3.02Å
554	K	85.8	Confident	82.2	Confident	36 Å²	36	63.9 Å²	63.9	16%	0.157	29%	0.285	C	S	.	.	H	α-helix	trans	-62.8	-47.4	173.8	-70.1	175.9	-176.8	164.7	0	111.6	L396 E397 L400 T549 S550 F552 R557 V558	L396-K554 HydrophobicContact CB-CB 4.39Å; L396-K554 HydrophobicContact CD1-CB 4.37Å; E397-K554 VanDerWaalsContact CD-NZ 3.32Å; E397-K554 HydrophobicContact CG-CD 4.46Å; E397-K554 WeakPolarHBondContact OE1-CE 3.5Å; E397-K554 IonicContact OE1-NZ 3.36Å; E397-K554 PolarHBondContact OE1-NZ 2.87Å; E397-K554 WeakPolarHBondContact OE2-CE 3.01Å; E397-K554 IonicContact OE2-NZ 2.73Å; L400-K554 HydrophobicContact CD1-CB 3.92Å; L400-K554 HydrophobicContact CD1-CG 3.95Å; T549-K554 WeakPolarHBondContact O-CE 3.45Å; T549-K554 PolarHBondContact O-NZ 2.62Å; S550-K554 PolarHBondContact O-N 3.1Å; F552-K554 PolarHBondContact O-N 2.86Å; K554-R557 PolarHBondContact O-N 2.96Å; K554-V558 WeakPolarHBondContact O-CG2 3.26Å; K554-V558 PolarHBondContact O-N 3.46Å; K554-V558 VanDerWaalsContact O-N 3.11Å
555	Q	85.9	Confident	81.1	Confident	68 Å²	68	60.4 Å²	60.4	32%	0.318	29%	0.288	S	S	.	.	H	α-helix	trans	-65.7	-39.7	177.1	-170.4	-179.2	-8.6	0	0	111.4	L537 V538 R551 F552 V558 E559	L537-Q555 PolarHBondContact O-NE2 2.82Å; V538-Q555 HydrophobicContact CG1-CB 4.26Å; V538-Q555 HydrophobicContact CG1-CG 4.4Å; V538-Q555 HydrophobicContact CG2-CG 4.28Å; R551-Q555 WeakPolarHBondContact O-CB 3.44Å; R551-Q555 PolarHBondContact O-N 2.69Å; F552-Q555 PolarHBondContact O-N 3.16Å; Q555-V558 PolarHBondContact O-N 3.45Å; Q555-E559 PolarHBondContact O-N 3.2Å
556	L	87.5	Confident	79.2	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-62.2	-43.6	175	-169.6	63.4	0	0	0	111.3	L438 L478 I512 V514 V538 F552 W553 V558 E559 L560	L438-L556 HydrophobicContact CD1-CD2 4.13Å; L478-L556 HydrophobicContact CD1-CD1 3.96Å; L478-L556 HydrophobicContact CD1-CD2 4.44Å; I512-L556 HydrophobicContact CG2-CD1 4.14Å; V514-L556 HydrophobicContact CG2-CD1 3.97Å; V538-L556 HydrophobicContact CG1-CB 4.32Å; V538-L556 HydrophobicContact CG2-CD1 4.14Å; F552-L556 HydrophobicContact CE1-CD2 4.13Å; F552-L556 HydrophobicContact CZ-CD2 4.18Å; F552-L556 WeakPolarHBondContact O-CB 3.27Å; F552-L556 PolarHBondContact O-N 2.88Å; W553-L556 HydrophobicContact CE3-CD2 3.86Å; W553-L556 HydrophobicContact CZ3-CD2 3.84Å; W553-L556 PolarHBondContact O-N 3.25Å; L556-V558 VanDerWaalsContact C-N 3.29Å; L556-V558 PolarHBondContact O-N 3.37Å; L556-E559 PolarHBondContact O-N 3.06Å; L556-E559 VanDerWaalsContact O-N 3.08Å; L556-L560 HydrophobicContact CD2-CD1 4.49Å; L556-L560 HydrophobicContact CG-CD1 4.01Å; L556-L560 HydrophobicContact CG-CG 4.34Å; L556-L560 VanDerWaalsContact O-CG 3.28Å; L556-L560 WeakPolarHBondContact O-CG 3.5Å; L556-L560 PolarHBondContact O-N 3.3Å
557	R	86.3	Confident	77.1	Confident	89 Å²	89	68.1 Å²	68.1	34%	0.336	33%	0.33	S	S	.	.	H	α-helix	trans	-64.6	-30.2	178.8	-169	-177.7	-62.6	175.4	1	113.2	L400 W553 K554 E559	L400-R557 HydrophobicContact CD2-CB 4.05Å; L400-R557 HydrophobicContact CD2-CG 3.86Å; W553-R557 VanDerWaalsContact O-CB 3.23Å; W553-R557 WeakPolarHBondContact O-CB 2.97Å; W553-R557 PolarHBondContact O-N 3.02Å; K554-R557 PolarHBondContact O-N 2.96Å; R557-E559 VanDerWaalsContact C-N 3.3Å
558	V	84.7	Confident	74.6	Confident	43 Å²	43	70.1 Å²	70.1	26%	0.261	34%	0.339	S	S	.	.	H	α-helix	trans	-64.7	-36.7	172.8	170.5	0	0	0	0	111.3	L396 L400 K554 Q555 L556	L396-V558 HydrophobicContact CD2-CG2 4.46Å; L400-V558 HydrophobicContact CD2-CG2 3.71Å; L400-V558 HydrophobicContact CG-CG2 4.04Å; K554-V558 WeakPolarHBondContact O-CG2 3.26Å; K554-V558 PolarHBondContact O-N 3.46Å; K554-V558 VanDerWaalsContact O-N 3.11Å; Q555-V558 PolarHBondContact O-N 3.45Å; L556-V558 VanDerWaalsContact C-N 3.29Å; L556-V558 PolarHBondContact O-N 3.37Å
559	E	85.7	Confident	72.6	Confident	56 Å²	56	76 Å²	76	26%	0.262	37%	0.365	S	S	.	.	H	α-helix	trans	-85.3	-24.9	-177.8	-60.8	-63.5	167.4	0	0	113.7	R476 I512 A536 Q555 L556 R557	R476-E559 PolarHBondContact NE-O 2.99Å; I512-E559 HydrophobicContact CD1-CB 3.67Å; I512-E559 HydrophobicContact CG1-CB 4.05Å; I512-E559 HydrophobicContact CG2-CB 4.35Å; A536-E559 HydrophobicContact CB-CG 3.75Å; A536-E559 WeakPolarHBondContact CB-OE1 3.28Å; Q555-E559 PolarHBondContact O-N 3.2Å; L556-E559 PolarHBondContact O-N 3.06Å; L556-E559 VanDerWaalsContact O-N 3.08Å; R557-E559 VanDerWaalsContact C-N 3.3Å
560	L	86.9	Confident	70.2	Confident	1 Å²	1	80.6 Å²	80.6	1%	0.005	38%	0.38	C	S	.	.	S	Bend	trans	-69.6	160.5	175.4	-72.4	174	0	0	0	112.5	R403 V420 L442 Y448 I512 L556	R403-L560 PolarHBondContact NH2-O 2.9Å; V420-L560 HydrophobicContact CG2-CD2 3.38Å; L442-L560 HydrophobicContact CD2-CD1 3.57Å; Y448-L560 HydrophobicContact CD2-CD1 4.24Å; Y448-L560 HydrophobicContact CE1-CB 4.3Å; Y448-L560 HydrophobicContact CE2-CB 4.47Å; Y448-L560 HydrophobicContact CE2-CD1 3.71Å; I512-L560 HydrophobicContact CD1-CD2 4.29Å; L556-L560 HydrophobicContact CD2-CD1 4.49Å; L556-L560 HydrophobicContact CG-CD1 4.01Å; L556-L560 HydrophobicContact CG-CG 4.34Å; L556-L560 VanDerWaalsContact O-CG 3.28Å; L556-L560 WeakPolarHBondContact O-CG 3.5Å; L556-L560 PolarHBondContact O-N 3.3Å
561	P	84.2	Confident	67.8	Low	2 Å²	2	89.4 Å²	89.4	1%	0.013	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-56.2	147.2	178.9	-23	36	0	0	0	112.1	D419 Y448 R475 R476 R563	D419-P561 HydrophobicContact CB-CG 4.28Å; Y448-P561 PolarHBondContact OH-O 3.1Å; R475-P561 HydrophobicContact CB-CG 3.94Å; R476-P561 HydrophobicContact CG-CG 3.77Å; P561-R563 PolarHBondContact O-N 3.36Å
562	V	79	Confident	65.4	Low	13 Å²	13	83.7 Å²	83.7	8%	0.079	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-64.2	130.3	177	-175.8	0	0	0	0	107.4	R403 T408 E410	R403-V562 HydrophobicContact CG-CG1 4.3Å; R403-V562 HydrophobicContact CG-CG2 4.06Å; T408-V562 WeakPolarHBondContact O-CB 3.41Å; E410-V562 PolarHBondContact OE1-N 2.76Å
563	R	71.5	Confident	62.9	Low	92 Å²	92	87.9 Å²	87.9	35%	0.347	45%	0.45	S	S	.	.			trans	-120.8	134.7	163.9	-170.5	-177.8	174.1	158.6	6	109.6	L446 G447 P561	L446-R563 PolarHBondContact O-NH1 3.3Å; L446-R563 VanDerWaalsContact O-NH1 3.09Å; G447-R563 PolarHBondContact O-NH1 3.09Å; P561-R563 PolarHBondContact O-N 3.36Å
564	R	63.1	Low	60.5	Low	128 Å²	128	92.2 Å²	92.2	48%	0.483	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-80.6	125.4	160.8	-73.7	-174.3	-178.3	172.7	-1.2	107.6	G407 D409 G566	G407-R564 PolarHBondContact O-NE 2.84Å; G407-R564 PolarHBondContact O-NH2 3.22Å; D409-R564 PolarHBondContact OD2-N 3.43Å; R564-G566 PolarHBondContact O-N 3.35Å
565	A	54	Low	58.3	Low	93 Å²	93	99.4 Å²	99.4	77%	0.769	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-52.8	119.7	169.5	0	0	0	0	0	107.5	R567	A565-R567 PolarHBondContact O-N 2.67Å
566	G	43.9	Very low	56.3	Low	56 Å²	56	103 Å²	103	58%	0.577	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-55.4	127.2	172.1	0	0	0	0	0	107.1	R564 E568	R564-G566 PolarHBondContact O-N 3.35Å; G566-E568 PolarHBondContact O-N 2.92Å
567	R	34.4	Very low	54	Low	250 Å²	250	105.7 Å²	105.7	94%	0.943	55%	0.551	S	S	*	*			trans	-67.3	83.9	172.2	-146.7	-179.2	-168.2	175.6	1.5	106.1	A565 E569	A565-R567 PolarHBondContact O-N 2.67Å; R567-E569 PolarHBondContact O-N 3.11Å
568	E	31.7	Very low	51.9	Low	179 Å²	179	104 Å²	104	84%	0.836	56%	0.556	S	S	*	*			trans	-61.3	128.2	165.3	-78.3	-175.7	166.4	0	0	107.3	G566 Q570	G566-E568 PolarHBondContact O-N 2.92Å; E568-Q570 VanDerWaalsContact C-N 3.32Å; E568-Q570 PolarHBondContact O-N 3.11Å
569	E	37.4	Very low	49.9	Very low	188 Å²	188	107.4 Å²	107.4	88%	0.879	57%	0.572	S	S	*	*			trans	-59.1	89.3	177.3	-70.3	175.6	136.6	0	0	110.4	R567 Q571	R567-E569 PolarHBondContact O-N 3.11Å; E569-Q571 VanDerWaalsContact C-N 3.26Å; E569-Q571 PolarHBondContact O-N 3.15Å
570	Q	28.8	Very low	47.8	Very low	184 Å²	184	111.9 Å²	111.9	86%	0.86	60%	0.595	S	S	*	*			trans	-85.1	80.9	156.5	-94.1	170.4	-18.2	0	0	109.2	E568 G572	E568-Q570 VanDerWaalsContact C-N 3.32Å; E568-Q570 PolarHBondContact O-N 3.11Å; Q570-G572 PolarHBondContact O-N 3.16Å
571	Q	34.3	Very low	45.7	Very low	199 Å²	199	121 Å²	121	93%	0.93	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	82.4	153.5	-159.3	162	25.7	0	0	107.9	E569	E569-Q571 VanDerWaalsContact C-N 3.26Å; E569-Q571 PolarHBondContact O-N 3.15Å
572	G	33.8	Very low	43.8	Very low	70 Å²	70	127.2 Å²	127.2	72%	0.722	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-170	-4.6	-173.7	0	0	0	0	0	116.6	Q570	Q570-G572 PolarHBondContact O-N 3.16Å
573	S	33.8	Very low	42.1	Very low	92 Å²	92	132.4 Å²	132.4	64%	0.643	69%	0.688	S	S	*	*			trans	-123.1	52.3	174.7	-163.8	0	0	0	0	111.8
574	S	37.3	Very low	40.6	Very low	97 Å²	97	133 Å²	133	68%	0.678	71%	0.706	S	S	*	*	S	Bend	trans	-112	5.3	166.7	-171.2	0	0	0	0	112.8
575	K	40.2	Very low	39.8	Very low	186 Å²	186	134.7 Å²	134.7	81%	0.809	72%	0.72	S	S	*	*	S	Bend	trans	-95.9	-22.9	176.5	-82.2	-175.3	173.9	178.7	0	114.4	L579	K575-L579 WeakPolarHBondContact O-CB 3.4Å; K575-L579 PolarHBondContact O-N 3.26Å
576	E	43.3	Very low	39.1	Very low	145 Å²	145	137.6 Å²	137.6	68%	0.678	72%	0.722	S	S	*	*	H	α-helix	trans	-87.6	-32.1	176.8	-80.8	174.2	143.1	0	0	113.7	A578 L579 M580	E576-A578 VanDerWaalsContact C-N 3.29Å; E576-A578 PolarHBondContact O-N 2.86Å; E576-L579 PolarHBondContact O-N 3.23Å; E576-M580 PolarHBondContact O-N 2.81Å; E576-M580 VanDerWaalsContact O-N 3.11Å
577	A	38.8	Very low	38.6	Very low	57 Å²	57	140.5 Å²	140.5	47%	0.471	73%	0.734	S	S	.	*	H	α-helix	trans	-72.8	-21	173.7	0	0	0	0	0	113.4
578	A	43.3	Very low	38.8	Very low	53 Å²	53	134.4 Å²	134.4	44%	0.438	73%	0.725	S	S	.	*	H	α-helix	trans	-85.5	-32.3	172.7	0	0	0	0	0	112.3	E576 R581 L582	E576-A578 VanDerWaalsContact C-N 3.29Å; E576-A578 PolarHBondContact O-N 2.86Å; A578-R581 PolarHBondContact O-N 3.04Å; A578-L582 PolarHBondContact O-N 2.87Å
579	L	43.3	Very low	38.8	Very low	114 Å²	114	133.2 Å²	133.2	60%	0.597	72%	0.724	S	S	*	*	H	α-helix	trans	-69.8	-37.8	175.1	-157.1	96.8	0	0	0	111.9	K575 E576 R581 L582 I583	K575-L579 WeakPolarHBondContact O-CB 3.4Å; K575-L579 PolarHBondContact O-N 3.26Å; E576-L579 PolarHBondContact O-N 3.23Å; L579-R581 VanDerWaalsContact C-N 3.27Å; L579-R581 PolarHBondContact O-N 3.37Å; L579-L582 PolarHBondContact O-N 3.47Å; L579-I583 HydrophobicContact CD2-CD1 4.41Å; L579-I583 PolarHBondContact O-N 3.04Å
580	M	40.3	Very low	38.5	Very low	151 Å²	151	129.3 Å²	129.3	74%	0.744	72%	0.717	S	S	*	*	H	α-helix	trans	-70.6	-16.6	174.9	-86.3	-84.6	-100.9	0	0	114.2	E576	E576-M580 PolarHBondContact O-N 2.81Å; E576-M580 VanDerWaalsContact O-N 3.11Å
581	R	43.5	Very low	38.7	Very low	193 Å²	193	129.1 Å²	129.1	73%	0.728	72%	0.716	S	S	*	*	H	α-helix	trans	-89.8	-16.3	173.4	-78	-171.1	175.6	121.4	-2.8	114.1	A578 L579	A578-R581 PolarHBondContact O-N 3.04Å; L579-R581 VanDerWaalsContact C-N 3.27Å; L579-R581 PolarHBondContact O-N 3.37Å
582	L	45.2	Very low	38.7	Very low	131 Å²	131	126.1 Å²	126.1	69%	0.686	71%	0.712	S	S	*	*	H	α-helix	trans	-90.9	-14.9	175.2	-81.9	160.4	0	0	0	113.6	A578 L579	A578-L582 PolarHBondContact O-N 2.87Å; L579-L582 PolarHBondContact O-N 3.47Å
583	I	41.6	Very low	38.4	Very low	123 Å²	123	126.2 Å²	126.2	63%	0.631	71%	0.713	S	S	*	*	S	Bend	trans	-89.3	-15.6	177.3	-62.3	169.8	0	0	0	112.1	L579	L579-I583 HydrophobicContact CD2-CD1 4.41Å; L579-I583 PolarHBondContact O-N 3.04Å
584	S	40.3	Very low	38.2	Very low	105 Å²	105	129.8 Å²	129.8	73%	0.734	72%	0.724	S	S	*	*	S	Bend	trans	-83.6	-8.2	175.8	-178.2	0	0	0	0	114.5
585	Q	47.4	Very low	38	Very low	162 Å²	162	132.3 Å²	132.3	76%	0.757	73%	0.729	S	S	*	*	S	Bend	trans	-113.8	8.1	-175.6	-73.3	-169.4	-13.4	0	0	114.7
586	N	38.3	Very low	37.5	Very low	155 Å²	155	128.9 Å²	128.9	83%	0.829	73%	0.728	S	S	*	*	S	Bend	trans	-130.6	56	178.8	-124.1	9.2	0	0	0	111.7
587	S	33.6	Very low	36.9	Very low	116 Å²	116	129 Å²	129	81%	0.811	73%	0.733	S	S	*	*			trans	-159.6	68	158.5	-163.5	0	0	0	0	110.6
588	T	39.4	Very low	36.5	Very low	123 Å²	123	133.2 Å²	133.2	76%	0.755	75%	0.753	S	S	*	*			trans	-108.3	113.7	151.8	48.7	0	0	0	0	106.7
589	N	31.1	Very low	35.9	Very low	154 Å²	154	137 Å²	137	82%	0.824	77%	0.771	S	S	*	*			trans	166.7	109.4	139.1	-84.5	-18.9	0	0	0	111.4
590	S	31.1	Very low	35.3	Very low	106 Å²	106	141 Å²	141	74%	0.741	78%	0.783	S	S	*	*				175	120.8	114.3	42.7	0	0	0	0	111.5
591	Q	33.1	Very low	34.9	Very low	179 Å²	179	140.5 Å²	140.5	84%	0.836	79%	0.789	S	S	*	*			trans	61.1	138.1	141.2	-60.4	179.3	-11.1	0	0	118.6
592	T	33.1	Very low	34.8	Very low	136 Å²	136	136.3 Å²	136.3	83%	0.834	79%	0.787	S	S	*	*			cis	-178.6	147.4	-4	21.3	0	0	0	0	104.3
593	G	28.3	Very low	34.2	Very low	73 Å²	73	138.7 Å²	138.7	75%	0.753	79%	0.794	S	S	*	*			trans	119.6	119.6	144.7	0	0	0	0	0	118.8
594	L	29.7	Very low	33.7	Very low	166 Å²	166	142.7 Å²	142.7	87%	0.869	81%	0.808	S	S	*	*			trans	87.1	78.7	147.8	-68	155.8	0	0	0	119.7
595	I	32.4	Very low	33.6	Very low	151 Å²	151	144.1 Å²	144.1	77%	0.774	81%	0.811	S	S	*	*				24.6	115.9	111.2	-51	172.3	0	0	0	116.5
596	S	30.7	Very low	33.3	Very low	114 Å²	114	141.2 Å²	141.2	80%	0.797	81%	0.806	S	S	*	*				-165.5	135.9	105.4	56	0	0	0	0	112.4
597	N	29.9	Very low	33	Very low	147 Å²	147	140.9 Å²	140.9	79%	0.786	81%	0.805	S	S	*	*			trans	-69.6	141.1	-177.3	-68.2	-36.6	0	0	0	111.8
598	T	30.7	Very low	33.1	Very low	145 Å²	145	140.5 Å²	140.5	89%	0.89	80%	0.802	S	S	*	*			trans	-138	118.1	135.4	32.6	0	0	0	0	110.2
599	T	31.9	Very low	33.1	Very low	132 Å²	132	139.6 Å²	139.6	81%	0.81	81%	0.807	S	S	*	*			trans	-64.5	133.1	178	37.2	0	0	0	0	112.4
600	K	29.9	Very low	33.3	Very low	198 Å²	198	140.7 Å²	140.7	86%	0.861	84%	0.838	S	S	*	*			trans	-60.9	146.8	155.5	-79.2	176.1	172.6	175.6	0	110.4
601	T	32	Very low	33.4	Very low	142 Å²	142	142.5 Å²	142.5	87%	0.871	84%	0.842	S	S	*	*				-164	158.7	126.6	23.3	0	0	0	0	110.2
602	P	41.3	Very low	33.4	Very low	104 Å²	104	140.5 Å²	140.5	68%	0.675	84%	0.843	S	S	*	*			trans	-116.1	178.8	-139.1	42	-32.2	0	0	0	114.8
603	Q	33	Very low	33.4	Very low	181 Å²	181	140.8 Å²	140.8	85%	0.846	84%	0.843	S	S	*	*			trans	65.3	116.2	154.3	-84.4	177.8	-24.5	0	0	118.9
604	K	30.7	Very low	33.7	Very low	208 Å²	208	144.8 Å²	144.8	90%	0.904	85%	0.849	S	S	*	*				-167.4	113.7	122.2	-107	169.1	-178.3	-179.7	0	111.3
605	V	38.3	Very low	34	Very low	134 Å²	134	143.4 Å²	143.4	81%	0.812	85%	0.847	S	S	*	*			trans	-82	146.1	146.3	-173	0	0	0	0	103.7
606	P	41.4	Very low	34.1	Very low	101 Å²	101	142.9 Å²	142.9	66%	0.656	85%	0.852	S	S	*	*			cis	-153.4	-178.2	47.4	44.6	-23.1	0	0	0	118.4
607	N	31.3	Very low	34.3	Very low	149 Å²	149	145 Å²	145	80%	0.797	86%	0.856	S	S	*	*			trans	102	112.1	147.5	-70.9	-7.6	0	0	0	120.4
608	S	36.3	Very low	34.6	Very low	108 Å²	108	144.8 Å²	144.8	76%	0.755	86%	0.861	S	S	*	*			trans	-57.5	162.1	153.8	46.3	0	0	0	0	115.4
609	A	38.5	Very low	35	Very low	103 Å²	103	144.8 Å²	144.8	85%	0.851	86%	0.859	S	S	*	*			trans	101.5	94.1	156.7	0	0	0	0	0	117.1
610	A	35.2	Very low	35.3	Very low	178 Å²	178	146 Å²	146	100%	1.471	86%	0.864	S	S	*	*				-164.5	0	117.3	0	0	0	0	0	108.6

Retrieved 610 of 610 residues in 598.7 ms (Link to these results)

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