A0A096MG59_POEFO Loading...

Fetuin B

AlphaFold DB , UniProt , Accession A0A096MG59, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 580 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	43.2	Very low	46.8	Very low	240 Å²	240	167.6 Å²	167.6	100%	1.182	90%	0.9	S	S	*	*				0	83.9	0	-60.2	-172.6	-68.2	0	0	108.4
2	K	45.8	Very low	46.6	Very low	203 Å²	203	159.3 Å²	159.3	88%	0.883	88%	0.882	S	S	*	*			trans	-145.8	78.1	-179.6	-89.1	-175.5	174.8	177.1	0	107.2
3	T	49.3	Very low	46.3	Very low	134 Å²	134	156.8 Å²	156.8	82%	0.822	88%	0.883	S	S	*	*			trans	-175.2	92.4	173.4	38.5	0	0	0	0	106.2
4	C	46.4	Very low	46.2	Very low	132 Å²	132	152.9 Å²	152.9	89%	0.892	86%	0.864	S	S	*	*			trans	-177.3	30.9	162.9	-104	0	0	0	0	114
5	V	50.8	Low	45.9	Very low	145 Å²	145	156.4 Å²	156.4	88%	0.879	86%	0.86	S	S	*	*	S	Bend	trans	-135.1	42.1	175.8	-161.9	0	0	0	0	111.6
6	L	45.4	Very low	45.2	Very low	164 Å²	164	154.4 Å²	154.4	86%	0.859	86%	0.861	S	S	*	*	S	Bend	trans	-145.4	34.6	179.6	-120.2	138.5	0	0	0	113.4
7	F	42.4	Very low	44.6	Very low	202 Å²	202	149.6 Å²	149.6	89%	0.886	85%	0.845	S	S	*	*	S	Bend	trans	-140	27.7	178.9	-105.1	-76.7	0	0	0	114.7
8	L	46.2	Very low	44.2	Very low	175 Å²	175	148 Å²	148	92%	0.916	84%	0.842	S	S	*	*	S	Bend	trans	-137.9	35.8	174.9	-78.5	176.1	0	0	0	113.9
9	L	45.3	Very low	43.9	Very low	174 Å²	174	147.1 Å²	147.1	91%	0.911	84%	0.84	S	S	*	*	S	Bend	trans	-145.6	42.1	168.6	-89.3	175.5	0	0	0	112
10	V	50.2	Low	43.8	Very low	136 Å²	136	145.9 Å²	145.9	82%	0.824	83%	0.826	S	S	*	*	S	Bend	trans	-136.5	28	172.9	-162.3	0	0	0	0	112
11	V	50.2	Low	43.7	Very low	139 Å²	139	147.2 Å²	147.2	84%	0.842	83%	0.825	S	S	*	*			trans	-139.7	74.8	174.6	-167.8	0	0	0	0	109.1
12	G	44.5	Very low	44.4	Very low	67 Å²	67	138.9 Å²	138.9	69%	0.691	80%	0.801	S	S	*	*	S	Bend	trans	-159.3	19.6	-179	0	0	0	0	0	114.9
13	S	42.8	Very low	45.8	Very low	127 Å²	127	130.4 Å²	130.4	89%	0.888	77%	0.771	S	S	*	*			trans	-141.2	50.2	174.3	-46.8	0	0	0	0	109.5
14	V	44.8	Very low	47.7	Very low	103 Å²	103	126.1 Å²	126.1	62%	0.624	74%	0.743	S	S	*	*			trans	-88.9	119.2	165.9	-105.7	0	0	0	0	108.2
15	Y	41.2	Very low	49.9	Very low	205 Å²	205	124.3 Å²	124.3	80%	0.804	72%	0.722	S	S	*	*			trans	60.9	76	159.7	-52.3	-73.6	0	0	0	116.5	A17	Y15-A17 PolarHBondContact O-N 3.31Å
16	S	34.3	Very low	51.9	Low	125 Å²	125	120.9 Å²	120.9	87%	0.874	70%	0.702	S	S	*	*				-60.6	101	130	-61.4	0	0	0	0	105.9
17	A	35.9	Very low	54.1	Low	72 Å²	72	113.3 Å²	113.3	60%	0.595	66%	0.664	S	S	*	*			trans	-49.7	135.8	157.6	0	0	0	0	0	106.4	Y15 V19	Y15-A17 PolarHBondContact O-N 3.31Å; A17-V19 PolarHBondContact O-N 3.43Å
18	P	37.2	Very low	56.6	Low	121 Å²	121	104.9 Å²	104.9	79%	0.786	63%	0.63	S	S	*	*			trans	-55.7	117.4	169.4	25	-29.6	0	0	0	105.6	E20	P18-E20 PolarHBondContact O-N 2.83Å
19	V	38.3	Very low	58.8	Low	131 Å²	131	97.4 Å²	97.4	79%	0.794	59%	0.592	S	S	*	*			trans	-50.3	115.1	158.2	170.4	0	0	0	0	103.6	A17 Q21	A17-V19 PolarHBondContact O-N 3.43Å; V19-Q21 PolarHBondContact O-N 2.88Å
20	E	42.1	Very low	61.1	Low	122 Å²	122	96.7 Å²	96.7	57%	0.57	58%	0.584	S	S	*	*			trans	-44.1	114.1	168.3	-84	-107.9	109.6	0	0	105.9	P18 G22	P18-E20 PolarHBondContact O-N 2.83Å; E20-G22 PolarHBondContact O-N 2.96Å
21	Q	41.6	Very low	63.2	Low	174 Å²	174	93.4 Å²	93.4	81%	0.813	56%	0.562	S	S	*	*			trans	-70	71.6	166.7	-75.5	177	-26.2	0	0	105.8	V19 G23	V19-Q21 PolarHBondContact O-N 2.88Å; Q21-G23 PolarHBondContact O-N 2.97Å
22	G	58.2	Low	65.3	Low	65 Å²	65	91.6 Å²	91.6	67%	0.67	55%	0.553	S	S	*	*			trans	-64.5	123.3	175.9	0	0	0	0	0	107.8	E20	E20-G22 PolarHBondContact O-N 2.96Å
23	G	75.2	Confident	67.6	Low	25 Å²	25	89.8 Å²	89.8	26%	0.258	53%	0.53	S	S	.	.	S	Bend	trans	152.6	145	-175.2	0	0	0	0	0	111.7	Q21 Q25 D66	Q21-G23 PolarHBondContact O-N 2.97Å; G23-Q25 PolarHBondContact O-N 3.48Å; G23-Q25 PolarHBondContact O-NE2 2.99Å; G23-D66 PolarHBondContact N-OD1 3.36Å
24	I	88.3	Confident	70.1	Confident	45 Å²	45	83.9 Å²	83.9	23%	0.231	49%	0.488	C	S	.	.			trans	-60.7	120.8	179.6	-55	178	0	0	0	110.1	H64 D66 Y76 L546 P549	I24-H64 HydrophobicContact CG2-CB 3.31Å; I24-D66 HydrophobicContact CG1-CB 4.4Å; I24-Y76 HydrophobicContact CD1-CD2 4.2Å; I24-Y76 HydrophobicContact CD1-CE2 3.93Å; I24-Y76 HydrophobicContact CG1-CD2 4.31Å; I24-Y76 HydrophobicContact CG1-CE2 3.91Å; I24-Y76 HydrophobicContact CG2-CD2 4.17Å; I24-L546 HydrophobicContact CD1-CB 3.84Å; I24-L546 HydrophobicContact CD1-CD1 3.88Å; I24-L546 HydrophobicContact CG1-CD1 3.68Å; I24-P549 HydrophobicContact CD1-CG 3.97Å; I24-P549 HydrophobicContact CG2-CG 3.73Å
25	Q	92.2	Very high	72.5	Confident	94 Å²	94	81.3 Å²	81.3	44%	0.439	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	145.4	176.1	-59.3	-56.4	-33.7	0	0	111	G23 H64 L65	G23-Q25 PolarHBondContact O-N 3.48Å; G23-Q25 PolarHBondContact O-NE2 2.99Å; Q25-H64 CarbonylContact O-C 3.59Å; Q25-H64 WeakPolarHBondContact O-CA 3.4Å; Q25-H64 WeakPolarHBondContact O-CB 3.34Å; Q25-L65 HydrophobicContact CB-CD1 4.34Å; Q25-L65 PolarHBondContact N-O 2.74Å; Q25-L65 PolarHBondContact O-N 3.24Å
26	P	92.8	Very high	75.1	Confident	72 Å²	72	74.4 Å²	74.4	47%	0.468	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	140.7	170.9	28	-33.4	0	0	0	110.4
27	G	92.8	Very high	78	Confident	5 Å²	5	68.5 Å²	68.5	5%	0.052	41%	0.413	C	S	.	.			trans	-122.4	169.4	175.2	0	0	0	0	0	112.4	V63 S553	G27-V63 PolarHBondContact N-O 3.47Å; G27-S553 VanDerWaalsContact O-CB 3.26Å; G27-S553 WeakPolarHBondContact O-CB 3.5Å; G27-S553 PolarHBondContact O-OG 2.95Å
28	S	93.6	Very high	80.9	Confident	25 Å²	25	65 Å²	65	18%	0.175	39%	0.385	C	S	.	.			trans	-83.2	139.1	177	-173.1	0	0	0	0	112.2	E30 A34 E555	S28-E30 PolarHBondContact O-N 3.06Å; S28-E30 PolarHBondContact OG-N 3.4Å; S28-E30 VanDerWaalsContact OG-N 3.08Å; S28-A34 WeakPolarHBondContact O-CB 3.34Å; S28-E555 VanDerWaalsContact CB-OE2 3.25Å; S28-E555 WeakPolarHBondContact CB-OE2 3.46Å
29	C	93.1	Very high	83.8	Confident	19 Å²	19	62 Å²	62	13%	0.128	36%	0.36	C	S	.	.	S	Bend	trans	-74.6	-13.9	168.8	-76.5	0	0	0	0	112.9	V35 L60 E555 C556	C29-V35 WeakPolarHBondContact O-CG2 3.28Å; C29-L60 HydrophobicContact CB-CD2 4.45Å; C29-L60 HydrophobicContact CB-CG 4.29Å; C29-L60 PolarHBondContact SG-O 3.45Å; C29-E555 PolarHBondContact N-O 3.26Å; C29-C556 HydrophobicContact CB-CB 3.91Å; C29-C556 WeakPolarHBondContact CB-SG 3.39Å; C29-C556 PolarHBondContact N-SG 2.69Å; C29-C556 VanDerWaalsContact N-SG 3.44Å; C29-C556 WeakPolarHBondContact SG-CB 3.12Å; C29-C556 CovalentContact SG-SG 2.03Å; C29-C556 PolarHBondContact SG-SG 2.91Å
30	E	93.6	Very high	86.5	Confident	159 Å²	159	58.9 Å²	58.9	74%	0.743	34%	0.339	S	S	*	.	S	Bend	trans	-96.5	-9.4	178.2	-61.8	178.2	177.3	0	0	112.4	S28 P32	S28-E30 PolarHBondContact O-N 3.06Å; S28-E30 PolarHBondContact OG-N 3.4Å; S28-E30 VanDerWaalsContact OG-N 3.08Å; E30-P32 WeakPolarHBondContact O-CD 3.39Å
31	D	94.3	Very high	89.1	Confident	66 Å²	66	53.1 Å²	53.1	35%	0.353	31%	0.312	S	S	.	.			trans	-62.8	125.9	177.5	176	-97.3	0	0	0	110.5	S33 A34 V35	D31-S33 PolarHBondContact O-N 3.24Å; D31-S33 VanDerWaalsContact O-N 3.16Å; D31-S33 VanDerWaalsContact OD1-CA 3.25Å; D31-S33 WeakPolarHBondContact OD1-CA 3.47Å; D31-S33 WeakPolarHBondContact OD1-CB 3.48Å; D31-S33 PolarHBondContact OD1-N 2.82Å; D31-A34 HydrophobicContact CB-CB 4.05Å; D31-A34 WeakPolarHBondContact O-CB 3.34Å; D31-A34 PolarHBondContact O-N 2.92Å; D31-A34 PolarHBondContact OD1-N 3.36Å; D31-V35 WeakPolarHBondContact O-CG2 3.26Å; D31-V35 PolarHBondContact O-N 2.83Å
32	P	94.3	Very high	91.8	Very high	101 Å²	101	44.8 Å²	44.8	66%	0.656	27%	0.273	S	S	*	.	H	α-helix	trans	-59.5	-29.5	-178.2	-26.7	34.8	0	0	0	114.3	E30 S36	E30-P32 WeakPolarHBondContact O-CD 3.39Å; P32-S36 VanDerWaalsContact O-CB 3.24Å; P32-S36 WeakPolarHBondContact O-CB 3.34Å; P32-S36 PolarHBondContact O-N 3.05Å
33	S	93.4	Very high	93.6	Very high	30 Å²	30	43.1 Å²	43.1	21%	0.21	25%	0.251	C	S	.	.	H	α-helix	trans	-73.5	-39.8	176.1	-55.4	0	0	0	0	111	D31 S36 A37 Y75 K119	D31-S33 PolarHBondContact O-N 3.24Å; D31-S33 VanDerWaalsContact O-N 3.16Å; D31-S33 VanDerWaalsContact OD1-CA 3.25Å; D31-S33 WeakPolarHBondContact OD1-CA 3.47Å; D31-S33 WeakPolarHBondContact OD1-CB 3.48Å; D31-S33 PolarHBondContact OD1-N 2.82Å; S33-S36 PolarHBondContact O-N 2.92Å; S33-A37 WeakPolarHBondContact O-CB 3.49Å; S33-A37 PolarHBondContact O-N 3.31Å; S33-Y75 WeakPolarHBondContact CB-OH 3.36Å; S33-K119 PolarHBondContact OG-NZ 2.91Å
34	A	94.9	Very high	94.5	Very high	2 Å²	2	45.5 Å²	45.5	2%	0.017	25%	0.254	C	S	.	.	H	α-helix	trans	-64.1	-44.2	173.6	0	0	0	0	0	112.3	S28 D31 S36 A37 S38 L60 V63 Y75	S28-A34 WeakPolarHBondContact O-CB 3.34Å; D31-A34 HydrophobicContact CB-CB 4.05Å; D31-A34 WeakPolarHBondContact O-CB 3.34Å; D31-A34 PolarHBondContact O-N 2.92Å; D31-A34 PolarHBondContact OD1-N 3.36Å; A34-S36 PolarHBondContact O-N 3.26Å; A34-A37 WeakPolarHBondContact O-CB 3.25Å; A34-A37 PolarHBondContact O-N 2.9Å; A34-S38 PolarHBondContact O-N 2.66Å; A34-L60 HydrophobicContact CB-CD2 4.39Å; A34-V63 HydrophobicContact CB-CG1 3.91Å; A34-V63 HydrophobicContact CB-CG2 4.08Å; A34-Y75 HydrophobicContact CB-CE1 4.39Å
35	V	95.3	Very high	94.9	Very high	49 Å²	49	43.4 Å²	43.4	30%	0.297	24%	0.243	S	C	.	.	H	α-helix	trans	-61.7	-44.2	174.7	175.4	0	0	0	0	110.7	C29 D31 A37 S38 H39 L60	C29-V35 WeakPolarHBondContact O-CG2 3.28Å; D31-V35 WeakPolarHBondContact O-CG2 3.26Å; D31-V35 PolarHBondContact O-N 2.83Å; V35-A37 PolarHBondContact O-N 3.36Å; V35-S38 WeakPolarHBondContact O-CB 3.47Å; V35-S38 PolarHBondContact O-N 3.04Å; V35-S38 PolarHBondContact O-OG 3.25Å; V35-H39 PolarHBondContact O-N 3.3Å; V35-H39 VanDerWaalsContact O-N 3.14Å; V35-L60 HydrophobicContact CG2-CD2 4.45Å
36	S	95.1	Very high	95.1	Very high	61 Å²	61	39.3 Å²	39.3	43%	0.427	22%	0.224	S	C	.	.	H	α-helix	trans	-61.9	-43.4	175.5	-172.6	0	0	0	0	112.2	P32 S33 A34 S38 H39 L40	P32-S36 VanDerWaalsContact O-CB 3.24Å; P32-S36 WeakPolarHBondContact O-CB 3.34Å; P32-S36 PolarHBondContact O-N 3.05Å; S33-S36 PolarHBondContact O-N 2.92Å; A34-S36 PolarHBondContact O-N 3.26Å; S36-S38 VanDerWaalsContact C-N 3.27Å; S36-S38 PolarHBondContact O-N 3.19Å; S36-H39 PolarHBondContact O-N 2.6Å; S36-L40 WeakPolarHBondContact O-CG 3.49Å; S36-L40 PolarHBondContact O-N 3.48Å
37	A	96.4	Very high	95.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.2	-38	175.2	0	0	0	0	0	111.8	S33 A34 V35 L40 A41 Y75 L77 I115 I117	S33-A37 WeakPolarHBondContact O-CB 3.49Å; S33-A37 PolarHBondContact O-N 3.31Å; A34-A37 WeakPolarHBondContact O-CB 3.25Å; A34-A37 PolarHBondContact O-N 2.9Å; V35-A37 PolarHBondContact O-N 3.36Å; A37-L40 PolarHBondContact O-N 2.7Å; A37-A41 VanDerWaalsContact O-CB 3.28Å; A37-A41 WeakPolarHBondContact O-CB 3.43Å; A37-A41 PolarHBondContact O-N 3.28Å; A37-Y75 HydrophobicContact CB-CD1 4.02Å; A37-Y75 HydrophobicContact CB-CD2 3.82Å; A37-Y75 HydrophobicContact CB-CE1 4.3Å; A37-Y75 HydrophobicContact CB-CE2 4.13Å; A37-Y75 HydrophobicContact CB-CG 3.77Å; A37-L77 HydrophobicContact CB-CD1 4.1Å; A37-I115 HydrophobicContact CB-CG2 4.24Å; A37-I117 HydrophobicContact CB-CD1 3.61Å
38	S	97.1	Very high	95	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.9	-42.6	176.2	82.5	0	0	0	0	113.1	A34 V35 S36 A41 L42	A34-S38 PolarHBondContact O-N 2.66Å; V35-S38 WeakPolarHBondContact O-CB 3.47Å; V35-S38 PolarHBondContact O-N 3.04Å; V35-S38 PolarHBondContact O-OG 3.25Å; S36-S38 VanDerWaalsContact C-N 3.27Å; S36-S38 PolarHBondContact O-N 3.19Å; S38-A41 PolarHBondContact O-N 3.14Å; S38-L42 WeakPolarHBondContact O-CB 3.42Å; S38-L42 PolarHBondContact O-N 3.49Å
39	H	96.3	Very high	94.9	Very high	58 Å²	58	41.6 Å²	41.6	27%	0.269	23%	0.228	S	C	.	.	H	α-helix	trans	-66.5	-43.4	176.2	-65.5	163.4	0	0	0	111.6	V35 S36 L42 S43 W94	V35-H39 PolarHBondContact O-N 3.3Å; V35-H39 VanDerWaalsContact O-N 3.14Å; S36-H39 PolarHBondContact O-N 2.6Å; H39-L42 PolarHBondContact O-N 3.34Å; H39-S43 WeakPolarHBondContact O-CB 3.29Å; H39-S43 PolarHBondContact O-N 2.79Å; H39-S43 PolarHBondContact O-OG 3.03Å; H39-W94 HydrophobicContact CB-CZ2 4.33Å; H39-W94 AromaticContact CD2-CH2 3.95Å; H39-W94 AromaticContact CD2-CZ2 3.63Å
40	L	96.2	Very high	94.7	Very high	65 Å²	65	46.3 Å²	46.3	34%	0.34	26%	0.256	S	S	.	.	H	α-helix	trans	-63.8	-42.1	177.5	-70.1	169.8	0	0	0	111.7	S36 A37 K44 I115 I117 V124	S36-L40 WeakPolarHBondContact O-CG 3.49Å; S36-L40 PolarHBondContact O-N 3.48Å; A37-L40 PolarHBondContact O-N 2.7Å; L40-K44 WeakPolarHBondContact O-CB 3.22Å; L40-K44 PolarHBondContact O-N 2.72Å; L40-I115 HydrophobicContact CB-CD1 3.81Å; L40-I117 HydrophobicContact CD1-CD1 4.02Å; L40-V124 HydrophobicContact CB-CG1 4.31Å; L40-V124 HydrophobicContact CD1-CG1 4.17Å; L40-V124 HydrophobicContact CD1-CG2 4.32Å
41	A	96.8	Very high	94.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.5	-50.6	175.5	0	0	0	0	0	110.9	A37 S38 S43 K44 I45 L77 L79 A113 I115 L126	A37-A41 VanDerWaalsContact O-CB 3.28Å; A37-A41 WeakPolarHBondContact O-CB 3.43Å; A37-A41 PolarHBondContact O-N 3.28Å; S38-A41 PolarHBondContact O-N 3.14Å; A41-S43 PolarHBondContact O-N 3.14Å; A41-K44 PolarHBondContact O-N 2.91Å; A41-I45 VanDerWaalsContact O-CG1 3.26Å; A41-I45 WeakPolarHBondContact O-CG1 3.22Å; A41-I45 PolarHBondContact O-N 3.41Å; A41-L77 HydrophobicContact CB-CD1 4.11Å; A41-L79 HydrophobicContact CB-CD1 4.39Å; A41-A113 HydrophobicContact CB-CB 4.12Å; A41-I115 HydrophobicContact CB-CB 4.33Å; A41-I115 HydrophobicContact CB-CD1 4Å; A41-I115 HydrophobicContact CB-CG2 4.17Å; A41-L126 HydrophobicContact CB-CD1 4.48Å
42	L	97.3	Very high	94.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.8	-43.3	179.1	-175.2	63.2	0	0	0	112.4	S38 H39 K44 I45 N46 F55 L57 L79 V81 W94	S38-L42 WeakPolarHBondContact O-CB 3.42Å; S38-L42 PolarHBondContact O-N 3.49Å; H39-L42 PolarHBondContact O-N 3.34Å; L42-K44 VanDerWaalsContact C-N 3.35Å; L42-K44 PolarHBondContact O-N 2.8Å; L42-I45 PolarHBondContact O-N 3.18Å; L42-N46 PolarHBondContact O-N 3.43Å; L42-N46 PolarHBondContact O-ND2 2.95Å; L42-F55 HydrophobicContact CD1-CB 3.88Å; L42-L57 HydrophobicContact CD2-CB 3.61Å; L42-L57 VanDerWaalsContact CD2-N 3.26Å; L42-L79 HydrophobicContact CB-CD1 4.29Å; L42-V81 HydrophobicContact CD1-CG1 3.93Å; L42-W94 HydrophobicContact CD2-CD2 3.99Å; L42-W94 HydrophobicContact CD2-CE3 4.43Å; L42-W94 HydrophobicContact CD2-CG 4.19Å; L42-W94 HydrophobicContact CD2-CZ2 4.5Å
43	S	95.8	Very high	94.6	Very high	29 Å²	29	34.9 Å²	34.9	20%	0.203	20%	0.197	C	C	.	.	H	α-helix	trans	-60.2	-44.6	175.5	-68.2	0	0	0	0	111.3	H39 A41 N46 L47 W94	H39-S43 WeakPolarHBondContact O-CB 3.29Å; H39-S43 PolarHBondContact O-N 2.79Å; H39-S43 PolarHBondContact O-OG 3.03Å; A41-S43 PolarHBondContact O-N 3.14Å; S43-N46 PolarHBondContact O-N 2.86Å; S43-L47 VanDerWaalsContact O-CG 3.29Å; S43-L47 WeakPolarHBondContact O-CG 3.49Å; S43-L47 PolarHBondContact O-N 3.06Å; S43-W94 PolarHBondContact OG-NE1 3.37Å
44	K	95.1	Very high	94.7	Very high	76 Å²	76	33.6 Å²	33.6	33%	0.33	19%	0.188	S	C	.	.	H	α-helix	trans	-66.3	-38.4	176.5	-77.3	-176.5	171.8	-76.8	0	113	L40 A41 L42 N46 L47 D48 V124 L126	L40-K44 WeakPolarHBondContact O-CB 3.22Å; L40-K44 PolarHBondContact O-N 2.72Å; A41-K44 PolarHBondContact O-N 2.91Å; L42-K44 VanDerWaalsContact C-N 3.35Å; L42-K44 PolarHBondContact O-N 2.8Å; K44-N46 VanDerWaalsContact C-N 3.35Å; K44-N46 PolarHBondContact O-N 3.24Å; K44-L47 PolarHBondContact O-N 2.91Å; K44-D48 WeakPolarHBondContact O-CB 3.34Å; K44-D48 PolarHBondContact O-N 3.42Å; K44-V124 HydrophobicContact CD-CG1 4.41Å; K44-V124 WeakPolarHBondContact CE-O 3.45Å; K44-V124 PolarHBondContact NZ-O 2.99Å; K44-L126 HydrophobicContact CB-CB 3.96Å; K44-L126 HydrophobicContact CB-CD2 3.75Å; K44-L126 HydrophobicContact CB-CG 4.46Å; K44-L126 HydrophobicContact CD-CB 3.75Å
45	I	95.9	Very high	94.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-46.6	173.8	-69.1	166.2	0	0	0	110.3	A41 L42 L47 D48 R49 L79 C111 A113 L126 Y129	A41-I45 VanDerWaalsContact O-CG1 3.26Å; A41-I45 WeakPolarHBondContact O-CG1 3.22Å; A41-I45 PolarHBondContact O-N 3.41Å; L42-I45 PolarHBondContact O-N 3.18Å; I45-L47 VanDerWaalsContact C-N 3.31Å; I45-L47 PolarHBondContact O-N 3.41Å; I45-D48 PolarHBondContact O-N 3.32Å; I45-R49 WeakPolarHBondContact O-CD 3.41Å; I45-R49 VanDerWaalsContact O-CG 3.22Å; I45-R49 WeakPolarHBondContact O-CG 3.2Å; I45-R49 PolarHBondContact O-N 3.12Å; I45-L79 HydrophobicContact CD1-CD1 4.33Å; I45-C111 HydrophobicContact CD1-CB 4.42Å; I45-A113 HydrophobicContact CD1-CB 4.07Å; I45-L126 HydrophobicContact CG1-CD2 3.7Å; I45-Y129 HydrophobicContact CD1-CD2 4.4Å; I45-Y129 HydrophobicContact CD1-CG 4.15Å; I45-Y129 HydrophobicContact CG1-CD1 3.93Å; I45-Y129 HydrophobicContact CG1-CD2 4.06Å; I45-Y129 HydrophobicContact CG1-CE1 4.44Å; I45-Y129 HydrophobicContact CG1-CG 3.7Å; I45-Y129 HydrophobicContact CG2-CD2 3.99Å; I45-Y129 HydrophobicContact CG2-CE2 3.89Å; I45-Y129 HydrophobicContact CG2-CG 4.45Å
46	N	96.3	Very high	95	Very high	9 Å²	9	32.1 Å²	32.1	5%	0.048	18%	0.18	C	C	.	.	H	α-helix	trans	-67.4	-30.5	179.3	-74	-40.1	0	0	0	113.1	L42 S43 K44 V54 F55	L42-N46 PolarHBondContact O-N 3.43Å; L42-N46 PolarHBondContact O-ND2 2.95Å; S43-N46 PolarHBondContact O-N 2.86Å; K44-N46 VanDerWaalsContact C-N 3.35Å; K44-N46 PolarHBondContact O-N 3.24Å; N46-V54 HydrophobicContact CB-CG1 4.36Å; N46-F55 PolarHBondContact ND2-O 3.15Å; N46-F55 PolarHBondContact OD1-N 2.94Å
47	L	92.6	Very high	95	Very high	88 Å²	88	30.6 Å²	30.6	46%	0.461	17%	0.167	S	C	.	.	H	α-helix	trans	-76.2	-30.5	174.6	-72.4	171.2	0	0	0	113	S43 K44 I45 R91	S43-L47 VanDerWaalsContact O-CG 3.29Å; S43-L47 WeakPolarHBondContact O-CG 3.49Å; S43-L47 PolarHBondContact O-N 3.06Å; K44-L47 PolarHBondContact O-N 2.91Å; I45-L47 VanDerWaalsContact C-N 3.31Å; I45-L47 PolarHBondContact O-N 3.41Å; L47-R91 PolarHBondContact O-NH1 3.06Å
48	D	92.7	Very high	94.8	Very high	46 Å²	46	33.5 Å²	33.5	25%	0.246	18%	0.18	C	C	.	.	H	α-helix	trans	-72.2	-35.3	176.9	-178	70.3	0	0	0	111.9	K44 I45 Y129 P496	K44-D48 WeakPolarHBondContact O-CB 3.34Å; K44-D48 PolarHBondContact O-N 3.42Å; I45-D48 PolarHBondContact O-N 3.32Å; D48-Y129 HydrophobicContact CB-CE1 4.17Å; D48-Y129 WeakPolarHBondContact OD2-CE1 3.02Å; D48-Y129 VanDerWaalsContact OD2-CZ 3.27Å; D48-Y129 PolarHBondContact OD2-OH 2.8Å; D48-P496 HydrophobicContact CB-CG 3.97Å; D48-P496 VanDerWaalsContact CG-CG 3.45Å; D48-P496 VanDerWaalsContact OD1-CD 3.31Å; D48-P496 WeakPolarHBondContact OD1-CD 3.42Å; D48-P496 WeakPolarHBondContact OD1-CG 3.46Å
49	R	91.3	Very high	94.5	Very high	16 Å²	16	35.8 Å²	35.8	6%	0.06	19%	0.191	C	C	.	.			trans	-70.5	134.6	-176.1	-70	170	65.7	-145.6	-11.7	112.8	I45 D51 Y53 V88 R91 I500	I45-R49 WeakPolarHBondContact O-CD 3.41Å; I45-R49 VanDerWaalsContact O-CG 3.22Å; I45-R49 WeakPolarHBondContact O-CG 3.2Å; I45-R49 PolarHBondContact O-N 3.12Å; R49-D51 PolarHBondContact NH2-O 3.36Å; R49-Y53 PolarHBondContact NH1-O 2.76Å; R49-Y53 PolarHBondContact NH2-O 2.8Å; R49-Y53 VanDerWaalsContact NH2-O 3.07Å; R49-V88 HydrophobicContact CB-CB 4.44Å; R49-V88 HydrophobicContact CB-CG1 4.15Å; R49-V88 HydrophobicContact CB-CG2 4.49Å; R49-V88 WeakPolarHBondContact O-CG2 3.3Å; R49-R91 PolarHBondContact O-NH1 3.05Å; R49-I500 HydrophobicContact CG-CD1 4.44Å; R49-I500 HydrophobicContact CG-CG1 4.31Å
50	V	87.8	Confident	94.4	Very high	117 Å²	117	34.2 Å²	34.2	71%	0.709	18%	0.184	S	C	*	.			trans	-103.8	-7.3	175.9	-61.1	0	0	0	0	114
51	D	89.4	Confident	94.2	Very high	67 Å²	67	31.5 Å²	31.5	36%	0.358	17%	0.17	S	C	.	.	S	Bend	trans	-139	149.1	-177	-175.1	49.7	0	0	0	113.9	R49 V88 K184 L186	R49-D51 PolarHBondContact NH2-O 3.36Å; D51-V88 VanDerWaalsContact N-CG2 3.33Å; D51-K184 IonicContact OD1-NZ 3.41Å; D51-K184 IonicContact OD2-NZ 2.65Å; D51-K184 PolarHBondContact OD2-NZ 3.31Å; D51-L186 WeakPolarHBondContact OD1-CD2 3.43Å
52	G	93.5	Very high	94	Very high	14 Å²	14	32.1 Å²	32.1	14%	0.144	17%	0.174	C	C	.	.	S	Bend	trans	84.9	-152.8	-178.6	0	0	0	0	0	114	V88	G52-V88 WeakPolarHBondContact O-CG2 3.45Å; G52-V88 PolarHBondContact O-N 2.9Å
53	Y	96.7	Very high	94	Very high	6 Å²	6	32.2 Å²	32.2	2%	0.024	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	152.6	-174.1	-61.9	-88.6	0	0	0	112.4	R49 F55 E83 C86 V88 L186 R187 E201 F233	R49-Y53 PolarHBondContact NH1-O 2.76Å; R49-Y53 PolarHBondContact NH2-O 2.8Å; R49-Y53 VanDerWaalsContact NH2-O 3.07Å; Y53-F55 PolarHBondContact O-N 2.84Å; Y53-E83 HydrophobicContact CD2-CG 3.92Å; Y53-E83 WeakPolarHBondContact CD2-OE1 3.49Å; Y53-E83 WeakPolarHBondContact CD2-OE2 3.14Å; Y53-E83 HydrophobicContact CG-CG 3.83Å; Y53-C86 CarbonylContact C-O 3.47Å; Y53-C86 VanDerWaalsContact CA-O 3.23Å; Y53-C86 WeakPolarHBondContact CA-O 3.28Å; Y53-C86 WeakPolarHBondContact CB-O 3.43Å; Y53-C86 WeakPolarHBondContact CD1-O 3.14Å; Y53-V88 VanDerWaalsContact C-CG1 3.42Å; Y53-V88 WeakPolarHBondContact O-CG1 3.47Å; Y53-L186 HydrophobicContact CE2-CB 3.83Å; Y53-L186 HydrophobicContact CE2-CD1 4.33Å; Y53-L186 WeakPolarHBondContact OH-CB 3.4Å; Y53-R187 HydrophobicContact CE2-CB 4.45Å; Y53-R187 WeakPolarHBondContact OH-CB 3.36Å; Y53-E201 WeakPolarHBondContact CE1-OE2 3.14Å; Y53-E201 WeakPolarHBondContact OH-CB 2.99Å; Y53-E201 PolarHBondContact OH-OE2 2.88Å; Y53-F233 AromaticContact CE1-CE2 3.99Å; Y53-F233 HydrophobicContact CE1-CE2 3.99Å; Y53-F233 AromaticContact CE1-CZ 3.65Å; Y53-F233 HydrophobicContact CE1-CZ 3.65Å
54	V	97.3	Very high	93.9	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.012	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	133.2	173	176.7	0	0	0	0	108.9	N46 T84 C86 V88 W94	N46-V54 HydrophobicContact CB-CG1 4.36Å; V54-T84 WeakPolarHBondContact O-CB 3.46Å; V54-T84 VanDerWaalsContact O-CG2 3.31Å; V54-T84 WeakPolarHBondContact O-CG2 3.48Å; V54-T84 PolarHBondContact O-N 3.45Å; V54-T84 PolarHBondContact O-OG1 3.44Å; V54-C86 HydrophobicContact CB-CB 4.06Å; V54-C86 HydrophobicContact CG2-CB 3.91Å; V54-C86 PolarHBondContact N-O 2.83Å; V54-V88 HydrophobicContact CG2-CG1 4.33Å; V54-W94 HydrophobicContact CG1-CB 3.58Å
55	F	97.7	Very high	93.9	Very high	1 Å²	1	29.5 Å²	29.5	0%	0.004	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	140	173.1	-65.4	-33.4	0	0	0	111.2	L42 N46 Y53 V81 V82 W94 C131 I133 I500	L42-F55 HydrophobicContact CD1-CB 3.88Å; N46-F55 PolarHBondContact ND2-O 3.15Å; N46-F55 PolarHBondContact OD1-N 2.94Å; Y53-F55 PolarHBondContact O-N 2.84Å; F55-V81 HydrophobicContact CB-CB 4.13Å; F55-V81 HydrophobicContact CB-CG1 4.4Å; F55-V81 HydrophobicContact CD2-CG2 4.3Å; F55-V81 HydrophobicContact CG-CB 4.3Å; F55-V81 HydrophobicContact CG-CG2 4.31Å; F55-V82 WeakPolarHBondContact CA-O 3.46Å; F55-W94 WeakPolarHBondContact O-CB 3.37Å; F55-C131 HydrophobicContact CE2-CB 4.44Å; F55-I133 HydrophobicContact CE1-CD1 4.27Å; F55-I133 HydrophobicContact CE1-CG2 4.15Å; F55-I133 HydrophobicContact CE2-CG2 4.43Å; F55-I133 HydrophobicContact CZ-CD1 4.04Å; F55-I133 HydrophobicContact CZ-CG2 3.75Å; F55-I500 HydrophobicContact CE2-CD1 4.2Å
56	S	96.9	Very high	93.8	Very high	20 Å²	20	30.7 Å²	30.7	14%	0.14	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	149.2	166.4	-176	0	0	0	0	110	H58 V81 V82	S56-H58 PolarHBondContact O-N 2.89Å; S56-V81 WeakPolarHBondContact O-CA 3.28Å; S56-V82 PolarHBondContact N-O 2.82Å; S56-V82 PolarHBondContact O-N 3.3Å
57	L	95.8	Very high	93.6	Very high	29 Å²	29	38.5 Å²	38.5	15%	0.152	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	118.5	178.3	-172	62.5	0	0	0	109.1	L42 L79 W94	L42-L57 HydrophobicContact CD2-CB 3.61Å; L42-L57 VanDerWaalsContact CD2-N 3.26Å; L57-L79 HydrophobicContact CD1-CB 3.88Å; L57-L79 HydrophobicContact CD1-CD2 3.98Å; L57-L79 HydrophobicContact CD1-CG 4.41Å; L57-W94 HydrophobicContact CB-CH2 4.09Å; L57-W94 HydrophobicContact CB-CZ3 4.22Å
58	H	92.7	Very high	93.4	Very high	60 Å²	60	35.9 Å²	35.9	28%	0.278	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-53.2	170.4	-177	53.7	0	0	0	110.4	S56 D80 V82 N567 F570	S56-H58 PolarHBondContact O-N 2.89Å; H58-D80 WeakPolarHBondContact CA-O 3.27Å; H58-D80 HydrophobicContact CB-CB 4.2Å; H58-D80 VanDerWaalsContact CB-O 3.28Å; H58-D80 WeakPolarHBondContact CB-O 3.45Å; H58-D80 PolarHBondContact N-O 3.4Å; H58-V82 HydrophobicContact CB-CG1 4.2Å; H58-N567 PolarHBondContact CE1-OD1 3.47Å; H58-N567 PolarHBondContact NE2-OD1 3.32Å; H58-N567 VanDerWaalsContact NE2-OD1 3.13Å; H58-F570 AromaticContact CD2-CD2 3.85Å; H58-F570 AromaticContact CD2-CE2 3.7Å
59	Q	91.3	Very high	93	Very high	49 Å²	49	35.7 Å²	35.7	23%	0.229	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	162.6	175	59.5	177.6	18.9	0	0	111.6	S61 D80	Q59-S61 PolarHBondContact NE2-OG 3.32Å; Q59-D80 HydrophobicContact CG-CB 3.71Å; Q59-D80 WeakPolarHBondContact CG-OD2 3.33Å; Q59-D80 PolarHBondContact N-O 3.08Å; Q59-D80 PolarHBondContact NE2-OD2 2.67Å; Q59-D80 PolarHBondContact O-N 3.26Å
60	L	93.7	Very high	92.4	Very high	24 Å²	24	43.7 Å²	43.7	13%	0.126	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	112.3	170.3	-179.3	57.5	0	0	0	108.8	C29 A34 V35 V63 L77 L79	C29-L60 HydrophobicContact CB-CD2 4.45Å; C29-L60 HydrophobicContact CB-CG 4.29Å; C29-L60 PolarHBondContact SG-O 3.45Å; A34-L60 HydrophobicContact CB-CD2 4.39Å; V35-L60 HydrophobicContact CG2-CD2 4.45Å; L60-V63 HydrophobicContact CD1-CG2 3.84Å; L60-V63 HydrophobicContact CD2-CG2 3.51Å; L60-V63 HydrophobicContact CG-CG2 3.68Å; L60-L77 HydrophobicContact CD1-CB 4.35Å; L60-L77 HydrophobicContact CD1-CD2 4.17Å; L60-L79 HydrophobicContact CD1-CD2 3.65Å
61	S	91.6	Very high	92.3	Very high	8 Å²	8	42 Å²	42	6%	0.056	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-23.3	-166.1	-59.3	0	0	0	0	113.9	Q59 T78 D80 R552	Q59-S61 PolarHBondContact NE2-OG 3.32Å; S61-T78 PolarHBondContact N-O 3.24Å; S61-D80 PolarHBondContact OG-OD1 3.06Å; S61-D80 PolarHBondContact OG-OD2 3.37Å; S61-R552 PolarHBondContact O-NE 3.38Å; S61-R552 PolarHBondContact O-NH2 2.91Å
62	N	93.6	Very high	92.4	Very high	14 Å²	14	38.9 Å²	38.9	8%	0.075	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	143.2	175.9	-160.2	12.5	0	0	0	110.5	H64 T78 S551 R552 S553	N62-H64 PolarHBondContact OD1-CE1 2.61Å; N62-H64 VanDerWaalsContact OD1-CE1 3.26Å; N62-T78 PolarHBondContact N-O 3Å; N62-T78 PolarHBondContact O-N 3.46Å; N62-S551 PolarHBondContact ND2-O 3.29Å; N62-R552 HydrophobicContact CB-CG 4.47Å; N62-R552 WeakPolarHBondContact OD1-CA 3.35Å; N62-S553 PolarHBondContact OD1-N 2.81Å
63	V	95.7	Very high	92.4	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	127.9	176.2	178.4	0	0	0	0	108.6	G27 A34 L60 L77 S553	G27-V63 PolarHBondContact N-O 3.47Å; A34-V63 HydrophobicContact CB-CG1 3.91Å; A34-V63 HydrophobicContact CB-CG2 4.08Å; L60-V63 HydrophobicContact CD1-CG2 3.84Å; L60-V63 HydrophobicContact CD2-CG2 3.51Å; L60-V63 HydrophobicContact CG-CG2 3.68Å; V63-L77 HydrophobicContact CB-CD2 4.41Å; V63-L77 HydrophobicContact CG1-CD2 4.09Å; V63-L77 HydrophobicContact CG2-CD2 3.94Å; V63-S553 WeakPolarHBondContact O-CB 3.46Å
64	H	95.1	Very high	92.4	Very high	7 Å²	7	39.4 Å²	39.4	3%	0.032	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	158.2	159.2	-62	65.1	0	0	0	109.6	I24 Q25 N62 Y75 Y76 P549 S551	I24-H64 HydrophobicContact CG2-CB 3.31Å; Q25-H64 CarbonylContact O-C 3.59Å; Q25-H64 WeakPolarHBondContact O-CA 3.4Å; Q25-H64 WeakPolarHBondContact O-CB 3.34Å; N62-H64 PolarHBondContact OD1-CE1 2.61Å; N62-H64 VanDerWaalsContact OD1-CE1 3.26Å; H64-Y75 WeakPolarHBondContact O-CA 3.3Å; H64-Y76 PolarHBondContact N-O 3.37Å; H64-Y76 PolarHBondContact O-N 3.42Å; H64-P549 HydrophobicContact CB-CG 3.91Å; H64-S551 PolarHBondContact CE1-O 2.71Å; H64-S551 PolarHBondContact NE2-OG 3.31Å
65	L	94.8	Very high	92.3	Very high	42 Å²	42	40.2 Å²	40.2	22%	0.22	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	144.6	-177.2	57.9	94.9	0	0	0	110.8	Q25 V73 V74	Q25-L65 HydrophobicContact CB-CD1 4.34Å; Q25-L65 PolarHBondContact N-O 2.74Å; Q25-L65 PolarHBondContact O-N 3.24Å; L65-V73 HydrophobicContact CB-CG1 3.96Å; L65-V74 CarbonylContact C-O 3.52Å; L65-V74 VanDerWaalsContact CA-O 3.28Å; L65-V74 WeakPolarHBondContact CA-O 3.37Å
66	D	93.3	Very high	92.3	Very high	25 Å²	25	40.3 Å²	40.3	13%	0.134	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	128.6	172.6	-169.3	19.6	0	0	0	108.4	G23 I24 V73 V74 Y76	G23-D66 PolarHBondContact N-OD1 3.36Å; I24-D66 HydrophobicContact CG1-CB 4.4Å; D66-V73 WeakPolarHBondContact O-CA 3.47Å; D66-V74 HydrophobicContact CB-CB 4.45Å; D66-V74 PolarHBondContact N-O 2.03Å; D66-V74 PolarHBondContact O-N 2.96Å; D66-Y76 HydrophobicContact CB-CE2 3.91Å
67	R	92.4	Very high	92.3	Very high	173 Å²	173	39.4 Å²	39.4	65%	0.653	20%	0.197	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	135.8	-177.6	-69	-175.7	179.7	172.1	1	108.6
68	H	88.6	Confident	92.3	Very high	33 Å²	33	38.7 Å²	38.7	15%	0.153	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	110.5	-179.6	-177.8	66.3	0	0	0	110.3	G72 Y116 T541 P543	H68-G72 PolarHBondContact N-O 3.19Å; H68-G72 CarbonylContact O-C 3.53Å; H68-G72 WeakPolarHBondContact O-CA 3.47Å; H68-G72 PolarHBondContact O-N 3.44Å; H68-Y116 HydrophobicContact CB-CE2 4.17Å; H68-Y116 AromaticContact CD2-CE2 3.82Å; H68-T541 PolarHBondContact CE1-O 3.38Å; H68-T541 PolarHBondContact NE2-O 2.86Å; H68-P543 HydrophobicContact CB-CB 4.15Å; H68-P543 VanDerWaalsContact CE1-CA 3.47Å; H68-P543 WeakPolarHBondContact CE1-CA 3.43Å
69	G	83.3	Confident	92.4	Very high	42 Å²	42	35.8 Å²	35.8	43%	0.433	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	-158.1	-171.7	0	0	0	0	0	112.2
70	E	79.5	Confident	92.6	Very high	184 Å²	184	33.6 Å²	33.6	86%	0.86	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-27.9	-174.8	-65.2	-174.9	162.1	0	0	113.7
71	N	85.7	Confident	92.7	Very high	81 Å²	81	32.5 Å²	32.5	43%	0.433	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-135.2	-4.6	-166.2	-66.7	-53.7	0	0	0	114.9	P120	N71-P120 HydrophobicContact CB-CG 3.8Å
72	G	90.8	Very high	92.9	Very high	2 Å²	2	32.9 Å²	32.9	2%	0.021	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	144.9	-179.9	0	0	0	0	0	111.7	H68	H68-G72 PolarHBondContact N-O 3.19Å; H68-G72 CarbonylContact O-C 3.53Å; H68-G72 WeakPolarHBondContact O-CA 3.47Å; H68-G72 PolarHBondContact O-N 3.44Å
73	V	94.4	Very high	93.1	Very high	31 Å²	31	33 Å²	33	19%	0.188	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	130.3	174.1	-175.4	0	0	0	0	109.2	L65 D66 Y75 Y116 I117	L65-V73 HydrophobicContact CB-CG1 3.96Å; D66-V73 WeakPolarHBondContact O-CA 3.47Å; V73-Y75 HydrophobicContact CB-CD2 4.43Å; V73-Y75 HydrophobicContact CB-CE2 3.81Å; V73-Y75 HydrophobicContact CG1-CD2 4.04Å; V73-Y75 HydrophobicContact CG1-CE1 4.33Å; V73-Y75 HydrophobicContact CG1-CE2 3.65Å; V73-Y116 WeakPolarHBondContact O-CA 3.44Å; V73-I117 PolarHBondContact N-O 3.48Å; V73-I117 PolarHBondContact O-N 3.48Å
74	V	95.4	Very high	93.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	122.7	166.6	-175.9	0	0	0	0	108.2	L65 D66 Y76 I115 Y116 P543 I545	L65-V74 CarbonylContact C-O 3.52Å; L65-V74 VanDerWaalsContact CA-O 3.28Å; L65-V74 WeakPolarHBondContact CA-O 3.37Å; D66-V74 HydrophobicContact CB-CB 4.45Å; D66-V74 PolarHBondContact N-O 2.03Å; D66-V74 PolarHBondContact O-N 2.96Å; V74-Y76 HydrophobicContact CB-CE2 4.26Å; V74-Y76 HydrophobicContact CG1-CD2 4.35Å; V74-Y76 HydrophobicContact CG1-CE1 4.4Å; V74-Y76 HydrophobicContact CG1-CE2 3.75Å; V74-I115 CarbonylContact C-O 3.51Å; V74-I115 WeakPolarHBondContact CA-O 3.4Å; V74-Y116 HydrophobicContact CG2-CD2 3.97Å; V74-P543 HydrophobicContact CG2-CB 3.5Å; V74-P543 VanDerWaalsContact CG2-CB 3.5Å; V74-P543 HydrophobicContact CG2-CG 3.8Å; V74-I545 HydrophobicContact CG1-CD1 3.99Å; V74-I545 HydrophobicContact CG2-CD1 4.35Å
75	Y	96.4	Very high	93	Very high	19 Å²	19	34.6 Å²	34.6	8%	0.075	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	126.9	173.5	-64	-97.9	0	0	0	109.6	S33 A34 A37 H64 V73 L77 A114 I115 I117	S33-Y75 WeakPolarHBondContact CB-OH 3.36Å; A34-Y75 HydrophobicContact CB-CE1 4.39Å; A37-Y75 HydrophobicContact CB-CD1 4.02Å; A37-Y75 HydrophobicContact CB-CD2 3.82Å; A37-Y75 HydrophobicContact CB-CE1 4.3Å; A37-Y75 HydrophobicContact CB-CE2 4.13Å; A37-Y75 HydrophobicContact CB-CG 3.77Å; H64-Y75 WeakPolarHBondContact O-CA 3.3Å; V73-Y75 HydrophobicContact CB-CD2 4.43Å; V73-Y75 HydrophobicContact CB-CE2 3.81Å; V73-Y75 HydrophobicContact CG1-CD2 4.04Å; V73-Y75 HydrophobicContact CG1-CE1 4.33Å; V73-Y75 HydrophobicContact CG1-CE2 3.65Å; Y75-L77 HydrophobicContact CD1-CD2 4.42Å; Y75-A114 WeakPolarHBondContact O-CA 3.38Å; Y75-I115 PolarHBondContact N-O 3.17Å; Y75-I115 PolarHBondContact O-N 2.99Å; Y75-I117 HydrophobicContact CD2-CD1 4.12Å; Y75-I117 HydrophobicContact CD2-CG1 4.36Å; Y75-I117 HydrophobicContact CE2-CB 4.25Å; Y75-I117 HydrophobicContact CE2-CD1 3.98Å; Y75-I117 HydrophobicContact CE2-CG1 4.31Å
76	Y	96.4	Very high	93	Very high	3 Å²	3	33 Å²	33	1%	0.012	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	103.3	168.2	-59.6	-90.5	0	0	0	108	I24 H64 D66 V74 A113 A114 I545 L546 F548	I24-Y76 HydrophobicContact CD1-CD2 4.2Å; I24-Y76 HydrophobicContact CD1-CE2 3.93Å; I24-Y76 HydrophobicContact CG1-CD2 4.31Å; I24-Y76 HydrophobicContact CG1-CE2 3.91Å; I24-Y76 HydrophobicContact CG2-CD2 4.17Å; H64-Y76 PolarHBondContact N-O 3.37Å; H64-Y76 PolarHBondContact O-N 3.42Å; D66-Y76 HydrophobicContact CB-CE2 3.91Å; V74-Y76 HydrophobicContact CB-CE2 4.26Å; V74-Y76 HydrophobicContact CG1-CD2 4.35Å; V74-Y76 HydrophobicContact CG1-CE1 4.4Å; V74-Y76 HydrophobicContact CG1-CE2 3.75Å; Y76-A113 WeakPolarHBondContact CA-O 3.46Å; Y76-A114 HydrophobicContact CD1-CB 4.15Å; Y76-A114 HydrophobicContact CE1-CB 4.16Å; Y76-I545 HydrophobicContact CE1-CG2 4.33Å; Y76-L546 HydrophobicContact CE1-CB 4.46Å; Y76-L546 VanDerWaalsContact CE1-O 3.3Å; Y76-L546 WeakPolarHBondContact CE1-O 3.31Å; Y76-L546 WeakPolarHBondContact OH-CB 3.44Å; Y76-L546 PolarHBondContact OH-N 2.86Å; Y76-F548 HydrophobicContact CD1-CD1 4.02Å; Y76-F548 HydrophobicContact CD1-CE1 4.34Å
77	L	96.7	Very high	93.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	145.5	-170.5	-55.6	176.1	0	0	0	110.2	A37 A41 L60 V63 Y75 L79 K112 A113 I115	A37-L77 HydrophobicContact CB-CD1 4.1Å; A41-L77 HydrophobicContact CB-CD1 4.11Å; L60-L77 HydrophobicContact CD1-CB 4.35Å; L60-L77 HydrophobicContact CD1-CD2 4.17Å; V63-L77 HydrophobicContact CB-CD2 4.41Å; V63-L77 HydrophobicContact CG1-CD2 4.09Å; V63-L77 HydrophobicContact CG2-CD2 3.94Å; Y75-L77 HydrophobicContact CD1-CD2 4.42Å; L77-L79 HydrophobicContact CB-CD2 4.06Å; L77-L79 HydrophobicContact CB-CG 4.42Å; L77-K112 CarbonylContact O-C 3.52Å; L77-K112 VanDerWaalsContact O-CA 3.27Å; L77-K112 WeakPolarHBondContact O-CA 3.48Å; L77-A113 PolarHBondContact N-O 3.38Å; L77-A113 PolarHBondContact O-N 3.25Å; L77-I115 HydrophobicContact CD1-CG2 3.9Å
78	T	95.8	Very high	93.2	Very high	14 Å²	14	23.7 Å²	23.7	9%	0.086	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	112.4	164.7	-55.8	0	0	0	0	108	S61 N62 Q110 C111	S61-T78 PolarHBondContact N-O 3.24Å; N62-T78 PolarHBondContact N-O 3Å; N62-T78 PolarHBondContact O-N 3.46Å; T78-Q110 HydrophobicContact CG2-CG 3.33Å; T78-Q110 VanDerWaalsContact CG2-OE1 3.29Å; T78-C111 CarbonylContact C-O 3.5Å; T78-C111 WeakPolarHBondContact CA-O 3.46Å
79	L	95.8	Very high	93.4	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	119.7	-175.2	-49	176.5	0	0	0	108.2	A41 L42 I45 L57 L60 L77 V81 Q110 C111	A41-L79 HydrophobicContact CB-CD1 4.39Å; L42-L79 HydrophobicContact CB-CD1 4.29Å; I45-L79 HydrophobicContact CD1-CD1 4.33Å; L57-L79 HydrophobicContact CD1-CB 3.88Å; L57-L79 HydrophobicContact CD1-CD2 3.98Å; L57-L79 HydrophobicContact CD1-CG 4.41Å; L60-L79 HydrophobicContact CD1-CD2 3.65Å; L77-L79 HydrophobicContact CB-CD2 4.06Å; L77-L79 HydrophobicContact CB-CG 4.42Å; L79-V81 HydrophobicContact CB-CG1 4.06Å; L79-Q110 CarbonylContact O-C 3.59Å; L79-Q110 VanDerWaalsContact O-CA 3.3Å; L79-Q110 WeakPolarHBondContact O-CA 3.37Å; L79-C111 HydrophobicContact CB-CB 4.28Å; L79-C111 PolarHBondContact N-O 2.96Å; L79-C111 PolarHBondContact O-N 3.13Å
80	D	95.3	Very high	93.8	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.016	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	128.1	163.8	-68.7	-13	0	0	0	107.5	H58 Q59 S61 G109 Q110 F570	H58-D80 WeakPolarHBondContact CA-O 3.27Å; H58-D80 HydrophobicContact CB-CB 4.2Å; H58-D80 VanDerWaalsContact CB-O 3.28Å; H58-D80 WeakPolarHBondContact CB-O 3.45Å; H58-D80 PolarHBondContact N-O 3.4Å; Q59-D80 HydrophobicContact CG-CB 3.71Å; Q59-D80 WeakPolarHBondContact CG-OD2 3.33Å; Q59-D80 PolarHBondContact N-O 3.08Å; Q59-D80 PolarHBondContact NE2-OD2 2.67Å; Q59-D80 PolarHBondContact O-N 3.26Å; S61-D80 PolarHBondContact OG-OD1 3.06Å; S61-D80 PolarHBondContact OG-OD2 3.37Å; D80-G109 WeakPolarHBondContact CA-O 3.46Å; D80-Q110 WeakPolarHBondContact OD1-CG 3.44Å; D80-Q110 PolarHBondContact OD1-NE2 2.77Å; D80-F570 HydrophobicContact CB-CD1 4.28Å; D80-F570 HydrophobicContact CB-CE1 3.69Å; D80-F570 HydrophobicContact CB-CE2 4.35Å; D80-F570 HydrophobicContact CB-CZ 3.73Å
81	V	96.4	Very high	94.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	151.9	-171.3	-65.1	0	0	0	0	111.1	L42 F55 S56 L79 Y108 G109 C111	L42-V81 HydrophobicContact CD1-CG1 3.93Å; F55-V81 HydrophobicContact CB-CB 4.13Å; F55-V81 HydrophobicContact CB-CG1 4.4Å; F55-V81 HydrophobicContact CD2-CG2 4.3Å; F55-V81 HydrophobicContact CG-CB 4.3Å; F55-V81 HydrophobicContact CG-CG2 4.31Å; S56-V81 WeakPolarHBondContact O-CA 3.28Å; L79-V81 HydrophobicContact CB-CG1 4.06Å; V81-Y108 WeakPolarHBondContact O-CA 3.32Å; V81-G109 WeakPolarHBondContact CG2-O 3.48Å; V81-G109 PolarHBondContact N-O 3.43Å; V81-G109 PolarHBondContact O-N 3.24Å; V81-C111 HydrophobicContact CG1-CB 4.44Å
82	V	96.5	Very high	94.5	Very high	16 Å²	16	19.1 Å²	19.1	10%	0.097	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	144.2	172.1	-69	0	0	0	0	110.5	F55 S56 H58 A99 V566	F55-V82 WeakPolarHBondContact CA-O 3.46Å; S56-V82 PolarHBondContact N-O 2.82Å; S56-V82 PolarHBondContact O-N 3.3Å; H58-V82 HydrophobicContact CB-CG1 4.2Å; V82-A99 HydrophobicContact CG2-CB 3.91Å; V82-V566 HydrophobicContact CG1-CG1 3.9Å
83	E	96.2	Very high	94.5	Very high	16 Å²	16	22.1 Å²	22.1	8%	0.075	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	137	176	-165.2	-176.5	92	0	0	111.6	Y53 R100 V107 R187	Y53-E83 HydrophobicContact CD2-CG 3.92Å; Y53-E83 WeakPolarHBondContact CD2-OE1 3.49Å; Y53-E83 WeakPolarHBondContact CD2-OE2 3.14Å; Y53-E83 HydrophobicContact CG-CG 3.83Å; E83-R100 PolarHBondContact O-N 3.36Å; E83-R100 IonicContact OE1-NE 3.78Å; E83-V107 HydrophobicContact CB-CB 3.7Å; E83-V107 HydrophobicContact CB-CG1 4.34Å; E83-V107 WeakPolarHBondContact CB-O 3.25Å; E83-V107 HydrophobicContact CG-CB 4.37Å; E83-V107 PolarHBondContact N-O 3.1Å; E83-R187 IonicContact OE1-NH1 3.43Å; E83-R187 PolarHBondContact OE1-NH1 2.94Å
84	T	96.2	Very high	94.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-179.9	176.9	70.4	0	0	0	0	112.4	V54 C86 C97 E98 R100	V54-T84 WeakPolarHBondContact O-CB 3.46Å; V54-T84 VanDerWaalsContact O-CG2 3.31Å; V54-T84 WeakPolarHBondContact O-CG2 3.48Å; V54-T84 PolarHBondContact O-N 3.45Å; V54-T84 PolarHBondContact O-OG1 3.44Å; T84-C86 VanDerWaalsContact C-N 3.33Å; T84-C86 PolarHBondContact OG1-N 2.79Å; T84-C97 HydrophobicContact CG2-CB 3.95Å; T84-E98 CarbonylContact C-O 3.55Å; T84-E98 WeakPolarHBondContact CA-O 3.12Å; T84-E98 WeakPolarHBondContact CB-O 3.49Å; T84-R100 PolarHBondContact O-NE 3.05Å; T84-R100 VanDerWaalsContact O-NE 3.15Å
85	N	93.6	Very high	94.4	Very high	43 Å²	43	28.2 Å²	28.2	23%	0.23	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	1.5	173.7	67.8	-6	0	0	0	114.7	E98	N85-E98 PolarHBondContact N-O 2.72Å; N85-E98 PolarHBondContact OD1-N 2.91Å; N85-E98 VanDerWaalsContact OD1-N 3.16Å; N85-E98 PolarHBondContact OD1-O 2.94Å
86	C	95.1	Very high	94.3	Very high	9 Å²	9	35.5 Å²	35.5	6%	0.061	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	136.7	177.6	-69.4	0	0	0	0	111.6	Y53 V54 T84 C97	Y53-C86 CarbonylContact C-O 3.47Å; Y53-C86 VanDerWaalsContact CA-O 3.23Å; Y53-C86 WeakPolarHBondContact CA-O 3.28Å; Y53-C86 WeakPolarHBondContact CB-O 3.43Å; Y53-C86 WeakPolarHBondContact CD1-O 3.14Å; V54-C86 HydrophobicContact CB-CB 4.06Å; V54-C86 HydrophobicContact CG2-CB 3.91Å; V54-C86 PolarHBondContact N-O 2.83Å; T84-C86 VanDerWaalsContact C-N 3.33Å; T84-C86 PolarHBondContact OG1-N 2.79Å; C86-C97 HydrophobicContact CB-CB 3.72Å; C86-C97 WeakPolarHBondContact CB-SG 3.49Å; C86-C97 VanDerWaalsContact SG-CA 3.52Å; C86-C97 WeakPolarHBondContact SG-CB 3.3Å; C86-C97 CovalentContact SG-SG 2.04Å; C86-C97 PolarHBondContact SG-SG 2.85Å
87	S	95.2	Very high	94.3	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.007	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	145.5	168.6	-175.7	0	0	0	0	111.4	I89 S90	S87-I89 PolarHBondContact O-N 2.8Å; S87-I89 WeakPolarHBondContact OG-CG1 3.24Å; S87-S90 VanDerWaalsContact O-CB 3.28Å; S87-S90 WeakPolarHBondContact O-CB 3.24Å; S87-S90 PolarHBondContact O-N 2.95Å; S87-S90 VanDerWaalsContact O-N 3.07Å; S87-S90 PolarHBondContact O-OG 2.83Å
88	V	94.2	Very high	94.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-62.6	-26.9	177.4	-61.8	0	0	0	0	112.7	R49 D51 G52 Y53 V54 S90 R91	R49-V88 HydrophobicContact CB-CB 4.44Å; R49-V88 HydrophobicContact CB-CG1 4.15Å; R49-V88 HydrophobicContact CB-CG2 4.49Å; R49-V88 WeakPolarHBondContact O-CG2 3.3Å; D51-V88 VanDerWaalsContact N-CG2 3.33Å; G52-V88 WeakPolarHBondContact O-CG2 3.45Å; G52-V88 PolarHBondContact O-N 2.9Å; Y53-V88 VanDerWaalsContact C-CG1 3.42Å; Y53-V88 WeakPolarHBondContact O-CG1 3.47Å; V54-V88 HydrophobicContact CG2-CG1 4.33Å; V88-S90 PolarHBondContact O-N 2.79Å; V88-R91 PolarHBondContact O-N 2.9Å
89	I	92.1	Very high	94.1	Very high	23 Å²	23	43.6 Å²	43.6	12%	0.118	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-65.9	-18.2	176.9	73.4	-177.9	0	0	0	112.6	S87 R91 T203 K231 G232 F233 Y255	S87-I89 PolarHBondContact O-N 2.8Å; S87-I89 WeakPolarHBondContact OG-CG1 3.24Å; I89-R91 PolarHBondContact O-N 3.03Å; I89-T203 HydrophobicContact CD1-CG2 3.88Å; I89-K231 HydrophobicContact CD1-CB 4.24Å; I89-G232 WeakPolarHBondContact CD1-O 3.28Å; I89-F233 HydrophobicContact CD1-CB 4.17Å; I89-Y255 HydrophobicContact CD1-CD2 3.88Å; I89-Y255 HydrophobicContact CD1-CE2 3.91Å; I89-Y255 HydrophobicContact CG1-CD2 3.62Å; I89-Y255 HydrophobicContact CG1-CE2 3.61Å
90	S	91.5	Very high	93.9	Very high	15 Å²	15	44.5 Å²	44.5	11%	0.105	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-70.9	-16.5	175.1	72.6	0	0	0	0	113	S87 V88 R92 Y255	S87-S90 VanDerWaalsContact O-CB 3.28Å; S87-S90 WeakPolarHBondContact O-CB 3.24Å; S87-S90 PolarHBondContact O-N 2.95Å; S87-S90 VanDerWaalsContact O-N 3.07Å; S87-S90 PolarHBondContact O-OG 2.83Å; V88-S90 PolarHBondContact O-N 2.79Å; S90-R92 PolarHBondContact O-N 2.78Å; S90-R92 PolarHBondContact OG-N 2.85Å; S90-Y255 VanDerWaalsContact CB-CZ 3.47Å
91	R	90.3	Very high	93.8	Very high	98 Å²	98	47 Å²	47	37%	0.37	23%	0.225	S	C	.	.			trans	51.2	17.5	-174.4	-55.9	-59.2	-151	-175	15	114.5	L47 R49 V88 I89 E258	L47-R91 PolarHBondContact O-NH1 3.06Å; R49-R91 PolarHBondContact O-NH1 3.05Å; V88-R91 PolarHBondContact O-N 2.9Å; I89-R91 PolarHBondContact O-N 3.03Å; R91-E258 IonicContact CZ-OE1 3.75Å; R91-E258 IonicContact NE-OE1 2.79Å; R91-E258 PolarHBondContact NE-OE1 2.9Å; R91-E258 IonicContact NH2-OE1 3.35Å; R91-E258 PolarHBondContact NH2-OE1 2.81Å
92	R	89.8	Confident	93.4	Very high	109 Å²	109	49.8 Å²	49.8	41%	0.411	24%	0.238	S	C	.	.			trans	-69.2	145.6	-178.9	-70.8	-177.1	-178.4	159.9	10.8	110.7	S90 W94 E253	S90-R92 PolarHBondContact O-N 2.78Å; S90-R92 PolarHBondContact OG-N 2.85Å; R92-W94 PolarHBondContact O-N 3.38Å; R92-E253 IonicContact CZ-OE2 2.72Å; R92-E253 VanDerWaalsContact CZ-OE2 3.25Å; R92-E253 IonicContact NH1-OE1 3.24Å; R92-E253 IonicContact NH1-OE2 3.69Å; R92-E253 PolarHBondContact NH1-OE2 3.03Å; R92-E253 IonicContact NH2-OE2 3.25Å; R92-E253 PolarHBondContact NH2-OE2 2.85Å
93	D	91.9	Very high	93	Very high	65 Å²	65	52 Å²	52	35%	0.348	25%	0.251	S	S	.	.			trans	-61.4	134.3	170.1	-173.6	-85.6	0	0	0	110	K95 K96	D93-K95 PolarHBondContact O-N 2.79Å; D93-K95 VanDerWaalsContact O-N 3.09Å; D93-K95 WeakPolarHBondContact OD1-CB 3.44Å; D93-K95 VanDerWaalsContact OD1-CG 3.27Å; D93-K95 WeakPolarHBondContact OD1-CG 3.36Å; D93-K95 PolarHBondContact OD1-N 3.1Å; D93-K96 WeakPolarHBondContact O-CB 3.48Å; D93-K96 PolarHBondContact O-N 3.3Å
94	W	94.6	Very high	92.7	Very high	22 Å²	22	55.3 Å²	55.3	8%	0.083	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-60.4	-23	-175.2	62.5	-91.8	0	0	0	113.7	H39 L42 S43 V54 F55 L57 R92 K96 C97	H39-W94 HydrophobicContact CB-CZ2 4.33Å; H39-W94 AromaticContact CD2-CH2 3.95Å; H39-W94 AromaticContact CD2-CZ2 3.63Å; L42-W94 HydrophobicContact CD2-CD2 3.99Å; L42-W94 HydrophobicContact CD2-CE3 4.43Å; L42-W94 HydrophobicContact CD2-CG 4.19Å; L42-W94 HydrophobicContact CD2-CZ2 4.5Å; S43-W94 PolarHBondContact OG-NE1 3.37Å; V54-W94 HydrophobicContact CG1-CB 3.58Å; F55-W94 WeakPolarHBondContact O-CB 3.37Å; L57-W94 HydrophobicContact CB-CH2 4.09Å; L57-W94 HydrophobicContact CB-CZ3 4.22Å; R92-W94 PolarHBondContact O-N 3.38Å; W94-K96 PolarHBondContact O-N 2.74Å; W94-C97 PolarHBondContact O-N 2.91Å; W94-C97 VanDerWaalsContact O-N 3.14Å
95	K	93	Very high	92.5	Very high	136 Å²	136	55.5 Å²	55.5	59%	0.591	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-71.8	-18.6	175.7	-59.6	171.6	-177.8	172.5	0	113	D93 C97	D93-K95 PolarHBondContact O-N 2.79Å; D93-K95 VanDerWaalsContact O-N 3.09Å; D93-K95 WeakPolarHBondContact OD1-CB 3.44Å; D93-K95 VanDerWaalsContact OD1-CG 3.27Å; D93-K95 WeakPolarHBondContact OD1-CG 3.36Å; D93-K95 PolarHBondContact OD1-N 3.1Å; K95-C97 VanDerWaalsContact C-N 3.31Å
96	K	94.3	Very high	92.5	Very high	173 Å²	173	53.6 Å²	53.6	75%	0.752	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-90.4	-0.7	173.7	-60.2	-177.6	179.9	178.8	0	112.2	D93 W94	D93-K96 WeakPolarHBondContact O-CB 3.48Å; D93-K96 PolarHBondContact O-N 3.3Å; W94-K96 PolarHBondContact O-N 2.74Å
97	C	95.1	Very high	92.5	Very high	10 Å²	10	53.6 Å²	53.6	7%	0.068	26%	0.258	C	S	.	.	S	Bend	trans	-109.8	133.9	-177.3	-66.2	0	0	0	0	110	T84 C86 W94 K95	T84-C97 HydrophobicContact CG2-CB 3.95Å; C86-C97 HydrophobicContact CB-CB 3.72Å; C86-C97 WeakPolarHBondContact CB-SG 3.49Å; C86-C97 VanDerWaalsContact SG-CA 3.52Å; C86-C97 WeakPolarHBondContact SG-CB 3.3Å; C86-C97 CovalentContact SG-SG 2.04Å; C86-C97 PolarHBondContact SG-SG 2.85Å; W94-C97 PolarHBondContact O-N 2.91Å; W94-C97 VanDerWaalsContact O-N 3.14Å; K95-C97 VanDerWaalsContact C-N 3.31Å
98	E	94.3	Very high	92.5	Very high	134 Å²	134	53.6 Å²	53.6	63%	0.626	26%	0.258	S	S	*	.	P	Polyproline II helix	trans	-88.5	129.6	-175.4	-167	-178.9	174.8	0	0	110	T84 N85	T84-E98 CarbonylContact C-O 3.55Å; T84-E98 WeakPolarHBondContact CA-O 3.12Å; T84-E98 WeakPolarHBondContact CB-O 3.49Å; N85-E98 PolarHBondContact N-O 2.72Å; N85-E98 PolarHBondContact OD1-N 2.91Å; N85-E98 VanDerWaalsContact OD1-N 3.16Å; N85-E98 PolarHBondContact OD1-O 2.94Å
99	A	94.1	Very high	92.6	Very high	42 Å²	42	53.6 Å²	53.6	35%	0.347	26%	0.258	S	S	.	.	B	Isolated β-bridge	trans	-64.2	136	171.3	0	0	0	0	0	109.6	V82	V82-A99 HydrophobicContact CG2-CB 3.91Å
100	R	93.3	Very high	92.7	Very high	19 Å²	19	54 Å²	54	7%	0.072	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-66.8	137.4	-176.7	-67	-174.9	-176.3	-99.9	4.3	111.1	E83 T84 P106 E201	E83-R100 PolarHBondContact O-N 3.36Å; E83-R100 IonicContact OE1-NE 3.78Å; T84-R100 PolarHBondContact O-NE 3.05Å; T84-R100 VanDerWaalsContact O-NE 3.15Å; R100-P106 HydrophobicContact CB-CB 4.34Å; R100-E201 IonicContact CZ-OE1 2.79Å; R100-E201 IonicContact CZ-OE2 3.15Å; R100-E201 IonicContact NH1-OE1 2.81Å; R100-E201 PolarHBondContact NH1-OE1 3.08Å; R100-E201 IonicContact NH1-OE2 3.13Å; R100-E201 VanDerWaalsContact NH2-CD 3.33Å; R100-E201 IonicContact NH2-OE1 2.73Å; R100-E201 PolarHBondContact NH2-OE1 3.21Å; R100-E201 VanDerWaalsContact NH2-OE1 3.15Å; R100-E201 IonicContact NH2-OE2 2.81Å; R100-E201 PolarHBondContact NH2-OE2 3.47Å
101	P	91.6	Very high	93	Very high	57 Å²	57	53.3 Å²	53.3	37%	0.37	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-69	159.7	176.7	30.4	-35.9	0	0	0	111	T103 Q104 P106	P101-T103 PolarHBondContact O-N 2.84Å; P101-T103 VanDerWaalsContact O-N 3.13Å; P101-Q104 HydrophobicContact CG-CB 4.07Å; P101-Q104 HydrophobicContact CG-CG 3.83Å; P101-Q104 PolarHBondContact O-N 3.37Å; P101-P106 WeakPolarHBondContact O-CD 3.13Å
102	E	88.1	Confident	93.3	Very high	57 Å²	57	52 Å²	52	27%	0.266	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-56.3	-31.7	179.7	-63.2	-178.3	-175	0	0	113.4	Q104 M105 P106 S564 L565	E102-Q104 PolarHBondContact O-N 2.93Å; E102-M105 PolarHBondContact O-N 3.38Å; E102-P106 WeakPolarHBondContact O-CD 3.48Å; E102-S564 WeakPolarHBondContact OE1-CA 3.42Å; E102-S564 WeakPolarHBondContact OE1-CB 3.5Å; E102-L565 HydrophobicContact CG-CB 4.1Å; E102-L565 PolarHBondContact OE1-N 3.13Å; E102-L565 WeakPolarHBondContact OE2-CB 3.32Å
103	T	87.6	Confident	93.6	Very high	62 Å²	62	46.8 Å²	46.8	38%	0.38	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-68.7	-14.6	177.9	54.1	0	0	0	0	113.8	P101 C148	P101-T103 PolarHBondContact O-N 2.84Å; P101-T103 VanDerWaalsContact O-N 3.13Å; T103-C148 WeakPolarHBondContact CB-SG 3.43Å; T103-C148 WeakPolarHBondContact O-CB 3.4Å
104	Q	90.4	Very high	93.8	Very high	86 Å²	86	43.7 Å²	43.7	40%	0.402	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-110.4	31.1	-179.3	-69.4	-174.4	1.5	0	0	112.1	P101 E102 R187	P101-Q104 HydrophobicContact CG-CB 4.07Å; P101-Q104 HydrophobicContact CG-CG 3.83Å; P101-Q104 PolarHBondContact O-N 3.37Å; E102-Q104 PolarHBondContact O-N 2.93Å; Q104-R187 PolarHBondContact O-NH2 3.02Å
105	M	92	Very high	93.9	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.02	21%	0.211	C	C	.	.			trans	51.3	60.5	175	-66.9	-71.5	-62.6	0	0	112.8	E102 V136 A138 V141 P149 F151 R187	E102-M105 PolarHBondContact O-N 3.38Å; M105-V136 HydrophobicContact CB-CG2 4.42Å; M105-V136 HydrophobicContact CE-CG2 4.2Å; M105-V136 WeakPolarHBondContact CE-O 3.47Å; M105-V136 HydrophobicContact SD-CG2 4.08Å; M105-A138 HydrophobicContact CE-CB 3.92Å; M105-A138 HydrophobicContact SD-CB 4.35Å; M105-V141 HydrophobicContact SD-CB 3.75Å; M105-V141 HydrophobicContact SD-CG1 4.13Å; M105-V141 HydrophobicContact SD-CG2 3.52Å; M105-V141 VanDerWaalsContact SD-CG2 3.52Å; M105-P149 VanDerWaalsContact CG-O 3.29Å; M105-P149 WeakPolarHBondContact CG-O 3.47Å; M105-F151 HydrophobicContact CB-CD2 4.11Å; M105-F151 HydrophobicContact CB-CE1 4.42Å; M105-F151 HydrophobicContact CB-CE2 3.61Å; M105-F151 HydrophobicContact CB-CZ 3.81Å; M105-F151 HydrophobicContact CE-CD2 3.37Å; M105-F151 HydrophobicContact CE-CE2 3.7Å; M105-F151 HydrophobicContact CE-CG 4.31Å; M105-F151 HydrophobicContact CG-CD2 4.42Å; M105-F151 HydrophobicContact CG-CE2 4.38Å; M105-F151 WeakPolarHBondContact O-CZ 3.42Å; M105-R187 PolarHBondContact O-NH2 2.94Å
106	P	93.6	Very high	93.9	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.019	18%	0.183	C	C	.	.			trans	-59.2	155.8	-176.5	24.4	-32.9	0	0	0	111.8	R100 P101 E102 V136 V566	R100-P106 HydrophobicContact CB-CB 4.34Å; P101-P106 WeakPolarHBondContact O-CD 3.13Å; E102-P106 WeakPolarHBondContact O-CD 3.48Å; P106-V136 HydrophobicContact CG-CG1 3.89Å; P106-V136 HydrophobicContact CG-CG2 4.24Å; P106-V136 WeakPolarHBondContact O-CG1 3.37Å; P106-V136 PolarHBondContact O-N 3.03Å; P106-V566 HydrophobicContact CB-CG2 4.39Å; P106-V566 HydrophobicContact CG-CG2 3.93Å
107	V	95.6	Very high	93.9	Very high	10 Å²	10	28.8 Å²	28.8	6%	0.061	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.7	173.9	172.6	0	0	0	0	107	E83 I133 R134 P135 F151	E83-V107 HydrophobicContact CB-CB 3.7Å; E83-V107 HydrophobicContact CB-CG1 4.34Å; E83-V107 WeakPolarHBondContact CB-O 3.25Å; E83-V107 HydrophobicContact CG-CB 4.37Å; E83-V107 PolarHBondContact N-O 3.1Å; V107-I133 HydrophobicContact CG1-CB 3.95Å; V107-I133 HydrophobicContact CG1-CD1 3.99Å; V107-I133 HydrophobicContact CG1-CG1 4.18Å; V107-R134 WeakPolarHBondContact CA-O 3.44Å; V107-R134 WeakPolarHBondContact CG1-O 3.38Å; V107-P135 HydrophobicContact CG2-CB 4.22Å; V107-F151 HydrophobicContact CG2-CZ 4.39Å
108	Y	95.5	Very high	93.7	Very high	1 Å²	1	28.3 Å²	28.3	0%	0.004	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	159.2	-177.5	72.3	-74.3	0	0	0	109.4	V81 I133 R134 V136 V566 L569 F570 D573 F576	V81-Y108 WeakPolarHBondContact O-CA 3.32Å; Y108-I133 CarbonylContact O-C 3.46Å; Y108-I133 WeakPolarHBondContact O-CA 3.42Å; Y108-R134 VanDerWaalsContact CD1-O 3.3Å; Y108-R134 WeakPolarHBondContact CD1-O 3.3Å; Y108-R134 HydrophobicContact CE1-CB 4.08Å; Y108-R134 PolarHBondContact N-O 2.84Å; Y108-R134 PolarHBondContact O-N 3.38Å; Y108-V136 HydrophobicContact CD1-CG1 4Å; Y108-V136 HydrophobicContact CE1-CG1 4.26Å; Y108-V566 HydrophobicContact CG-CG1 4.49Å; Y108-L569 HydrophobicContact CD1-CD1 4.33Å; Y108-L569 HydrophobicContact CD2-CB 4.46Å; Y108-L569 HydrophobicContact CE1-CB 4.13Å; Y108-L569 HydrophobicContact CE1-CD1 3.83Å; Y108-L569 HydrophobicContact CE2-CB 3.84Å; Y108-F570 HydrophobicContact CD2-CD1 4.17Å; Y108-F570 HydrophobicContact CD2-CD2 4.12Å; Y108-F570 AromaticContact CD2-CE1 3.94Å; Y108-F570 HydrophobicContact CD2-CE1 3.94Å; Y108-F570 AromaticContact CD2-CE2 3.89Å; Y108-F570 HydrophobicContact CD2-CE2 3.89Å; Y108-F570 HydrophobicContact CD2-CG 4.25Å; Y108-F570 AromaticContact CD2-CZ 3.79Å; Y108-F570 HydrophobicContact CD2-CZ 3.79Å; Y108-F570 HydrophobicContact CG-CE2 4.32Å; Y108-F570 HydrophobicContact CG-CZ 4.35Å; Y108-D573 PolarHBondContact OH-OD2 3.39Å; Y108-D573 VanDerWaalsContact OH-OD2 3.05Å; Y108-F576 HydrophobicContact CD2-CD2 4.14Å; Y108-F576 HydrophobicContact CD2-CE2 4.22Å; Y108-F576 AromaticContact CE2-CD2 3.6Å; Y108-F576 HydrophobicContact CE2-CD2 3.6Å; Y108-F576 AromaticContact CE2-CE2 3.77Å; Y108-F576 HydrophobicContact CE2-CE2 3.77Å
109	G	95.3	Very high	93.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	180	-170.9	177.5	0	0	0	0	0	113.6	D80 V81 V132 F570	D80-G109 WeakPolarHBondContact CA-O 3.46Å; V81-G109 WeakPolarHBondContact CG2-O 3.48Å; V81-G109 PolarHBondContact N-O 3.43Å; V81-G109 PolarHBondContact O-N 3.24Å; G109-V132 CarbonylContact C-O 3.58Å; G109-V132 WeakPolarHBondContact CA-O 3.43Å; G109-F570 VanDerWaalsContact O-CE1 3.24Å; G109-F570 WeakPolarHBondContact O-CE1 3.45Å; G109-F570 VanDerWaalsContact O-CZ 3.24Å; G109-F570 WeakPolarHBondContact O-CZ 3.47Å
110	Q	95.8	Very high	93.1	Very high	32 Å²	32	30.1 Å²	30.1	15%	0.15	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	131.7	-177.6	-170.8	173.5	90.5	0	0	110.4	T78 L79 D80 C131 V132 F576	T78-Q110 HydrophobicContact CG2-CG 3.33Å; T78-Q110 VanDerWaalsContact CG2-OE1 3.29Å; L79-Q110 CarbonylContact O-C 3.59Å; L79-Q110 VanDerWaalsContact O-CA 3.3Å; L79-Q110 WeakPolarHBondContact O-CA 3.37Å; D80-Q110 WeakPolarHBondContact OD1-CG 3.44Å; D80-Q110 PolarHBondContact OD1-NE2 2.77Å; Q110-C131 WeakPolarHBondContact O-CA 3.04Å; Q110-V132 PolarHBondContact N-O 2.94Å; Q110-V132 PolarHBondContact O-N 2.77Å; Q110-F576 HydrophobicContact CB-CD1 3.55Å; Q110-F576 HydrophobicContact CB-CE1 3.82Å; Q110-F576 HydrophobicContact CB-CG 4.44Å
111	C	96.7	Very high	92.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	127.8	174.8	-67.2	0	0	0	0	110.2	I45 T78 L79 V81 D130 C131	I45-C111 HydrophobicContact CD1-CB 4.42Å; T78-C111 CarbonylContact C-O 3.5Å; T78-C111 WeakPolarHBondContact CA-O 3.46Å; L79-C111 HydrophobicContact CB-CB 4.28Å; L79-C111 PolarHBondContact N-O 2.96Å; L79-C111 PolarHBondContact O-N 3.13Å; V81-C111 HydrophobicContact CG1-CB 4.44Å; C111-D130 CarbonylContact C-O 3.54Å; C111-D130 WeakPolarHBondContact CA-O 3.37Å; C111-C131 HydrophobicContact CB-CB 4.05Å; C111-C131 WeakPolarHBondContact CB-SG 3.09Å; C111-C131 WeakPolarHBondContact SG-CB 3.38Å; C111-C131 CovalentContact SG-SG 2.04Å; C111-C131 PolarHBondContact SG-SG 2.94Å
112	K	96.3	Very high	92.5	Very high	70 Å²	70	41.5 Å²	41.5	30%	0.304	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	133.5	165.2	-63.8	-178.1	-178.8	-179.2	0	108.7	L77 Y129 D130 F548	L77-K112 CarbonylContact O-C 3.52Å; L77-K112 VanDerWaalsContact O-CA 3.27Å; L77-K112 WeakPolarHBondContact O-CA 3.48Å; K112-Y129 CarbonylContact O-C 3.59Å; K112-Y129 WeakPolarHBondContact O-CA 3.2Å; K112-Y129 WeakPolarHBondContact O-CB 3.47Å; K112-D130 PolarHBondContact N-O 2.98Å; K112-D130 PolarHBondContact O-N 3.21Å; K112-F548 HydrophobicContact CB-CD1 3.98Å; K112-F548 HydrophobicContact CB-CD2 3.77Å; K112-F548 HydrophobicContact CB-CE1 3.94Å; K112-F548 HydrophobicContact CB-CE2 3.7Å; K112-F548 HydrophobicContact CB-CG 3.91Å; K112-F548 HydrophobicContact CB-CZ 3.8Å; K112-F548 HydrophobicContact CD-CB 4.04Å; K112-F548 HydrophobicContact CD-CD2 4.01Å; K112-F548 HydrophobicContact CD-CG 4.02Å
113	A	97	Very high	92.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	136.4	-175.8	0	0	0	0	0	111.8	A41 I45 Y76 L77 L126 K128	A41-A113 HydrophobicContact CB-CB 4.12Å; I45-A113 HydrophobicContact CD1-CB 4.07Å; Y76-A113 WeakPolarHBondContact CA-O 3.46Å; L77-A113 PolarHBondContact N-O 3.38Å; L77-A113 PolarHBondContact O-N 3.25Å; A113-L126 HydrophobicContact CB-CD1 4.17Å; A113-K128 CarbonylContact C-O 3.52Å; A113-K128 WeakPolarHBondContact CA-O 3.48Å
114	A	96.3	Very high	92.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	108	172.7	0	0	0	0	0	108.9	Y75 Y76 Y127 K128 I545 F548	Y75-A114 WeakPolarHBondContact O-CA 3.38Å; Y76-A114 HydrophobicContact CD1-CB 4.15Å; Y76-A114 HydrophobicContact CE1-CB 4.16Å; A114-Y127 PolarHBondContact O-N 2.04Å; A114-K128 HydrophobicContact CB-CB 4.32Å; A114-K128 PolarHBondContact N-O 2.83Å; A114-I545 HydrophobicContact CB-CG2 3.91Å; A114-F548 HydrophobicContact CB-CE1 4.04Å; A114-F548 HydrophobicContact CB-CZ 4.49Å
115	I	95.4	Very high	92.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127	-177.2	-172.4	170.2	0	0	0	111.1	A37 L40 A41 V74 Y75 L77 I117 V124 R125 L126	A37-I115 HydrophobicContact CB-CG2 4.24Å; L40-I115 HydrophobicContact CB-CD1 3.81Å; A41-I115 HydrophobicContact CB-CB 4.33Å; A41-I115 HydrophobicContact CB-CD1 4Å; A41-I115 HydrophobicContact CB-CG2 4.17Å; V74-I115 CarbonylContact C-O 3.51Å; V74-I115 WeakPolarHBondContact CA-O 3.4Å; Y75-I115 PolarHBondContact N-O 3.17Å; Y75-I115 PolarHBondContact O-N 2.99Å; L77-I115 HydrophobicContact CD1-CG2 3.9Å; I115-I117 HydrophobicContact CG1-CG1 4.32Å; I115-V124 HydrophobicContact CD1-CG1 3.76Å; I115-V124 HydrophobicContact CG1-CG1 4.21Å; I115-R125 CarbonylContact C-O 3.51Å; I115-R125 WeakPolarHBondContact CA-O 2.98Å; I115-R125 WeakPolarHBondContact CG1-O 3.02Å; I115-L126 HydrophobicContact CB-CD1 4.31Å
116	Y	94.5	Very high	92.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	134.5	174	173.2	-115.2	0	0	0	111.2	H68 V73 V74 N118 V123 V124 R125 Y127 I537 P543	H68-Y116 HydrophobicContact CB-CE2 4.17Å; H68-Y116 AromaticContact CD2-CE2 3.82Å; V73-Y116 WeakPolarHBondContact O-CA 3.44Å; V74-Y116 HydrophobicContact CG2-CD2 3.97Å; Y116-N118 HydrophobicContact CE1-CB 4.1Å; Y116-N118 PolarHBondContact OH-ND2 3.42Å; Y116-V123 HydrophobicContact CD1-CG1 4.17Å; Y116-V123 HydrophobicContact CE1-CG1 4.03Å; Y116-V124 WeakPolarHBondContact O-CA 3.45Å; Y116-R125 PolarHBondContact N-O 3.16Å; Y116-R125 PolarHBondContact O-N 2.94Å; Y116-Y127 VanDerWaalsContact CB-CE2 3.48Å; Y116-Y127 HydrophobicContact CD1-CE2 4.49Å; Y116-Y127 HydrophobicContact CG-CE2 4.23Å; Y116-I537 HydrophobicContact CE1-CD1 4.28Å; Y116-P543 HydrophobicContact CD2-CG 3.91Å; Y116-P543 HydrophobicContact CE2-CG 4.37Å; Y116-P543 HydrophobicContact CG-CG 4Å
117	I	92.9	Very high	92.6	Very high	17 Å²	17	38 Å²	38	9%	0.087	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	124.5	178.2	-57.1	-179.8	0	0	0	109.1	A37 L40 V73 Y75 I115 K119 V123 V124	A37-I117 HydrophobicContact CB-CD1 3.61Å; L40-I117 HydrophobicContact CD1-CD1 4.02Å; V73-I117 PolarHBondContact N-O 3.48Å; V73-I117 PolarHBondContact O-N 3.48Å; Y75-I117 HydrophobicContact CD2-CD1 4.12Å; Y75-I117 HydrophobicContact CD2-CG1 4.36Å; Y75-I117 HydrophobicContact CE2-CB 4.25Å; Y75-I117 HydrophobicContact CE2-CD1 3.98Å; Y75-I117 HydrophobicContact CE2-CG1 4.31Å; I115-I117 HydrophobicContact CG1-CG1 4.32Å; I117-K119 HydrophobicContact CG2-CG 4.11Å; I117-V123 WeakPolarHBondContact CA-O 3.47Å; I117-V124 HydrophobicContact CG1-CG1 4.34Å; I117-V124 HydrophobicContact CG1-CG2 4.5Å; I117-V124 HydrophobicContact CG2-CG2 4.43Å
118	N	91.3	Very high	92.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	101.8	168.6	-170	-53.6	0	0	0	108.7	Y116 P120 H121 R122 V123 I537	Y116-N118 HydrophobicContact CE1-CB 4.1Å; Y116-N118 PolarHBondContact OH-ND2 3.42Å; N118-P120 VanDerWaalsContact OD1-CD 3.3Å; N118-P120 WeakPolarHBondContact OD1-CD 3.22Å; N118-H121 PolarHBondContact OD1-CD2 2.8Å; N118-H121 VanDerWaalsContact OD1-CD2 3.26Å; N118-H121 PolarHBondContact OD1-N 3.49Å; N118-H121 VanDerWaalsContact OD1-N 3.12Å; N118-R122 WeakPolarHBondContact O-CA 3.38Å; N118-R122 PolarHBondContact O-N 2.74Å; N118-V123 HydrophobicContact CB-CB 4.23Å; N118-V123 PolarHBondContact N-O 2.97Å; N118-V123 PolarHBondContact O-N 2.85Å; N118-I537 HydrophobicContact CB-CD1 3.9Å
119	K	87.1	Confident	92.5	Very high	133 Å²	133	41.8 Å²	41.8	58%	0.578	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-45.7	-174.1	-63.9	178	-177.9	173.6	0	112.5	S33 I117 H121 R122	S33-K119 PolarHBondContact OG-NZ 2.91Å; I117-K119 HydrophobicContact CG2-CG 4.11Å; K119-H121 VanDerWaalsContact C-N 3.34Å; K119-H121 PolarHBondContact O-N 2.98Å; K119-R122 PolarHBondContact O-N 2.86Å; K119-R122 VanDerWaalsContact O-N 3.15Å
120	P	89.1	Confident	92.4	Very high	81 Å²	81	44.1 Å²	44.1	53%	0.526	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-41.6	178.2	-29.1	38.2	0	0	0	113.9	N71 N118 R122	N71-P120 HydrophobicContact CB-CG 3.8Å; N118-P120 VanDerWaalsContact OD1-CD 3.3Å; N118-P120 WeakPolarHBondContact OD1-CD 3.22Å; P120-R122 VanDerWaalsContact C-N 3.34Å
121	H	84.9	Confident	92.5	Very high	87 Å²	87	42.6 Å²	42.6	40%	0.403	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-0.7	178.8	-65.5	-72.9	0	0	0	113.7	N118 K119 V123 I537	N118-H121 PolarHBondContact OD1-CD2 2.8Å; N118-H121 VanDerWaalsContact OD1-CD2 3.26Å; N118-H121 PolarHBondContact OD1-N 3.49Å; N118-H121 VanDerWaalsContact OD1-N 3.12Å; K119-H121 VanDerWaalsContact C-N 3.34Å; K119-H121 PolarHBondContact O-N 2.98Å; H121-V123 HydrophobicContact CB-CG2 4Å; H121-V123 PolarHBondContact O-N 3.02Å; H121-I537 HydrophobicContact CB-CD1 3.93Å; H121-I537 HydrophobicContact CB-CG1 3.92Å
122	R	86.6	Confident	92.4	Very high	229 Å²	229	43.8 Å²	43.8	86%	0.864	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	32.5	-177.4	-56.3	-178.6	177.6	-178.7	-0.6	113.8	N118 K119 P120	N118-R122 WeakPolarHBondContact O-CA 3.38Å; N118-R122 PolarHBondContact O-N 2.74Å; K119-R122 PolarHBondContact O-N 2.86Å; K119-R122 VanDerWaalsContact O-N 3.15Å; P120-R122 VanDerWaalsContact C-N 3.34Å
123	V	87.3	Confident	92.4	Very high	11 Å²	11	40.9 Å²	40.9	7%	0.067	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	129.3	-179.8	175.6	0	0	0	0	109.7	Y116 I117 N118 H121 R125 I537	Y116-V123 HydrophobicContact CD1-CG1 4.17Å; Y116-V123 HydrophobicContact CE1-CG1 4.03Å; I117-V123 WeakPolarHBondContact CA-O 3.47Å; N118-V123 HydrophobicContact CB-CB 4.23Å; N118-V123 PolarHBondContact N-O 2.97Å; N118-V123 PolarHBondContact O-N 2.85Å; H121-V123 HydrophobicContact CB-CG2 4Å; H121-V123 PolarHBondContact O-N 3.02Å; V123-R125 HydrophobicContact CG1-CG 3.99Å; V123-I537 HydrophobicContact CB-CD1 4.29Å; V123-I537 HydrophobicContact CG2-CD1 3.99Å; V123-I537 HydrophobicContact CG2-CG1 3.78Å
124	V	91.5	Very high	92.2	Very high	45 Å²	45	41.1 Å²	41.1	27%	0.273	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	113.8	173.5	-177.8	0	0	0	0	108.8	L40 K44 I115 Y116 I117	L40-V124 HydrophobicContact CB-CG1 4.31Å; L40-V124 HydrophobicContact CD1-CG1 4.17Å; L40-V124 HydrophobicContact CD1-CG2 4.32Å; K44-V124 HydrophobicContact CD-CG1 4.41Å; K44-V124 WeakPolarHBondContact CE-O 3.45Å; K44-V124 PolarHBondContact NZ-O 2.99Å; I115-V124 HydrophobicContact CD1-CG1 3.76Å; I115-V124 HydrophobicContact CG1-CG1 4.21Å; Y116-V124 WeakPolarHBondContact O-CA 3.45Å; I117-V124 HydrophobicContact CG1-CG1 4.34Å; I117-V124 HydrophobicContact CG1-CG2 4.5Å; I117-V124 HydrophobicContact CG2-CG2 4.43Å
125	R	92	Very high	92.1	Very high	38 Å²	38	42.2 Å²	42.2	14%	0.143	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	127	-179.5	-61	-166.2	-164.4	101.1	-0.1	111.1	I115 Y116 V123 Y127 D534 S536	I115-R125 CarbonylContact C-O 3.51Å; I115-R125 WeakPolarHBondContact CA-O 2.98Å; I115-R125 WeakPolarHBondContact CG1-O 3.02Å; Y116-R125 PolarHBondContact N-O 3.16Å; Y116-R125 PolarHBondContact O-N 2.94Å; V123-R125 HydrophobicContact CG1-CG 3.99Å; R125-Y127 HydrophobicContact CB-CE2 4.18Å; R125-D534 IonicContact CZ-OD1 2.82Å; R125-D534 IonicContact CZ-OD2 2.96Å; R125-D534 VanDerWaalsContact NH1-CG 3.31Å; R125-D534 IonicContact NH1-OD1 2.82Å; R125-D534 PolarHBondContact NH1-OD1 2.71Å; R125-D534 VanDerWaalsContact NH1-OD1 3.15Å; R125-D534 IonicContact NH1-OD2 3.52Å; R125-D534 PolarHBondContact NH1-OD2 2.82Å; R125-D534 IonicContact NH2-OD1 2.67Å; R125-D534 PolarHBondContact NH2-OD1 3.22Å; R125-D534 IonicContact NH2-OD2 3.61Å; R125-S536 PolarHBondContact NH2-OG 2.89Å
126	L	93.1	Very high	92	Very high	10 Å²	10	42.2 Å²	42.2	5%	0.052	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	122.8	168.5	179.8	69.3	0	0	0	106.2	A41 K44 I45 A113 I115 Y129 P496	A41-L126 HydrophobicContact CB-CD1 4.48Å; K44-L126 HydrophobicContact CB-CB 3.96Å; K44-L126 HydrophobicContact CB-CD2 3.75Å; K44-L126 HydrophobicContact CB-CG 4.46Å; K44-L126 HydrophobicContact CD-CB 3.75Å; I45-L126 HydrophobicContact CG1-CD2 3.7Å; A113-L126 HydrophobicContact CB-CD1 4.17Å; I115-L126 HydrophobicContact CB-CD1 4.31Å; L126-Y129 HydrophobicContact CD2-CD1 3.74Å; L126-Y129 HydrophobicContact CD2-CE1 4.29Å; L126-Y129 HydrophobicContact CG-CD1 4.45Å; L126-P496 HydrophobicContact CB-CB 4.46Å; L126-P496 HydrophobicContact CD2-CB 4.13Å; L126-P496 HydrophobicContact CD2-CG 4.23Å; L126-P496 HydrophobicContact CG-CB 4.05Å; L126-P496 WeakPolarHBondContact O-CB 3.29Å
127	Y	91	Very high	91.9	Very high	33 Å²	33	42.4 Å²	42.4	13%	0.129	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-41	-179.3	-78.6	-77.3	0	0	0	112.2	A114 Y116 R125 P496 E497 P543 I545	A114-Y127 PolarHBondContact O-N 2.04Å; Y116-Y127 VanDerWaalsContact CB-CE2 3.48Å; Y116-Y127 HydrophobicContact CD1-CE2 4.49Å; Y116-Y127 HydrophobicContact CG-CE2 4.23Å; R125-Y127 HydrophobicContact CB-CE2 4.18Å; Y127-P496 WeakPolarHBondContact O-CA 3.46Å; Y127-E497 PolarHBondContact O-N 2.89Å; Y127-P543 HydrophobicContact CE2-CG 3.73Å; Y127-P543 WeakPolarHBondContact OH-CD 2.83Å; Y127-I545 HydrophobicContact CD1-CG1 4.18Å; Y127-I545 HydrophobicContact CD2-CD1 3.5Å; Y127-I545 HydrophobicContact CD2-CG1 4.02Å; Y127-I545 HydrophobicContact CE2-CD1 4.04Å; Y127-I545 HydrophobicContact CG-CD1 3.78Å; Y127-I545 HydrophobicContact CG-CG1 3.74Å
128	K	92.8	Very high	91.9	Very high	82 Å²	82	43.5 Å²	43.5	36%	0.357	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	140.7	-173	-171.7	172.9	-165.1	114.7	0	111	A113 A114 E497 F548	A113-K128 CarbonylContact C-O 3.52Å; A113-K128 WeakPolarHBondContact CA-O 3.48Å; A114-K128 HydrophobicContact CB-CB 4.32Å; A114-K128 PolarHBondContact N-O 2.83Å; K128-E497 WeakPolarHBondContact CA-O 3.46Å; K128-E497 HydrophobicContact CG-CB 4.25Å; K128-E497 IonicContact NZ-OE2 3.65Å; K128-E497 PolarHBondContact NZ-OE2 2.88Å; K128-F548 HydrophobicContact CD-CE2 4.35Å; K128-F548 HydrophobicContact CG-CE2 4.35Å; K128-F548 HydrophobicContact CG-CZ 4.25Å
129	Y	95.8	Very high	91.9	Very high	9 Å²	9	46 Å²	46	4%	0.035	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	149.7	166	71.3	-88.4	0	0	0	112.8	I45 D48 K112 L126 P496 E497 L499 I500	I45-Y129 HydrophobicContact CD1-CD2 4.4Å; I45-Y129 HydrophobicContact CD1-CG 4.15Å; I45-Y129 HydrophobicContact CG1-CD1 3.93Å; I45-Y129 HydrophobicContact CG1-CD2 4.06Å; I45-Y129 HydrophobicContact CG1-CE1 4.44Å; I45-Y129 HydrophobicContact CG1-CG 3.7Å; I45-Y129 HydrophobicContact CG2-CD2 3.99Å; I45-Y129 HydrophobicContact CG2-CE2 3.89Å; I45-Y129 HydrophobicContact CG2-CG 4.45Å; D48-Y129 HydrophobicContact CB-CE1 4.17Å; D48-Y129 WeakPolarHBondContact OD2-CE1 3.02Å; D48-Y129 VanDerWaalsContact OD2-CZ 3.27Å; D48-Y129 PolarHBondContact OD2-OH 2.8Å; K112-Y129 CarbonylContact O-C 3.59Å; K112-Y129 WeakPolarHBondContact O-CA 3.2Å; K112-Y129 WeakPolarHBondContact O-CB 3.47Å; L126-Y129 HydrophobicContact CD2-CD1 3.74Å; L126-Y129 HydrophobicContact CD2-CE1 4.29Å; L126-Y129 HydrophobicContact CG-CD1 4.45Å; Y129-P496 HydrophobicContact CD1-CB 4.29Å; Y129-P496 HydrophobicContact CE1-CB 4.32Å; Y129-P496 HydrophobicContact CE1-CG 4.15Å; Y129-E497 PolarHBondContact N-O 3.37Å; Y129-L499 PolarHBondContact O-N 3.02Å; Y129-I500 HydrophobicContact CD2-CD1 4.32Å; Y129-I500 HydrophobicContact CE2-CD1 3.65Å; Y129-I500 HydrophobicContact CE2-CG1 4.31Å
130	D	94.4	Very high	92	Very high	49 Å²	49	43.2 Å²	43.2	26%	0.262	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	116.1	174.3	-179.3	10.2	0	0	0	108.6	C111 K112 L499 F548	C111-D130 CarbonylContact C-O 3.54Å; C111-D130 WeakPolarHBondContact CA-O 3.37Å; K112-D130 PolarHBondContact N-O 2.98Å; K112-D130 PolarHBondContact O-N 3.21Å; D130-L499 WeakPolarHBondContact CA-O 3.2Å; D130-F548 HydrophobicContact CB-CE2 4.47Å
131	C	96.1	Very high	92.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	132.5	177.5	-57.3	0	0	0	0	111.5	F55 Q110 C111 L499 I500 R501	F55-C131 HydrophobicContact CE2-CB 4.44Å; Q110-C131 WeakPolarHBondContact O-CA 3.04Å; C111-C131 HydrophobicContact CB-CB 4.05Å; C111-C131 WeakPolarHBondContact CB-SG 3.09Å; C111-C131 WeakPolarHBondContact SG-CB 3.38Å; C111-C131 CovalentContact SG-SG 2.04Å; C111-C131 PolarHBondContact SG-SG 2.94Å; C131-L499 PolarHBondContact N-O 3.28Å; C131-I500 HydrophobicContact CB-CD1 3.44Å; C131-I500 VanDerWaalsContact CB-CD1 3.44Å; C131-I500 CarbonylContact O-C 3.57Å; C131-I500 WeakPolarHBondContact O-CA 3.03Å; C131-I500 VanDerWaalsContact SG-CD1 3.59Å; C131-R501 PolarHBondContact O-N 3.32Å
132	V	95.8	Very high	92.2	Very high	26 Å²	26	38.1 Å²	38.1	16%	0.158	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	122.4	171.1	-177.5	0	0	0	0	108.4	G109 Q110 R501 L503 L575 F576	G109-V132 CarbonylContact C-O 3.58Å; G109-V132 WeakPolarHBondContact CA-O 3.43Å; Q110-V132 PolarHBondContact N-O 2.94Å; Q110-V132 PolarHBondContact O-N 2.77Å; V132-R501 WeakPolarHBondContact CA-O 3.42Å; V132-R501 HydrophobicContact CG2-CB 4.38Å; V132-L503 HydrophobicContact CG1-CD1 3.37Å; V132-L503 HydrophobicContact CG1-CG 3.86Å; V132-L575 HydrophobicContact CG1-CD1 4.28Å; V132-F576 HydrophobicContact CB-CE1 4.05Å; V132-F576 HydrophobicContact CB-CZ 4.34Å; V132-F576 HydrophobicContact CG1-CE1 4.11Å; V132-F576 HydrophobicContact CG1-CZ 4.03Å; V132-F576 WeakPolarHBondContact O-CE1 3.31Å; V132-F576 VanDerWaalsContact O-CZ 3.28Å; V132-F576 WeakPolarHBondContact O-CZ 3.18Å
133	I	95.4	Very high	92.3	Very high	9 Å²	9	33.8 Å²	33.8	5%	0.046	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	152	-177.4	66.9	176.7	0	0	0	111.8	F55 V107 Y108 I500 R501 T502 L503	F55-I133 HydrophobicContact CE1-CD1 4.27Å; F55-I133 HydrophobicContact CE1-CG2 4.15Å; F55-I133 HydrophobicContact CE2-CG2 4.43Å; F55-I133 HydrophobicContact CZ-CD1 4.04Å; F55-I133 HydrophobicContact CZ-CG2 3.75Å; V107-I133 HydrophobicContact CG1-CB 3.95Å; V107-I133 HydrophobicContact CG1-CD1 3.99Å; V107-I133 HydrophobicContact CG1-CG1 4.18Å; Y108-I133 CarbonylContact O-C 3.46Å; Y108-I133 WeakPolarHBondContact O-CA 3.42Å; I133-I500 HydrophobicContact CD1-CG2 4.38Å; I133-R501 PolarHBondContact N-O 3Å; I133-T502 HydrophobicContact CD1-CG2 4.48Å; I133-T502 HydrophobicContact CG1-CG2 4.17Å; I133-T502 WeakPolarHBondContact O-CA 3.38Å; I133-L503 PolarHBondContact O-N 2.76Å
134	R	94	Very high	92.4	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.015	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	141.5	177.7	-70.3	-175.9	-171.7	-88	4.6	111.6	V107 Y108 L503 P504 M510 D573 F576	V107-R134 WeakPolarHBondContact CA-O 3.44Å; V107-R134 WeakPolarHBondContact CG1-O 3.38Å; Y108-R134 VanDerWaalsContact CD1-O 3.3Å; Y108-R134 WeakPolarHBondContact CD1-O 3.3Å; Y108-R134 HydrophobicContact CE1-CB 4.08Å; Y108-R134 PolarHBondContact N-O 2.84Å; Y108-R134 PolarHBondContact O-N 3.38Å; R134-L503 HydrophobicContact CG-CB 3.84Å; R134-L503 VanDerWaalsContact NH1-CB 3.25Å; R134-P504 WeakPolarHBondContact CD-O 3.35Å; R134-P504 WeakPolarHBondContact CG-O 3.43Å; R134-P504 PolarHBondContact NH1-O 3.11Å; R134-M510 PolarHBondContact NH2-SD 3.48Å; R134-D573 VanDerWaalsContact CD-OD2 3.29Å; R134-D573 WeakPolarHBondContact CD-OD2 3.16Å; R134-D573 IonicContact NE-OD2 2.71Å; R134-D573 PolarHBondContact NE-OD2 3.3Å; R134-F576 HydrophobicContact CG-CE2 4.31Å
135	P	94.4	Very high	92.2	Very high	23 Å²	23	37.5 Å²	37.5	15%	0.149	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	148	164.1	29.3	-30.5	0	0	0	110.3	V107 F151 L503 A505	V107-P135 HydrophobicContact CG2-CB 4.22Å; P135-F151 HydrophobicContact CB-CD2 4.07Å; P135-F151 HydrophobicContact CB-CE2 3.47Å; P135-F151 VanDerWaalsContact CB-CE2 3.47Å; P135-F151 HydrophobicContact CB-CZ 4.35Å; P135-L503 WeakPolarHBondContact CD-O 3.16Å; P135-A505 HydrophobicContact CG-CB 4.25Å; P135-A505 WeakPolarHBondContact O-CA 3.36Å; P135-A505 WeakPolarHBondContact O-CB 3.5Å
136	V	93	Very high	91.9	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-60.9	146.5	167.4	-63.2	0	0	0	0	110.9	M105 P106 Y108 A138 V141 L565 L569	M105-V136 HydrophobicContact CB-CG2 4.42Å; M105-V136 HydrophobicContact CE-CG2 4.2Å; M105-V136 WeakPolarHBondContact CE-O 3.47Å; M105-V136 HydrophobicContact SD-CG2 4.08Å; P106-V136 HydrophobicContact CG-CG1 3.89Å; P106-V136 HydrophobicContact CG-CG2 4.24Å; P106-V136 WeakPolarHBondContact O-CG1 3.37Å; P106-V136 PolarHBondContact O-N 3.03Å; Y108-V136 HydrophobicContact CD1-CG1 4Å; Y108-V136 HydrophobicContact CE1-CG1 4.26Å; V136-A138 PolarHBondContact O-N 3.38Å; V136-V141 HydrophobicContact CB-CG2 4.48Å; V136-V141 HydrophobicContact CG2-CG2 3.51Å; V136-L565 HydrophobicContact CB-CD2 4.4Å; V136-L565 HydrophobicContact CG1-CD2 4.42Å; V136-L569 HydrophobicContact CB-CD1 3.87Å; V136-L569 HydrophobicContact CG1-CD1 3.39Å
137	P	92.6	Very high	91.5	Very high	4 Å²	4	45.3 Å²	45.3	3%	0.026	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-57.9	130.4	172	-28.5	37.6	0	0	0	112.2	A139 R140 V141 A505 I506 D507 L569	P137-A139 VanDerWaalsContact C-N 3.25Å; P137-A139 PolarHBondContact O-N 2.82Å; P137-R140 HydrophobicContact CB-CB 4.26Å; P137-R140 HydrophobicContact CB-CG 3.77Å; P137-R140 HydrophobicContact CG-CG 4.12Å; P137-R140 PolarHBondContact O-N 2.85Å; P137-R140 VanDerWaalsContact O-N 3.1Å; P137-V141 PolarHBondContact O-N 3.01Å; P137-A505 HydrophobicContact CG-CB 4.29Å; P137-I506 HydrophobicContact CG-CG2 3.48Å; P137-I506 VanDerWaalsContact CG-CG2 3.48Å; P137-D507 HydrophobicContact CB-CB 4.44Å; P137-D507 WeakPolarHBondContact CB-OD1 3.32Å; P137-D507 HydrophobicContact CG-CB 4.49Å; P137-L569 HydrophobicContact CG-CD2 4.44Å
138	A	91.6	Very high	91.5	Very high	39 Å²	39	44.4 Å²	44.4	32%	0.322	25%	0.247	S	C	.	.	H	α-helix	trans	-58.4	-40.3	178.3	0	0	0	0	0	111.6	M105 V136 R140 V141 T142 T150	M105-A138 HydrophobicContact CE-CB 3.92Å; M105-A138 HydrophobicContact SD-CB 4.35Å; V136-A138 PolarHBondContact O-N 3.38Å; A138-R140 VanDerWaalsContact C-N 3.25Å; A138-R140 PolarHBondContact O-N 3.25Å; A138-V141 PolarHBondContact O-N 2.62Å; A138-V141 VanDerWaalsContact O-N 3.1Å; A138-T142 PolarHBondContact O-N 3.37Å; A138-T142 PolarHBondContact O-OG1 3.26Å; A138-T150 HydrophobicContact CB-CG2 4.16Å
139	A	90.6	Very high	91.4	Very high	52 Å²	52	41.3 Å²	41.3	43%	0.43	24%	0.235	S	C	.	.	H	α-helix	trans	-56	-39.1	177.6	0	0	0	0	0	112.8	P137 T142 E143	P137-A139 VanDerWaalsContact C-N 3.25Å; P137-A139 PolarHBondContact O-N 2.82Å; A139-T142 PolarHBondContact O-N 3.29Å; A139-E143 WeakPolarHBondContact O-CG 3.48Å; A139-E143 PolarHBondContact O-N 2.85Å
140	R	90	Very high	91.3	Very high	76 Å²	76	43 Å²	43	29%	0.287	25%	0.246	S	C	.	.	H	α-helix	trans	-70.7	-34.2	-179.8	-62.2	-70.2	-106.4	179.5	-7.3	112.1	P137 A138 E143 I144 L565 E572	P137-R140 HydrophobicContact CB-CB 4.26Å; P137-R140 HydrophobicContact CB-CG 3.77Å; P137-R140 HydrophobicContact CG-CG 4.12Å; P137-R140 PolarHBondContact O-N 2.85Å; P137-R140 VanDerWaalsContact O-N 3.1Å; A138-R140 VanDerWaalsContact C-N 3.25Å; A138-R140 PolarHBondContact O-N 3.25Å; R140-E143 IonicContact NH1-OE2 3.75Å; R140-I144 WeakPolarHBondContact O-CG1 3.28Å; R140-L565 HydrophobicContact CB-CD1 3.84Å; R140-L565 HydrophobicContact CB-CD2 4.16Å; R140-L565 HydrophobicContact CG-CD1 4.46Å; R140-E572 IonicContact CZ-OE2 3.03Å; R140-E572 IonicContact NH2-OE1 3.79Å; R140-E572 PolarHBondContact NH2-OE1 3.31Å; R140-E572 IonicContact NH2-OE2 3.42Å; R140-E572 PolarHBondContact NH2-OE2 3.14Å
141	V	90.5	Very high	91.2	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.018	25%	0.248	C	C	.	.	H	α-helix	trans	-71.8	-43.2	173.6	178.6	0	0	0	0	110.3	M105 V136 P137 A138 E143 I144 C145 C148 L565	M105-V141 HydrophobicContact SD-CB 3.75Å; M105-V141 HydrophobicContact SD-CG1 4.13Å; M105-V141 HydrophobicContact SD-CG2 3.52Å; M105-V141 VanDerWaalsContact SD-CG2 3.52Å; V136-V141 HydrophobicContact CB-CG2 4.48Å; V136-V141 HydrophobicContact CG2-CG2 3.51Å; P137-V141 PolarHBondContact O-N 3.01Å; A138-V141 PolarHBondContact O-N 2.62Å; A138-V141 VanDerWaalsContact O-N 3.1Å; V141-E143 VanDerWaalsContact C-N 3.31Å; V141-E143 PolarHBondContact O-N 3.48Å; V141-I144 PolarHBondContact O-N 3.21Å; V141-I144 VanDerWaalsContact O-N 3.09Å; V141-C145 PolarHBondContact O-N 2.9Å; V141-C148 HydrophobicContact CG1-CB 4.01Å; V141-L565 HydrophobicContact CG2-CD2 3.96Å
142	T	88.9	Confident	91.1	Very high	57 Å²	57	46 Å²	46	35%	0.35	26%	0.259	S	S	.	.	H	α-helix	trans	-62.2	-34.4	177	-54.8	0	0	0	0	112.7	A138 A139 I144 C145 P146	A138-T142 PolarHBondContact O-N 3.37Å; A138-T142 PolarHBondContact O-OG1 3.26Å; A139-T142 PolarHBondContact O-N 3.29Å; T142-I144 VanDerWaalsContact C-N 3.28Å; T142-I144 PolarHBondContact O-N 2.98Å; T142-C145 WeakPolarHBondContact CA-O 3.5Å; T142-C145 CarbonylContact O-C 3.54Å; T142-C145 PolarHBondContact O-N 3.48Å; T142-P146 WeakPolarHBondContact O-CA 3.34Å; T142-P146 WeakPolarHBondContact O-CD 3.37Å; T142-P146 WeakPolarHBondContact O-CG 3.17Å
143	E	88.5	Confident	91	Very high	139 Å²	139	48.9 Å²	48.9	65%	0.65	28%	0.28	S	S	*	.	H	α-helix	trans	-61.2	-35.5	173.2	-79.9	172.2	-171.7	0	0	112.8	A139 R140 V141	A139-E143 WeakPolarHBondContact O-CG 3.48Å; A139-E143 PolarHBondContact O-N 2.85Å; R140-E143 IonicContact NH1-OE2 3.75Å; V141-E143 VanDerWaalsContact C-N 3.31Å; V141-E143 PolarHBondContact O-N 3.48Å
144	I	87.9	Confident	91	Very high	104 Å²	104	52.7 Å²	52.7	53%	0.533	30%	0.296	S	S	.	.	H	α-helix	trans	-85.8	-38.3	179.4	-61.6	169.2	0	0	0	110.6	R140 V141 T142 L565	R140-I144 WeakPolarHBondContact O-CG1 3.28Å; V141-I144 PolarHBondContact O-N 3.21Å; V141-I144 VanDerWaalsContact O-N 3.09Å; T142-I144 VanDerWaalsContact C-N 3.28Å; T142-I144 PolarHBondContact O-N 2.98Å; I144-L565 HydrophobicContact CD1-CB 4.21Å; I144-L565 HydrophobicContact CD1-CD2 4.14Å
145	C	87.4	Confident	90.9	Very high	30 Å²	30	55.2 Å²	55.2	20%	0.203	32%	0.324	C	S	.	.			trans	-147.7	94.4	-172.9	178	0	0	0	0	110.4	V141 T142 D147 C148	V141-C145 PolarHBondContact O-N 2.9Å; T142-C145 WeakPolarHBondContact CA-O 3.5Å; T142-C145 CarbonylContact O-C 3.54Å; T142-C145 PolarHBondContact O-N 3.48Å; C145-D147 VanDerWaalsContact C-N 3.26Å; C145-D147 PolarHBondContact O-N 3.4Å; C145-C148 HydrophobicContact CB-CB 3.73Å; C145-C148 WeakPolarHBondContact CB-SG 3.46Å; C145-C148 WeakPolarHBondContact O-CB 3.28Å; C145-C148 PolarHBondContact O-N 2.92Å; C145-C148 WeakPolarHBondContact SG-CB 3.45Å; C145-C148 PolarHBondContact SG-N 3.03Å; C145-C148 VanDerWaalsContact SG-N 3.36Å; C145-C148 CovalentContact SG-SG 2.03Å; C145-C148 PolarHBondContact SG-SG 2.96Å
146	P	85.8	Confident	90.9	Very high	95 Å²	95	55.8 Å²	55.8	62%	0.617	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-30.2	-178.7	-26.7	35.7	0	0	0	114.7	T142	T142-P146 WeakPolarHBondContact O-CA 3.34Å; T142-P146 WeakPolarHBondContact O-CD 3.37Å; T142-P146 WeakPolarHBondContact O-CG 3.17Å
147	D	85.8	Confident	90.9	Very high	116 Å²	116	63.1 Å²	63.1	62%	0.62	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-1	-176.5	-55.5	-40.6	0	0	0	113	C145	C145-D147 VanDerWaalsContact C-N 3.26Å; C145-D147 PolarHBondContact O-N 3.4Å
148	C	90.3	Very high	90.9	Very high	15 Å²	15	65.2 Å²	65.2	10%	0.101	37%	0.372	C	S	.	.	S	Bend	trans	-71.5	145.1	-179.3	-79.6	0	0	0	0	111.7	T103 V141 C145	T103-C148 WeakPolarHBondContact CB-SG 3.43Å; T103-C148 WeakPolarHBondContact O-CB 3.4Å; V141-C148 HydrophobicContact CG1-CB 4.01Å; C145-C148 HydrophobicContact CB-CB 3.73Å; C145-C148 WeakPolarHBondContact CB-SG 3.46Å; C145-C148 WeakPolarHBondContact O-CB 3.28Å; C145-C148 PolarHBondContact O-N 2.92Å; C145-C148 WeakPolarHBondContact SG-CB 3.45Å; C145-C148 PolarHBondContact SG-N 3.03Å; C145-C148 VanDerWaalsContact SG-N 3.36Å; C145-C148 CovalentContact SG-SG 2.03Å; C145-C148 PolarHBondContact SG-SG 2.96Å
149	P	91.6	Very high	91.1	Very high	16 Å²	16	63.3 Å²	63.3	10%	0.104	36%	0.357	C	S	.	.			trans	-69.5	138.7	-176.8	29.2	-33	0	0	0	110.9	M105 A190 Y197	M105-P149 VanDerWaalsContact CG-O 3.29Å; M105-P149 WeakPolarHBondContact CG-O 3.47Å; P149-A190 CarbonylContact C-O 3.54Å; P149-A190 WeakPolarHBondContact CA-O 3.47Å; P149-Y197 HydrophobicContact CB-CE2 4.08Å; P149-Y197 WeakPolarHBondContact CD-OH 3.44Å; P149-Y197 HydrophobicContact CG-CE2 4.42Å
150	T	92.2	Very high	91.3	Very high	44 Å²	44	65 Å²	65	27%	0.27	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	155.6	179	58.6	0	0	0	0	110.6	A138 I152 S189 A190	A138-T150 HydrophobicContact CB-CG2 4.16Å; T150-I152 PolarHBondContact O-N 2.77Å; T150-S189 CarbonylContact O-C 3.59Å; T150-S189 WeakPolarHBondContact O-CA 3.24Å; T150-S189 VanDerWaalsContact O-CB 3.28Å; T150-S189 WeakPolarHBondContact O-CB 3.47Å; T150-A190 PolarHBondContact N-O 2.03Å; T150-A190 PolarHBondContact O-N 2.89Å
151	F	93.3	Very high	91.5	Very high	69 Å²	69	64.1 Å²	64.1	30%	0.303	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	137.4	177.8	-72.5	-56.7	0	0	0	111.8	M105 V107 P135 R187 A188	M105-F151 HydrophobicContact CB-CD2 4.11Å; M105-F151 HydrophobicContact CB-CE1 4.42Å; M105-F151 HydrophobicContact CB-CE2 3.61Å; M105-F151 HydrophobicContact CB-CZ 3.81Å; M105-F151 HydrophobicContact CE-CD2 3.37Å; M105-F151 HydrophobicContact CE-CE2 3.7Å; M105-F151 HydrophobicContact CE-CG 4.31Å; M105-F151 HydrophobicContact CG-CD2 4.42Å; M105-F151 HydrophobicContact CG-CE2 4.38Å; M105-F151 WeakPolarHBondContact O-CZ 3.42Å; V107-F151 HydrophobicContact CG2-CZ 4.39Å; P135-F151 HydrophobicContact CB-CD2 4.07Å; P135-F151 HydrophobicContact CB-CE2 3.47Å; P135-F151 VanDerWaalsContact CB-CE2 3.47Å; P135-F151 HydrophobicContact CB-CZ 4.35Å; F151-R187 HydrophobicContact CE1-CG 3.82Å; F151-R187 VanDerWaalsContact CZ-NH1 3.27Å; F151-A188 WeakPolarHBondContact CA-O 3.48Å
152	I	93.6	Very high	91.7	Very high	45 Å²	45	64 Å²	64	23%	0.231	35%	0.353	C	S	.	.			trans	-125.6	161	174.3	59.8	169.9	0	0	0	110.5	T150 F154 V159 A188 A190 Y198	T150-I152 PolarHBondContact O-N 2.77Å; I152-F154 PolarHBondContact O-N 3.27Å; I152-V159 HydrophobicContact CD1-CG2 3.27Å; I152-V159 HydrophobicContact CG1-CG2 3.84Å; I152-A188 HydrophobicContact CG1-CB 3.97Å; I152-A188 PolarHBondContact N-O 3.09Å; I152-A190 HydrophobicContact CD1-CB 3.91Å; I152-A190 HydrophobicContact CG2-CB 3.88Å; I152-Y198 HydrophobicContact CD1-CD1 3.83Å; I152-Y198 HydrophobicContact CD1-CE1 4.37Å
153	S	93.7	Very high	92.1	Very high	86 Å²	86	61.5 Å²	61.5	60%	0.601	34%	0.337	S	S	*	.			trans	-63	135.2	178.8	178.2	0	0	0	0	111.6	G155 S156	S153-G155 PolarHBondContact O-N 3.26Å; S153-G155 PolarHBondContact OG-N 3.46Å; S153-S156 WeakPolarHBondContact O-CB 3.18Å; S153-S156 PolarHBondContact O-N 3.29Å; S153-S156 VanDerWaalsContact O-N 3.08Å; S153-S156 PolarHBondContact O-OG 2.65Å
154	F	94.7	Very high	92.4	Very high	88 Å²	88	58.5 Å²	58.5	39%	0.386	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-27.4	173.9	-59.1	-14.2	0	0	0	112.1	I152 S156 V159 Q160 I185 L186 A188	I152-F154 PolarHBondContact O-N 3.27Å; F154-S156 VanDerWaalsContact C-N 3.32Å; F154-V159 WeakPolarHBondContact O-CG1 2.97Å; F154-Q160 PolarHBondContact O-NE2 3.15Å; F154-I185 HydrophobicContact CB-CB 4.47Å; F154-I185 HydrophobicContact CB-CD1 4.36Å; F154-I185 HydrophobicContact CB-CG2 4.26Å; F154-I185 HydrophobicContact CD1-CG2 3.78Å; F154-I185 HydrophobicContact CD2-CB 4.28Å; F154-I185 HydrophobicContact CD2-CG2 4.21Å; F154-I185 HydrophobicContact CE1-CG2 4.14Å; F154-I185 WeakPolarHBondContact CE2-O 3.22Å; F154-I185 HydrophobicContact CG-CB 4.24Å; F154-I185 HydrophobicContact CG-CG2 3.83Å; F154-L186 WeakPolarHBondContact CZ-O 3.17Å; F154-A188 HydrophobicContact CD1-CB 3.72Å; F154-A188 HydrophobicContact CE1-CB 4.05Å
155	G	92.8	Very high	92.8	Very high	58 Å²	58	59.6 Å²	59.6	60%	0.598	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	2.8	178.5	0	0	0	0	0	114.7	S153	S153-G155 PolarHBondContact O-N 3.26Å; S153-G155 PolarHBondContact OG-N 3.46Å
156	S	94	Very high	93.2	Very high	34 Å²	34	58.1 Å²	58.1	24%	0.238	32%	0.32	C	S	.	.	S	Bend	trans	-65.9	143.1	176.6	63.6	0	0	0	0	111	S153 F154 Q158 V159 Q160	S153-S156 WeakPolarHBondContact O-CB 3.18Å; S153-S156 PolarHBondContact O-N 3.29Å; S153-S156 VanDerWaalsContact O-N 3.08Å; S153-S156 PolarHBondContact O-OG 2.65Å; F154-S156 VanDerWaalsContact C-N 3.32Å; S156-Q158 PolarHBondContact O-N 3.12Å; S156-V159 PolarHBondContact O-N 2.82Å; S156-V159 VanDerWaalsContact O-N 3.09Å; S156-V159 WeakPolarHBondContact OG-CB 3.31Å; S156-V159 WeakPolarHBondContact OG-CG2 3.21Å; S156-V159 PolarHBondContact OG-N 3.47Å; S156-Q160 WeakPolarHBondContact O-CG 3.2Å; S156-Q160 PolarHBondContact O-N 3.41Å
157	E	93.8	Very high	93.7	Very high	155 Å²	155	54.6 Å²	54.6	72%	0.724	30%	0.295	S	S	*	.	H	α-helix	trans	-55.1	-41.8	-178.1	-175.3	-176.9	169	0	0	111.8	Q160 K161	E157-Q160 PolarHBondContact O-N 3.34Å; E157-K161 WeakPolarHBondContact O-CB 3.5Å; E157-K161 PolarHBondContact O-N 2.84Å
158	Q	92.1	Very high	94	Very high	48 Å²	48	53.5 Å²	53.5	22%	0.224	29%	0.287	C	S	.	.	H	α-helix	trans	-65.7	-40.4	179.7	-59	-61.9	-22.9	0	0	111.8	S156 K161 T162 Y198	S156-Q158 PolarHBondContact O-N 3.12Å; Q158-K161 PolarHBondContact O-N 2.71Å; Q158-T162 WeakPolarHBondContact O-CB 3.5Å; Q158-T162 PolarHBondContact O-N 3.42Å; Q158-T162 PolarHBondContact O-OG1 3.27Å; Q158-Y198 HydrophobicContact CB-CD1 3.69Å; Q158-Y198 HydrophobicContact CB-CD2 4.22Å; Q158-Y198 HydrophobicContact CB-CE1 3.47Å; Q158-Y198 VanDerWaalsContact CB-CE1 3.47Å; Q158-Y198 HydrophobicContact CB-CE2 4.05Å; Q158-Y198 HydrophobicContact CB-CG 4.06Å; Q158-Y198 HydrophobicContact CG-CE1 3.82Å; Q158-Y198 HydrophobicContact CG-CE2 4.12Å
159	V	95.3	Very high	94.2	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.7	-46.3	176	170	0	0	0	0	111.4	I152 F154 S156 K161 T162 V163 I185 A188 V200	I152-V159 HydrophobicContact CD1-CG2 3.27Å; I152-V159 HydrophobicContact CG1-CG2 3.84Å; F154-V159 WeakPolarHBondContact O-CG1 2.97Å; S156-V159 PolarHBondContact O-N 2.82Å; S156-V159 VanDerWaalsContact O-N 3.09Å; S156-V159 WeakPolarHBondContact OG-CB 3.31Å; S156-V159 WeakPolarHBondContact OG-CG2 3.21Å; S156-V159 PolarHBondContact OG-N 3.47Å; V159-K161 VanDerWaalsContact C-N 3.28Å; V159-K161 PolarHBondContact O-N 2.87Å; V159-T162 PolarHBondContact O-N 2.55Å; V159-V163 WeakPolarHBondContact O-CG2 3.22Å; V159-V163 PolarHBondContact O-N 2.79Å; V159-I185 HydrophobicContact CG1-CD1 4.07Å; V159-A188 HydrophobicContact CG1-CB 3.99Å; V159-A188 HydrophobicContact CG2-CB 3.7Å; V159-V200 HydrophobicContact CB-CG2 4.36Å; V159-V200 HydrophobicContact CG1-CG1 4.06Å; V159-V200 HydrophobicContact CG1-CG2 3.94Å; V159-V200 HydrophobicContact CG2-CG2 4.2Å
160	Q	95.9	Very high	94.4	Very high	86 Å²	86	56.1 Å²	56.1	40%	0.402	29%	0.294	S	S	.	.	H	α-helix	trans	-62	-40.4	178.1	-67.6	-63.3	-42.4	0	0	111.3	F154 S156 E157 S164	F154-Q160 PolarHBondContact O-NE2 3.15Å; S156-Q160 WeakPolarHBondContact O-CG 3.2Å; S156-Q160 PolarHBondContact O-N 3.41Å; E157-Q160 PolarHBondContact O-N 3.34Å; Q160-S164 WeakPolarHBondContact O-CB 3.43Å; Q160-S164 PolarHBondContact O-N 3.18Å
161	K	93.9	Very high	94.5	Very high	59 Å²	59	55.1 Å²	55.1	26%	0.257	29%	0.287	S	S	.	.	H	α-helix	trans	-62.9	-48.8	174.3	-176.7	-178.8	177.2	-173.6	0	111.7	E157 Q158 V159 V163 S164 R165 E246	E157-K161 WeakPolarHBondContact O-CB 3.5Å; E157-K161 PolarHBondContact O-N 2.84Å; Q158-K161 PolarHBondContact O-N 2.71Å; V159-K161 VanDerWaalsContact C-N 3.28Å; V159-K161 PolarHBondContact O-N 2.87Å; K161-V163 VanDerWaalsContact C-N 3.34Å; K161-V163 PolarHBondContact O-N 3.05Å; K161-S164 PolarHBondContact O-N 3.32Å; K161-R165 HydrophobicContact CG-CG 4.29Å; K161-R165 WeakPolarHBondContact O-CB 3.26Å; K161-R165 VanDerWaalsContact O-CG 3.31Å; K161-R165 WeakPolarHBondContact O-CG 3.49Å; K161-R165 PolarHBondContact O-N 2.85Å; K161-E246 WeakPolarHBondContact CE-OE2 3.45Å; K161-E246 IonicContact NZ-OE1 3.25Å; K161-E246 PolarHBondContact NZ-OE1 2.64Å; K161-E246 IonicContact NZ-OE2 2.6Å; K161-E246 PolarHBondContact NZ-OE2 3.42Å
162	T	95.2	Very high	94.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-54.4	-51.8	176.6	-59.6	0	0	0	0	110.2	Q158 V159 S164 R165 S166 V200 A236 L238	Q158-T162 WeakPolarHBondContact O-CB 3.5Å; Q158-T162 PolarHBondContact O-N 3.42Å; Q158-T162 PolarHBondContact O-OG1 3.27Å; V159-T162 PolarHBondContact O-N 2.55Å; T162-S164 PolarHBondContact O-N 3.42Å; T162-R165 PolarHBondContact O-N 3.33Å; T162-S166 VanDerWaalsContact O-CB 3.23Å; T162-S166 WeakPolarHBondContact O-CB 3.16Å; T162-S166 PolarHBondContact O-N 2.89Å; T162-S166 PolarHBondContact O-OG 2.73Å; T162-V200 HydrophobicContact CG2-CB 4.29Å; T162-V200 HydrophobicContact CG2-CG2 3.81Å; T162-A236 HydrophobicContact CG2-CB 3.91Å; T162-L238 HydrophobicContact CG2-CB 3.91Å; T162-L238 VanDerWaalsContact OG1-CB 3.29Å; T162-L238 WeakPolarHBondContact OG1-CB 3.35Å; T162-L238 WeakPolarHBondContact OG1-CD2 3.41Å
163	V	97	Very high	94.3	Very high	4 Å²	4	61.6 Å²	61.6	2%	0.024	32%	0.321	C	S	.	.	H	α-helix	trans	-61.5	-46	-179.2	174.8	0	0	0	0	112.1	V159 K161 R165 S166 L167 L182 I185 V200 Y202	V159-V163 WeakPolarHBondContact O-CG2 3.22Å; V159-V163 PolarHBondContact O-N 2.79Å; K161-V163 VanDerWaalsContact C-N 3.34Å; K161-V163 PolarHBondContact O-N 3.05Å; V163-R165 PolarHBondContact O-N 3.24Å; V163-S166 WeakPolarHBondContact CA-OG 3.3Å; V163-S166 PolarHBondContact O-OG 2.97Å; V163-S166 VanDerWaalsContact O-OG 3.14Å; V163-L167 WeakPolarHBondContact O-CB 3.47Å; V163-L167 PolarHBondContact O-N 3.07Å; V163-L182 HydrophobicContact CG1-CD1 3.72Å; V163-L182 HydrophobicContact CG1-CD2 3.75Å; V163-L182 HydrophobicContact CG1-CG 4.2Å; V163-I185 HydrophobicContact CG2-CD1 4.03Å; V163-I185 HydrophobicContact CG2-CG1 4.21Å; V163-V200 HydrophobicContact CG2-CB 4.21Å; V163-V200 HydrophobicContact CG2-CG1 3.54Å; V163-Y202 HydrophobicContact CG1-CD1 4.44Å; V163-Y202 HydrophobicContact CG1-CD2 4.45Å; V163-Y202 HydrophobicContact CG1-CE1 4.48Å; V163-Y202 HydrophobicContact CG1-CG 4.42Å; V163-Y202 HydrophobicContact CG2-CD1 3.97Å; V163-Y202 HydrophobicContact CG2-CE1 4.29Å; V163-Y202 HydrophobicContact CG2-CG 4.48Å
164	S	95.3	Very high	94.1	Very high	76 Å²	76	59.3 Å²	59.3	53%	0.531	31%	0.305	S	S	.	.	H	α-helix	trans	-62.4	-45.8	-179	-172.5	0	0	0	0	111.4	Q160 K161 T162 E168	Q160-S164 WeakPolarHBondContact O-CB 3.43Å; Q160-S164 PolarHBondContact O-N 3.18Å; K161-S164 PolarHBondContact O-N 3.32Å; T162-S164 PolarHBondContact O-N 3.42Å; S164-E168 WeakPolarHBondContact O-CB 3.47Å; S164-E168 PolarHBondContact O-N 3.49Å; S164-E168 VanDerWaalsContact O-N 3.08Å
165	R	94.9	Very high	93.8	Very high	127 Å²	127	57.3 Å²	57.3	48%	0.479	31%	0.31	S	S	.	.	H	α-helix	trans	-72.2	-39.8	-178.1	-69	-61.4	-164.6	178.5	6.9	112.1	K161 T162 V163 E168 K169 I248	K161-R165 HydrophobicContact CG-CG 4.29Å; K161-R165 WeakPolarHBondContact O-CB 3.26Å; K161-R165 VanDerWaalsContact O-CG 3.31Å; K161-R165 WeakPolarHBondContact O-CG 3.49Å; K161-R165 PolarHBondContact O-N 2.85Å; T162-R165 PolarHBondContact O-N 3.33Å; V163-R165 PolarHBondContact O-N 3.24Å; R165-E168 IonicContact NH1-OE2 3.15Å; R165-E168 PolarHBondContact NH1-OE2 3.27Å; R165-E168 PolarHBondContact O-N 3.06Å; R165-K169 WeakPolarHBondContact O-CB 3.4Å; R165-K169 PolarHBondContact O-N 2.94Å; R165-I248 HydrophobicContact CB-CD1 3.3Å
166	S	96.5	Very high	93.6	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-68.8	-39	179.8	60.6	0	0	0	0	111.1	T162 V163 K169 F170 Y202 A236	T162-S166 VanDerWaalsContact O-CB 3.23Å; T162-S166 WeakPolarHBondContact O-CB 3.16Å; T162-S166 PolarHBondContact O-N 2.89Å; T162-S166 PolarHBondContact O-OG 2.73Å; V163-S166 WeakPolarHBondContact CA-OG 3.3Å; V163-S166 PolarHBondContact O-OG 2.97Å; V163-S166 VanDerWaalsContact O-OG 3.14Å; S166-K169 PolarHBondContact O-N 2.89Å; S166-F170 WeakPolarHBondContact O-CB 3.41Å; S166-F170 PolarHBondContact O-N 3.26Å; S166-Y202 WeakPolarHBondContact CB-OH 3.23Å; S166-Y202 WeakPolarHBondContact OG-CE1 3.42Å; S166-Y202 PolarHBondContact OG-OH 3.34Å; S166-A236 VanDerWaalsContact CB-CB 3.46Å; S166-A236 WeakPolarHBondContact OG-CB 3.38Å
167	L	95.8	Very high	93.3	Very high	21 Å²	21	61.4 Å²	61.4	11%	0.11	32%	0.315	C	S	.	.	H	α-helix	trans	-68.3	-41.3	176	-176.7	59.1	0	0	0	112.2	V163 F170 N171 F180 L182 I204	V163-L167 WeakPolarHBondContact O-CB 3.47Å; V163-L167 PolarHBondContact O-N 3.07Å; L167-F170 PolarHBondContact O-N 3.03Å; L167-N171 WeakPolarHBondContact O-CB 3.44Å; L167-N171 PolarHBondContact O-N 3.26Å; L167-N171 PolarHBondContact O-ND2 3.12Å; L167-F180 HydrophobicContact CD1-CB 4.26Å; L167-L182 HydrophobicContact CD2-CB 4.22Å; L167-I204 HydrophobicContact CD1-CG2 3.91Å
168	E	93.2	Very high	93.1	Very high	93 Å²	93	56.1 Å²	56.1	44%	0.435	29%	0.292	S	S	.	.	H	α-helix	trans	-58.3	-49.1	173.2	-179.4	178.8	-159	0	0	110.8	S164 R165 F170 N171 N172	S164-E168 WeakPolarHBondContact O-CB 3.47Å; S164-E168 PolarHBondContact O-N 3.49Å; S164-E168 VanDerWaalsContact O-N 3.08Å; R165-E168 IonicContact NH1-OE2 3.15Å; R165-E168 PolarHBondContact NH1-OE2 3.27Å; R165-E168 PolarHBondContact O-N 3.06Å; E168-F170 PolarHBondContact O-N 3.47Å; E168-N171 PolarHBondContact O-N 2.87Å; E168-N172 VanDerWaalsContact O-CG 3.22Å; E168-N172 PolarHBondContact O-N 3.48Å; E168-N172 VanDerWaalsContact O-N 3.09Å; E168-N172 PolarHBondContact O-ND2 3.42Å
169	K	94.3	Very high	93.1	Very high	62 Å²	62	55.4 Å²	55.4	27%	0.27	29%	0.288	S	S	.	.	H	α-helix	trans	-57.1	-49.9	175.8	-177.4	171.4	176.8	172.6	0	111.9	R165 S166 N171 N172 E173 I248 V250	R165-K169 WeakPolarHBondContact O-CB 3.4Å; R165-K169 PolarHBondContact O-N 2.94Å; S166-K169 PolarHBondContact O-N 2.89Å; K169-N171 PolarHBondContact O-N 2.96Å; K169-N172 PolarHBondContact O-N 3.19Å; K169-E173 WeakPolarHBondContact CE-OE1 3.39Å; K169-E173 WeakPolarHBondContact CE-OE2 3.29Å; K169-E173 HydrophobicContact CG-CG 4.38Å; K169-E173 WeakPolarHBondContact CG-OE2 3.28Å; K169-E173 WeakPolarHBondContact O-CB 3.21Å; K169-E173 WeakPolarHBondContact O-CG 3.1Å; K169-E173 PolarHBondContact O-N 3.21Å; K169-I248 HydrophobicContact CD-CG2 3.96Å; K169-I248 PolarHBondContact NZ-O 3.25Å; K169-V250 HydrophobicContact CB-CG1 4.27Å; K169-V250 HydrophobicContact CD-CG1 4.17Å; K169-V250 HydrophobicContact CG-CG1 4.13Å
170	F	94.8	Very high	93.1	Very high	23 Å²	23	55.7 Å²	55.7	10%	0.101	29%	0.289	C	S	.	.	H	α-helix	trans	-60.5	-44.7	178.9	178.7	-102.1	0	0	0	112.5	S166 L167 E168 N172 E173 S174 L176 F180 I204 V250 C252 I254	S166-F170 WeakPolarHBondContact O-CB 3.41Å; S166-F170 PolarHBondContact O-N 3.26Å; L167-F170 PolarHBondContact O-N 3.03Å; E168-F170 PolarHBondContact O-N 3.47Å; F170-N172 PolarHBondContact O-N 2.99Å; F170-E173 PolarHBondContact O-N 2.89Å; F170-S174 WeakPolarHBondContact O-CB 3.19Å; F170-S174 PolarHBondContact O-N 2.77Å; F170-S174 PolarHBondContact O-OG 3.23Å; F170-L176 HydrophobicContact CE1-CD1 4.25Å; F170-L176 HydrophobicContact CZ-CD1 3.88Å; F170-F180 AromaticContact CE1-CD2 3.85Å; F170-F180 HydrophobicContact CE1-CD2 3.85Å; F170-F180 HydrophobicContact CE1-CE2 4.28Å; F170-F180 HydrophobicContact CE1-CG 4.29Å; F170-I204 HydrophobicContact CD1-CD1 4.2Å; F170-I204 HydrophobicContact CE1-CD1 3.84Å; F170-V250 HydrophobicContact CB-CG1 4.22Å; F170-V250 HydrophobicContact CB-CG2 4.38Å; F170-C252 HydrophobicContact CD2-CB 3.79Å; F170-C252 HydrophobicContact CE1-CB 4.31Å; F170-C252 HydrophobicContact CE2-CB 3.49Å; F170-C252 VanDerWaalsContact CE2-CB 3.49Å; F170-C252 HydrophobicContact CG-CB 4.33Å; F170-C252 HydrophobicContact CZ-CB 3.78Å; F170-I254 HydrophobicContact CE1-CD1 4.13Å; F170-I254 HydrophobicContact CZ-CD1 3.82Å; F170-I254 HydrophobicContact CZ-CG1 4.1Å
171	N	93.6	Very high	93	Very high	23 Å²	23	52.6 Å²	52.6	12%	0.123	28%	0.278	C	S	.	.	H	α-helix	trans	-64.4	-29.3	179.2	-80.7	-25.9	0	0	0	113.1	L167 E168 K169 F180	L167-N171 WeakPolarHBondContact O-CB 3.44Å; L167-N171 PolarHBondContact O-N 3.26Å; L167-N171 PolarHBondContact O-ND2 3.12Å; E168-N171 PolarHBondContact O-N 2.87Å; K169-N171 PolarHBondContact O-N 2.96Å; N171-F180 PolarHBondContact ND2-O 2.94Å; N171-F180 PolarHBondContact OD1-N 3.4Å
172	N	91.2	Very high	93.1	Very high	114 Å²	114	52.7 Å²	52.7	61%	0.61	28%	0.281	S	S	*	.	H	α-helix	trans	-83	-36.7	177.8	-67.4	-21.3	0	0	0	112.4	E168 K169 F170	E168-N172 VanDerWaalsContact O-CG 3.22Å; E168-N172 PolarHBondContact O-N 3.48Å; E168-N172 VanDerWaalsContact O-N 3.09Å; E168-N172 PolarHBondContact O-ND2 3.42Å; K169-N172 PolarHBondContact O-N 3.19Å; F170-N172 PolarHBondContact O-N 2.99Å
173	E	92.6	Very high	93	Very high	136 Å²	136	56.5 Å²	56.5	64%	0.636	30%	0.301	S	S	*	.	H	α-helix	trans	-102.2	-19.3	-169.3	-65	177.8	-172.7	0	0	114.5	K169 F170 G175	K169-E173 WeakPolarHBondContact CE-OE1 3.39Å; K169-E173 WeakPolarHBondContact CE-OE2 3.29Å; K169-E173 HydrophobicContact CG-CG 4.38Å; K169-E173 WeakPolarHBondContact CG-OE2 3.28Å; K169-E173 WeakPolarHBondContact O-CB 3.21Å; K169-E173 WeakPolarHBondContact O-CG 3.1Å; K169-E173 PolarHBondContact O-N 3.21Å; F170-E173 PolarHBondContact O-N 2.89Å; E173-G175 PolarHBondContact O-N 2.94Å; E173-G175 VanDerWaalsContact O-N 3.13Å
174	S	89.4	Confident	92.9	Very high	38 Å²	38	60.8 Å²	60.8	27%	0.266	32%	0.32	S	S	.	.	S	Bend	trans	-65.3	-18	-173.4	58.8	0	0	0	0	115.1	F170 L176	F170-S174 WeakPolarHBondContact O-CB 3.19Å; F170-S174 PolarHBondContact O-N 2.77Å; F170-S174 PolarHBondContact O-OG 3.23Å; S174-L176 PolarHBondContact O-N 2.95Å
175	G	87.3	Confident	92.9	Very high	46 Å²	46	57.9 Å²	57.9	47%	0.474	30%	0.298	S	S	.	.			trans	74.5	-5.9	-175.3	0	0	0	0	0	114.7	E173 K211	E173-G175 PolarHBondContact O-N 2.94Å; E173-G175 VanDerWaalsContact O-N 3.13Å; G175-K211 PolarHBondContact O-NZ 3.44Å
176	L	89.6	Confident	93	Very high	65 Å²	65	53 Å²	53	34%	0.34	28%	0.281	S	S	.	.			trans	-68.7	149.8	-179.3	-61.4	171.7	0	0	0	112.2	F170 S174 F180 K211 I254	F170-L176 HydrophobicContact CE1-CD1 4.25Å; F170-L176 HydrophobicContact CZ-CD1 3.88Å; S174-L176 PolarHBondContact O-N 2.95Å; L176-F180 HydrophobicContact CB-CE2 4.23Å; L176-F180 HydrophobicContact CD1-CD2 4.37Å; L176-F180 HydrophobicContact CD1-CE2 3.42Å; L176-F180 VanDerWaalsContact CD1-CE2 3.42Å; L176-F180 HydrophobicContact CD1-CZ 3.88Å; L176-F180 HydrophobicContact CG-CE2 4.44Å; L176-K211 WeakPolarHBondContact O-CE 3.38Å; L176-I254 HydrophobicContact CD1-CG1 3.97Å
177	N	87.3	Confident	92.9	Very high	113 Å²	113	53.7 Å²	53.7	60%	0.604	28%	0.284	S	S	*	.	S	Bend	trans	-69.2	-46.9	-175.8	-75.3	-18	0	0	0	112.3	G210 K211	N177-G210 CarbonylContact O-C 3.52Å; N177-G210 WeakPolarHBondContact O-CA 3.43Å; N177-K211 PolarHBondContact O-N 2.67Å
178	N	90.3	Very high	92.9	Very high	45 Å²	45	52.7 Å²	52.7	24%	0.241	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	148.5	180	-64.6	-36.4	0	0	0	111.1	F180 E206 C209	N178-F180 WeakPolarHBondContact O-CE2 3.45Å; N178-E206 HydrophobicContact CB-CG 3.69Å; N178-E206 VanDerWaalsContact CB-OE1 3.31Å; N178-E206 WeakPolarHBondContact CB-OE1 3.07Å; N178-E206 PolarHBondContact ND2-OE1 3.47Å; N178-C209 CarbonylContact C-O 3.53Å; N178-C209 VanDerWaalsContact CA-O 3.26Å; N178-C209 WeakPolarHBondContact CA-O 3.33Å; N178-C209 WeakPolarHBondContact CB-O 3.21Å
179	H	91.9	Very high	93	Very high	32 Å²	32	48.8 Å²	48.8	15%	0.148	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	156.8	172	-63.5	-51.8	0	0	0	110.4	T207 C209 Q214	H179-T207 WeakPolarHBondContact O-CB 2.96Å; H179-T207 WeakPolarHBondContact O-CG2 3.31Å; H179-T207 PolarHBondContact O-N 3.15Å; H179-T207 PolarHBondContact O-OG1 3.11Å; H179-C209 PolarHBondContact N-O 3.36Å; H179-Q214 PolarHBondContact NE2-NE2 2.81Å
180	F	94.2	Very high	93	Very high	6 Å²	6	46.3 Å²	46.3	3%	0.026	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	146	177.4	-69.1	-99.5	0	0	0	110.8	L167 F170 N171 L176 N178 I204 Q205 E206 H230 I254	L167-F180 HydrophobicContact CD1-CB 4.26Å; F170-F180 AromaticContact CE1-CD2 3.85Å; F170-F180 HydrophobicContact CE1-CD2 3.85Å; F170-F180 HydrophobicContact CE1-CE2 4.28Å; F170-F180 HydrophobicContact CE1-CG 4.29Å; N171-F180 PolarHBondContact ND2-O 2.94Å; N171-F180 PolarHBondContact OD1-N 3.4Å; L176-F180 HydrophobicContact CB-CE2 4.23Å; L176-F180 HydrophobicContact CD1-CD2 4.37Å; L176-F180 HydrophobicContact CD1-CE2 3.42Å; L176-F180 VanDerWaalsContact CD1-CE2 3.42Å; L176-F180 HydrophobicContact CD1-CZ 3.88Å; L176-F180 HydrophobicContact CG-CE2 4.44Å; N178-F180 WeakPolarHBondContact O-CE2 3.45Å; F180-I204 HydrophobicContact CB-CB 4.12Å; F180-I204 HydrophobicContact CB-CD1 3.8Å; F180-I204 HydrophobicContact CB-CG1 4.34Å; F180-I204 HydrophobicContact CD1-CB 4.4Å; F180-I204 HydrophobicContact CD1-CD1 3.73Å; F180-I204 HydrophobicContact CD1-CG1 4Å; F180-I204 HydrophobicContact CG-CD1 3.79Å; F180-I204 HydrophobicContact CG-CG1 4.44Å; F180-Q205 WeakPolarHBondContact CA-O 3.44Å; F180-E206 HydrophobicContact CD1-CB 4.21Å; F180-E206 HydrophobicContact CE1-CB 3.85Å; F180-E206 HydrophobicContact CE1-CG 4.43Å; F180-E206 HydrophobicContact CZ-CB 4.32Å; F180-E206 HydrophobicContact CZ-CG 4.42Å; F180-H230 HydrophobicContact CE1-CB 4.06Å; F180-H230 HydrophobicContact CZ-CB 4.32Å; F180-I254 HydrophobicContact CD1-CD1 4.39Å; F180-I254 HydrophobicContact CE1-CD1 3.92Å; F180-I254 HydrophobicContact CE1-CG2 4.31Å; F180-I254 HydrophobicContact CZ-CD1 4.02Å; F180-I254 HydrophobicContact CZ-CG1 4.38Å; F180-I254 HydrophobicContact CZ-CG2 4.19Å
181	A	94.4	Very high	92.7	Very high	21 Å²	21	45.6 Å²	45.6	17%	0.174	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	150.9	172.9	0	0	0	0	0	110.5	L183 I204 Q205 T207 I223	A181-L183 PolarHBondContact O-N 2.96Å; A181-I204 CarbonylContact O-C 3.48Å; A181-I204 WeakPolarHBondContact O-CA 3.47Å; A181-I204 WeakPolarHBondContact O-CB 3.41Å; A181-Q205 PolarHBondContact N-O 3.27Å; A181-Q205 PolarHBondContact O-N 2.87Å; A181-T207 HydrophobicContact CB-CG2 3.53Å; A181-I223 HydrophobicContact CB-CD1 4.49Å; A181-I223 HydrophobicContact CB-CG1 4.08Å
182	L	95.6	Very high	92.2	Very high	61 Å²	61	50.4 Å²	50.4	32%	0.319	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	125.6	171.1	176.7	67.9	0	0	0	109.9	V163 L167 I185 Y202	V163-L182 HydrophobicContact CG1-CD1 3.72Å; V163-L182 HydrophobicContact CG1-CD2 3.75Å; V163-L182 HydrophobicContact CG1-CG 4.2Å; L167-L182 HydrophobicContact CD2-CB 4.22Å; L182-I185 HydrophobicContact CD1-CG1 4.25Å; L182-I185 HydrophobicContact CD2-CG1 4.35Å; L182-Y202 HydrophobicContact CD1-CD2 3.58Å; L182-Y202 HydrophobicContact CD1-CE2 4.49Å; L182-Y202 HydrophobicContact CD1-CG 3.88Å
183	L	93.4	Very high	91.6	Very high	80 Å²	80	48.4 Å²	48.4	42%	0.419	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-57.9	171.8	-179.7	63.5	0	0	0	110.3	A181 T203	A181-L183 PolarHBondContact O-N 2.96Å; L183-T203 WeakPolarHBondContact CB-O 3.34Å; L183-T203 PolarHBondContact N-O 2.75Å
184	K	94.8	Very high	91	Very high	94 Å²	94	50.8 Å²	50.8	41%	0.409	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	139.3	-178.3	-169.1	175.7	177.7	-179.4	0	112.6	D51 L186 Y202 T203	D51-K184 IonicContact OD1-NZ 3.41Å; D51-K184 IonicContact OD2-NZ 2.65Å; D51-K184 PolarHBondContact OD2-NZ 3.31Å; K184-L186 HydrophobicContact CB-CD2 4.48Å; K184-L186 HydrophobicContact CD-CD2 4.04Å; K184-L186 HydrophobicContact CG-CD2 4.18Å; K184-Y202 CarbonylContact O-C 3.53Å; K184-Y202 VanDerWaalsContact O-CA 3.24Å; K184-Y202 WeakPolarHBondContact O-CA 3.06Å; K184-Y202 WeakPolarHBondContact O-CB 3.46Å; K184-T203 PolarHBondContact N-O 2.62Å; K184-T203 PolarHBondContact N-OG1 3.02Å; K184-T203 PolarHBondContact O-N 2.89Å; K184-T203 PolarHBondContact O-OG1 2.66Å
185	I	96.7	Very high	90.7	Very high	15 Å²	15	51.6 Å²	51.6	8%	0.077	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	122.7	167.2	-57.9	172.6	0	0	0	107.9	F154 V159 V163 L182 V200	F154-I185 HydrophobicContact CB-CB 4.47Å; F154-I185 HydrophobicContact CB-CD1 4.36Å; F154-I185 HydrophobicContact CB-CG2 4.26Å; F154-I185 HydrophobicContact CD1-CG2 3.78Å; F154-I185 HydrophobicContact CD2-CB 4.28Å; F154-I185 HydrophobicContact CD2-CG2 4.21Å; F154-I185 HydrophobicContact CE1-CG2 4.14Å; F154-I185 WeakPolarHBondContact CE2-O 3.22Å; F154-I185 HydrophobicContact CG-CB 4.24Å; F154-I185 HydrophobicContact CG-CG2 3.83Å; V159-I185 HydrophobicContact CG1-CD1 4.07Å; V163-I185 HydrophobicContact CG2-CD1 4.03Å; V163-I185 HydrophobicContact CG2-CG1 4.21Å; L182-I185 HydrophobicContact CD1-CG1 4.25Å; L182-I185 HydrophobicContact CD2-CG1 4.35Å; I185-V200 HydrophobicContact CG2-CG1 3.85Å
186	L	95.1	Very high	90.6	Very high	24 Å²	24	53.1 Å²	53.1	13%	0.126	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-36	-179.2	-61.9	-173.9	0	0	0	111.6	D51 Y53 F154 K184 E201 T203 F233	D51-L186 WeakPolarHBondContact OD1-CD2 3.43Å; Y53-L186 HydrophobicContact CE2-CB 3.83Å; Y53-L186 HydrophobicContact CE2-CD1 4.33Å; Y53-L186 WeakPolarHBondContact OH-CB 3.4Å; F154-L186 WeakPolarHBondContact CZ-O 3.17Å; K184-L186 HydrophobicContact CB-CD2 4.48Å; K184-L186 HydrophobicContact CD-CD2 4.04Å; K184-L186 HydrophobicContact CG-CD2 4.18Å; L186-E201 PolarHBondContact N-O 2.86Å; L186-T203 HydrophobicContact CD1-CG2 3.74Å; L186-T203 HydrophobicContact CG-CG2 4.21Å; L186-F233 HydrophobicContact CD1-CD2 4.29Å; L186-F233 HydrophobicContact CD1-CE2 4.02Å
187	R	95.6	Very high	90.7	Very high	15 Å²	15	52 Å²	52	6%	0.057	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	137.2	-173.5	-161.6	-178.8	178.6	80.5	12.3	110.7	Y53 E83 Q104 M105 F151 V200 E201	Y53-R187 HydrophobicContact CE2-CB 4.45Å; Y53-R187 WeakPolarHBondContact OH-CB 3.36Å; E83-R187 IonicContact OE1-NH1 3.43Å; E83-R187 PolarHBondContact OE1-NH1 2.94Å; Q104-R187 PolarHBondContact O-NH2 3.02Å; M105-R187 PolarHBondContact O-NH2 2.94Å; F151-R187 HydrophobicContact CE1-CG 3.82Å; F151-R187 VanDerWaalsContact CZ-NH1 3.27Å; R187-V200 CarbonylContact O-C 3.59Å; R187-V200 WeakPolarHBondContact O-CA 3.38Å; R187-V200 WeakPolarHBondContact O-CG1 3.36Å; R187-E201 HydrophobicContact CB-CB 4.02Å; R187-E201 HydrophobicContact CB-CG 4.31Å; R187-E201 PolarHBondContact N-O 3.22Å; R187-E201 VanDerWaalsContact N-O 3.11Å; R187-E201 PolarHBondContact O-N 3.15Å
188	A	96.4	Very high	91	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	131.5	173.1	0	0	0	0	0	109.8	F151 I152 F154 V159 N199 V200	F151-A188 WeakPolarHBondContact CA-O 3.48Å; I152-A188 HydrophobicContact CG1-CB 3.97Å; I152-A188 PolarHBondContact N-O 3.09Å; F154-A188 HydrophobicContact CD1-CB 3.72Å; F154-A188 HydrophobicContact CE1-CB 4.05Å; V159-A188 HydrophobicContact CG1-CB 3.99Å; V159-A188 HydrophobicContact CG2-CB 3.7Å; A188-N199 WeakPolarHBondContact CA-O 3.39Å; A188-V200 HydrophobicContact CB-CG1 4.5Å
189	S	94.9	Very high	91.2	Very high	12 Å²	12	48.2 Å²	48.2	8%	0.084	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	148.2	179.1	62.1	0	0	0	0	111.2	T150 N199	T150-S189 CarbonylContact O-C 3.59Å; T150-S189 WeakPolarHBondContact O-CA 3.24Å; T150-S189 VanDerWaalsContact O-CB 3.28Å; T150-S189 WeakPolarHBondContact O-CB 3.47Å; S189-N199 PolarHBondContact N-O 3.13Å; S189-N199 PolarHBondContact O-N 3.36Å
190	A	92.9	Very high	91.5	Very high	10 Å²	10	46.7 Å²	46.7	8%	0.083	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	143.4	171.3	0	0	0	0	0	110.4	P149 T150 I152 M196 Y197 Y198	P149-A190 CarbonylContact C-O 3.54Å; P149-A190 WeakPolarHBondContact CA-O 3.47Å; T150-A190 PolarHBondContact N-O 2.03Å; T150-A190 PolarHBondContact O-N 2.89Å; I152-A190 HydrophobicContact CD1-CB 3.91Å; I152-A190 HydrophobicContact CG2-CB 3.88Å; A190-M196 HydrophobicContact CB-CE 4.31Å; A190-Y197 VanDerWaalsContact CA-O 3.3Å; A190-Y197 WeakPolarHBondContact CA-O 3.49Å; A190-Y198 HydrophobicContact CB-CD1 3.77Å; A190-Y198 HydrophobicContact CB-CE1 3.89Å
191	G	89.1	Confident	91.7	Very high	7 Å²	7	47.6 Å²	47.6	7%	0.072	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	172	173.2	0	0	0	0	0	111	Y197	G191-Y197 PolarHBondContact N-O 2.61Å; G191-Y197 VanDerWaalsContact N-O 3.12Å; G191-Y197 WeakPolarHBondContact O-CD1 3.39Å; G191-Y197 PolarHBondContact O-N 2.82Å; G191-Y197 VanDerWaalsContact O-N 3.09Å
192	M	83.8	Confident	91.8	Very high	125 Å²	125	46.6 Å²	46.6	62%	0.616	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.2	176.3	-172.1	172.2	-176.6	0	0	108.3	M196	M192-M196 HydrophobicContact CB-SD 4.13Å; M192-M196 HydrophobicContact CG-SD 4.34Å
193	A	79.3	Confident	91.8	Very high	71 Å²	71	44 Å²	44	59%	0.587	23%	0.229	S	C	*	.	S	Bend	trans	-124.7	-118.2	168.3	0	0	0	0	0	108.2	D195 Y197	A193-D195 VanDerWaalsContact C-N 3.34Å; A193-D195 PolarHBondContact N-O 3.03Å; A193-D195 VanDerWaalsContact N-O 3.12Å; A193-Y197 HydrophobicContact CB-CD1 4.07Å; A193-Y197 HydrophobicContact CB-CE1 3.94Å
194	M	78.8	Confident	91.9	Very high	186 Å²	186	40.1 Å²	40.1	92%	0.916	21%	0.21	S	C	*	.	S	Bend	trans	-68.8	-37.8	167.9	-68.5	-168.6	-73.2	0	0	111.6
195	D	83.3	Confident	91.9	Very high	55 Å²	55	36.9 Å²	36.9	29%	0.294	20%	0.196	S	C	.	.	S	Bend	trans	-132.4	170.9	172.7	-72.9	-59.4	0	0	0	109.4	A193 Y197 I239 N240	A193-D195 VanDerWaalsContact C-N 3.34Å; A193-D195 PolarHBondContact N-O 3.03Å; A193-D195 VanDerWaalsContact N-O 3.12Å; D195-Y197 PolarHBondContact O-N 2.87Å; D195-I239 HydrophobicContact CB-CG2 4.01Å; D195-N240 WeakPolarHBondContact CB-O 3.17Å
196	M	86.4	Confident	91.7	Very high	78 Å²	78	37.1 Å²	37.1	38%	0.384	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	127.4	171.3	-73.1	-64.6	-61.2	0	0	109.6	A190 M192 Y198 N240	A190-M196 HydrophobicContact CB-CE 4.31Å; M192-M196 HydrophobicContact CB-SD 4.13Å; M192-M196 HydrophobicContact CG-SD 4.34Å; M196-Y198 HydrophobicContact CB-CE2 4.25Å; M196-N240 PolarHBondContact O-N 2.79Å
197	Y	90.6	Very high	91.5	Very high	41 Å²	41	36 Å²	36	16%	0.161	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	146.5	175.2	67.8	-87.9	0	0	0	111.4	P149 A190 G191 A193 D195 N199 L238	P149-Y197 HydrophobicContact CB-CE2 4.08Å; P149-Y197 WeakPolarHBondContact CD-OH 3.44Å; P149-Y197 HydrophobicContact CG-CE2 4.42Å; A190-Y197 VanDerWaalsContact CA-O 3.3Å; A190-Y197 WeakPolarHBondContact CA-O 3.49Å; G191-Y197 PolarHBondContact N-O 2.61Å; G191-Y197 VanDerWaalsContact N-O 3.12Å; G191-Y197 WeakPolarHBondContact O-CD1 3.39Å; G191-Y197 PolarHBondContact O-N 2.82Å; G191-Y197 VanDerWaalsContact O-N 3.09Å; A193-Y197 HydrophobicContact CB-CD1 4.07Å; A193-Y197 HydrophobicContact CB-CE1 3.94Å; D195-Y197 PolarHBondContact O-N 2.87Å; Y197-N199 WeakPolarHBondContact CE2-ND2 3.4Å; Y197-L238 CarbonylContact C-O 3.5Å; Y197-L238 VanDerWaalsContact CA-O 3.25Å; Y197-L238 WeakPolarHBondContact CA-O 3.35Å
198	Y	93.7	Very high	91.2	Very high	29 Å²	29	37.8 Å²	37.8	11%	0.114	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	117.2	-178.1	-56.7	-90.2	0	0	0	109.2	I152 Q158 A190 M196 S237 L238	I152-Y198 HydrophobicContact CD1-CD1 3.83Å; I152-Y198 HydrophobicContact CD1-CE1 4.37Å; Q158-Y198 HydrophobicContact CB-CD1 3.69Å; Q158-Y198 HydrophobicContact CB-CD2 4.22Å; Q158-Y198 HydrophobicContact CB-CE1 3.47Å; Q158-Y198 VanDerWaalsContact CB-CE1 3.47Å; Q158-Y198 HydrophobicContact CB-CE2 4.05Å; Q158-Y198 HydrophobicContact CB-CG 4.06Å; Q158-Y198 HydrophobicContact CG-CE1 3.82Å; Q158-Y198 HydrophobicContact CG-CE2 4.12Å; A190-Y198 HydrophobicContact CB-CD1 3.77Å; A190-Y198 HydrophobicContact CB-CE1 3.89Å; M196-Y198 HydrophobicContact CB-CE2 4.25Å; Y198-S237 CarbonylContact O-C 3.52Å; Y198-S237 VanDerWaalsContact O-CA 3.31Å; Y198-S237 WeakPolarHBondContact O-CA 3.5Å; Y198-L238 HydrophobicContact CD2-CD2 4.46Å; Y198-L238 PolarHBondContact N-O 2.82Å; Y198-L238 PolarHBondContact O-N 3.5Å
199	N	95.4	Very high	90.8	Very high	51 Å²	51	38 Å²	38	27%	0.273	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.3	174.6	-63.2	-31.5	0	0	0	109.1	A188 S189 Y197 A236 S237	A188-N199 WeakPolarHBondContact CA-O 3.39Å; S189-N199 PolarHBondContact N-O 3.13Å; S189-N199 PolarHBondContact O-N 3.36Å; Y197-N199 WeakPolarHBondContact CE2-ND2 3.4Å; N199-A236 CarbonylContact C-O 3.58Å; N199-A236 WeakPolarHBondContact CA-O 3.4Å; N199-S237 WeakPolarHBondContact OD1-CB 3.21Å; N199-S237 PolarHBondContact OD1-OG 3.35Å
200	V	97.3	Very high	90.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	132.5	178.8	-167.3	0	0	0	0	109.5	V159 T162 V163 I185 R187 A188 Y202 A236	V159-V200 HydrophobicContact CB-CG2 4.36Å; V159-V200 HydrophobicContact CG1-CG1 4.06Å; V159-V200 HydrophobicContact CG1-CG2 3.94Å; V159-V200 HydrophobicContact CG2-CG2 4.2Å; T162-V200 HydrophobicContact CG2-CB 4.29Å; T162-V200 HydrophobicContact CG2-CG2 3.81Å; V163-V200 HydrophobicContact CG2-CB 4.21Å; V163-V200 HydrophobicContact CG2-CG1 3.54Å; I185-V200 HydrophobicContact CG2-CG1 3.85Å; R187-V200 CarbonylContact O-C 3.59Å; R187-V200 WeakPolarHBondContact O-CA 3.38Å; R187-V200 WeakPolarHBondContact O-CG1 3.36Å; A188-V200 HydrophobicContact CB-CG1 4.5Å; V200-Y202 HydrophobicContact CG1-CD1 4.13Å; V200-A236 PolarHBondContact N-O 3.28Å; V200-A236 PolarHBondContact O-N 2.89Å
201	E	97.6	Very high	89.5	Confident	24 Å²	24	41.4 Å²	41.4	11%	0.112	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128	173.4	-51.4	-177.7	-178.3	0	0	109.1	Y53 R100 L186 R187 F233 C234 K235	Y53-E201 WeakPolarHBondContact CE1-OE2 3.14Å; Y53-E201 WeakPolarHBondContact OH-CB 2.99Å; Y53-E201 PolarHBondContact OH-OE2 2.88Å; R100-E201 IonicContact CZ-OE1 2.79Å; R100-E201 IonicContact CZ-OE2 3.15Å; R100-E201 IonicContact NH1-OE1 2.81Å; R100-E201 PolarHBondContact NH1-OE1 3.08Å; R100-E201 IonicContact NH1-OE2 3.13Å; R100-E201 VanDerWaalsContact NH2-CD 3.33Å; R100-E201 IonicContact NH2-OE1 2.73Å; R100-E201 PolarHBondContact NH2-OE1 3.21Å; R100-E201 VanDerWaalsContact NH2-OE1 3.15Å; R100-E201 IonicContact NH2-OE2 2.81Å; R100-E201 PolarHBondContact NH2-OE2 3.47Å; L186-E201 PolarHBondContact N-O 2.86Å; R187-E201 HydrophobicContact CB-CB 4.02Å; R187-E201 HydrophobicContact CB-CG 4.31Å; R187-E201 PolarHBondContact N-O 3.22Å; R187-E201 VanDerWaalsContact N-O 3.11Å; R187-E201 PolarHBondContact O-N 3.15Å; E201-F233 HydrophobicContact CB-CE2 3.88Å; E201-F233 HydrophobicContact CB-CZ 3.81Å; E201-F233 HydrophobicContact CG-CZ 4.32Å; E201-F233 WeakPolarHBondContact OE2-CZ 3.25Å; E201-C234 VanDerWaalsContact CA-O 3.28Å; E201-C234 WeakPolarHBondContact CA-O 3.36Å; E201-K235 HydrophobicContact CG-CG 4.18Å
202	Y	97.3	Very high	88.8	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	154.2	-172.3	59.8	-88.7	0	0	0	111.6	V163 S166 L182 K184 V200 I204 C234 A236	V163-Y202 HydrophobicContact CG1-CD1 4.44Å; V163-Y202 HydrophobicContact CG1-CD2 4.45Å; V163-Y202 HydrophobicContact CG1-CE1 4.48Å; V163-Y202 HydrophobicContact CG1-CG 4.42Å; V163-Y202 HydrophobicContact CG2-CD1 3.97Å; V163-Y202 HydrophobicContact CG2-CE1 4.29Å; V163-Y202 HydrophobicContact CG2-CG 4.48Å; S166-Y202 WeakPolarHBondContact CB-OH 3.23Å; S166-Y202 WeakPolarHBondContact OG-CE1 3.42Å; S166-Y202 PolarHBondContact OG-OH 3.34Å; L182-Y202 HydrophobicContact CD1-CD2 3.58Å; L182-Y202 HydrophobicContact CD1-CE2 4.49Å; L182-Y202 HydrophobicContact CD1-CG 3.88Å; K184-Y202 CarbonylContact O-C 3.53Å; K184-Y202 VanDerWaalsContact O-CA 3.24Å; K184-Y202 WeakPolarHBondContact O-CA 3.06Å; K184-Y202 WeakPolarHBondContact O-CB 3.46Å; V200-Y202 HydrophobicContact CG1-CD1 4.13Å; Y202-I204 HydrophobicContact CD2-CG2 3.62Å; Y202-I204 HydrophobicContact CE2-CG2 3.48Å; Y202-I204 VanDerWaalsContact CE2-CG2 3.48Å; Y202-C234 HydrophobicContact CD1-CB 4.27Å; Y202-C234 HydrophobicContact CD2-CB 3.98Å; Y202-C234 HydrophobicContact CE1-CB 3.86Å; Y202-C234 HydrophobicContact CE2-CB 3.52Å; Y202-C234 HydrophobicContact CG-CB 4.33Å; Y202-C234 VanDerWaalsContact CZ-CB 3.44Å; Y202-C234 PolarHBondContact N-O 2.91Å; Y202-C234 PolarHBondContact O-N 3.09Å; Y202-A236 HydrophobicContact CE1-CB 3.86Å
203	T	96.4	Very high	88.6	Confident	6 Å²	6	51.9 Å²	51.9	4%	0.037	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	147.8	173.4	55.5	0	0	0	0	110.5	I89 L183 K184 L186 G232 F233	I89-T203 HydrophobicContact CD1-CG2 3.88Å; L183-T203 WeakPolarHBondContact CB-O 3.34Å; L183-T203 PolarHBondContact N-O 2.75Å; K184-T203 PolarHBondContact N-O 2.62Å; K184-T203 PolarHBondContact N-OG1 3.02Å; K184-T203 PolarHBondContact O-N 2.89Å; K184-T203 PolarHBondContact O-OG1 2.66Å; L186-T203 HydrophobicContact CD1-CG2 3.74Å; L186-T203 HydrophobicContact CG-CG2 4.21Å; T203-G232 CarbonylContact C-O 3.34Å; T203-G232 VanDerWaalsContact CA-O 3.26Å; T203-G232 WeakPolarHBondContact CA-O 3.12Å; T203-F233 HydrophobicContact CG2-CD2 4.28Å
204	I	95.1	Very high	88.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	154.3	177.6	58.3	171.8	0	0	0	110.1	L167 F170 F180 A181 Y202 K231 G232 C234 C252 I254	L167-I204 HydrophobicContact CD1-CG2 3.91Å; F170-I204 HydrophobicContact CD1-CD1 4.2Å; F170-I204 HydrophobicContact CE1-CD1 3.84Å; F180-I204 HydrophobicContact CB-CB 4.12Å; F180-I204 HydrophobicContact CB-CD1 3.8Å; F180-I204 HydrophobicContact CB-CG1 4.34Å; F180-I204 HydrophobicContact CD1-CB 4.4Å; F180-I204 HydrophobicContact CD1-CD1 3.73Å; F180-I204 HydrophobicContact CD1-CG1 4Å; F180-I204 HydrophobicContact CG-CD1 3.79Å; F180-I204 HydrophobicContact CG-CG1 4.44Å; A181-I204 CarbonylContact O-C 3.48Å; A181-I204 WeakPolarHBondContact O-CA 3.47Å; A181-I204 WeakPolarHBondContact O-CB 3.41Å; Y202-I204 HydrophobicContact CD2-CG2 3.62Å; Y202-I204 HydrophobicContact CE2-CG2 3.48Å; Y202-I204 VanDerWaalsContact CE2-CG2 3.48Å; I204-K231 CarbonylContact O-C 3.37Å; I204-K231 WeakPolarHBondContact O-CA 3.48Å; I204-G232 PolarHBondContact N-O 3.01Å; I204-G232 PolarHBondContact O-N 2.86Å; I204-C234 WeakPolarHBondContact CD1-SG 3.29Å; I204-C252 HydrophobicContact CD1-CB 4.4Å; I204-I254 HydrophobicContact CD1-CD1 3.73Å; I204-I254 HydrophobicContact CG1-CD1 4.47Å
205	Q	93.7	Very high	88.1	Confident	25 Å²	25	47.2 Å²	47.2	12%	0.117	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.9	174.4	-170.7	170.2	2.8	0	0	109.8	F180 A181 I223 M224 S229 K231	F180-Q205 WeakPolarHBondContact CA-O 3.44Å; A181-Q205 PolarHBondContact N-O 3.27Å; A181-Q205 PolarHBondContact O-N 2.87Å; Q205-I223 HydrophobicContact CB-CG2 4.04Å; Q205-I223 HydrophobicContact CG-CG2 3.65Å; Q205-M224 PolarHBondContact NE2-O 3.09Å; Q205-M224 VanDerWaalsContact NE2-O 3.09Å; Q205-S229 PolarHBondContact NE2-OG 3.49Å; Q205-K231 HydrophobicContact CG-CG 4.34Å
206	E	92.7	Very high	87.5	Confident	20 Å²	20	48.4 Å²	48.4	9%	0.093	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	146.1	177.2	-170.1	172	-157.8	0	0	111.6	N178 F180 M224 H230	N178-E206 HydrophobicContact CB-CG 3.69Å; N178-E206 VanDerWaalsContact CB-OE1 3.31Å; N178-E206 WeakPolarHBondContact CB-OE1 3.07Å; N178-E206 PolarHBondContact ND2-OE1 3.47Å; F180-E206 HydrophobicContact CD1-CB 4.21Å; F180-E206 HydrophobicContact CE1-CB 3.85Å; F180-E206 HydrophobicContact CE1-CG 4.43Å; F180-E206 HydrophobicContact CZ-CB 4.32Å; F180-E206 HydrophobicContact CZ-CG 4.42Å; E206-M224 HydrophobicContact CG-CE 4.49Å; E206-M224 VanDerWaalsContact O-CB 3.31Å; E206-M224 WeakPolarHBondContact O-CB 3.24Å; E206-M224 PolarHBondContact O-N 3.12Å; E206-H230 HydrophobicContact CB-CB 4.23Å; E206-H230 WeakPolarHBondContact CB-O 3.3Å; E206-H230 PolarHBondContact N-O 2.87Å; E206-H230 IonicContact OE1-ND1 3.69Å; E206-H230 WeakPolarHBondContact OE2-CB 3.19Å; E206-H230 IonicContact OE2-CE1 3.84Å; E206-H230 IonicContact OE2-CG 3.45Å; E206-H230 PolarHBondContact OE2-N 3.38Å; E206-H230 IonicContact OE2-ND1 2.77Å; E206-H230 PolarHBondContact OE2-ND1 2.83Å
207	T	91.8	Very high	86.7	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	165.2	-179.1	72.1	0	0	0	0	111	H179 A181 C209 C221 P222	H179-T207 WeakPolarHBondContact O-CB 2.96Å; H179-T207 WeakPolarHBondContact O-CG2 3.31Å; H179-T207 PolarHBondContact O-N 3.15Å; H179-T207 PolarHBondContact O-OG1 3.11Å; A181-T207 HydrophobicContact CB-CG2 3.53Å; T207-C209 PolarHBondContact O-N 2.85Å; T207-C209 PolarHBondContact OG1-N 3.02Å; T207-C209 PolarHBondContact OG1-O 2.55Å; T207-C221 WeakPolarHBondContact CB-SG 3.19Å; T207-C221 HydrophobicContact CG2-CB 4.41Å; T207-C221 PolarHBondContact OG1-SG 3.44Å; T207-C221 VanDerWaalsContact OG1-SG 3.33Å; T207-P222 WeakPolarHBondContact CA-O 3.34Å; T207-P222 VanDerWaalsContact CB-O 3.29Å; T207-P222 WeakPolarHBondContact CB-O 3.33Å
208	V	88.8	Confident	85.6	Confident	52 Å²	52	52.3 Å²	52.3	32%	0.315	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	-3.1	175.9	-58.4	0	0	0	0	113.4	K213 P222 M224	V208-K213 WeakPolarHBondContact O-CD 3.17Å; V208-P222 HydrophobicContact CG2-CB 4.03Å; V208-P222 HydrophobicContact CG2-CG 4.17Å; V208-P222 PolarHBondContact N-O 3.44Å; V208-P222 VanDerWaalsContact N-O 3.12Å; V208-M224 HydrophobicContact CG1-CB 4.23Å; V208-M224 HydrophobicContact CG1-CE 4.35Å; V208-M224 HydrophobicContact CG1-CG 4.36Å
209	C	87.7	Confident	84.8	Confident	4 Å²	4	57 Å²	57	3%	0.027	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	150.4	176.2	-51.3	0	0	0	0	109.4	N178 H179 T207 K213 C221	N178-C209 CarbonylContact C-O 3.53Å; N178-C209 VanDerWaalsContact CA-O 3.26Å; N178-C209 WeakPolarHBondContact CA-O 3.33Å; N178-C209 WeakPolarHBondContact CB-O 3.21Å; H179-C209 PolarHBondContact N-O 3.36Å; T207-C209 PolarHBondContact O-N 2.85Å; T207-C209 PolarHBondContact OG1-N 3.02Å; T207-C209 PolarHBondContact OG1-O 2.55Å; C209-K213 CarbonylContact C-O 3.56Å; C209-K213 WeakPolarHBondContact CA-O 3.32Å; C209-K213 WeakPolarHBondContact CB-O 3.39Å; C209-C221 VanDerWaalsContact CA-SG 3.57Å; C209-C221 HydrophobicContact CB-CB 3.77Å; C209-C221 WeakPolarHBondContact CB-SG 3.5Å; C209-C221 PolarHBondContact N-SG 2.92Å; C209-C221 WeakPolarHBondContact SG-CB 3.27Å; C209-C221 CovalentContact SG-SG 2Å; C209-C221 PolarHBondContact SG-SG 3.09Å
210	G	82.4	Confident	84	Confident	3 Å²	3	64 Å²	64	3%	0.031	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	-172.5	177	0	0	0	0	0	110.4	N177 Y212 K213 Q214	N177-G210 CarbonylContact O-C 3.52Å; N177-G210 WeakPolarHBondContact O-CA 3.43Å; G210-Y212 PolarHBondContact O-N 3.12Å; G210-K213 PolarHBondContact N-O 3.15Å; G210-K213 CarbonylContact O-C 3.44Å; G210-K213 PolarHBondContact O-N 2.84Å; G210-K213 VanDerWaalsContact O-O 3.06Å; G210-Q214 PolarHBondContact O-NE2 3.15Å
211	K	77.8	Confident	83.4	Confident	91 Å²	91	65.3 Å²	65.3	40%	0.396	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-42.3	-176.7	-65.2	-178.7	-176.1	163.4	0	112.7	G175 L176 N177 Q214	G175-K211 PolarHBondContact O-NZ 3.44Å; L176-K211 WeakPolarHBondContact O-CE 3.38Å; N177-K211 PolarHBondContact O-N 2.67Å; K211-Q214 PolarHBondContact O-NE2 3.35Å
212	Y	75.9	Confident	82.9	Confident	214 Å²	214	67.9 Å²	67.9	84%	0.839	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-6.9	-176	-50.8	-74.4	0	0	0	114.1	G210	G210-Y212 PolarHBondContact O-N 3.12Å
213	K	78.2	Confident	82.5	Confident	138 Å²	138	71 Å²	71	60%	0.6	39%	0.387	S	S	*	.	B	Isolated β-bridge	trans	-130.8	92.5	-176.3	-172.8	174.5	176.9	-174.8	0	109.1	V208 C209 G210	V208-K213 WeakPolarHBondContact O-CD 3.17Å; C209-K213 CarbonylContact C-O 3.56Å; C209-K213 WeakPolarHBondContact CA-O 3.32Å; C209-K213 WeakPolarHBondContact CB-O 3.39Å; G210-K213 PolarHBondContact N-O 3.15Å; G210-K213 CarbonylContact O-C 3.44Å; G210-K213 PolarHBondContact O-N 2.84Å; G210-K213 VanDerWaalsContact O-O 3.06Å
214	Q	74.5	Confident	82	Confident	118 Å²	118	72.7 Å²	72.7	55%	0.551	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-90	150.5	-179	-63.8	-59.8	-34.5	0	0	111	H179 G210 K211	H179-Q214 PolarHBondContact NE2-NE2 2.81Å; G210-Q214 PolarHBondContact O-NE2 3.15Å; K211-Q214 PolarHBondContact O-NE2 3.35Å
215	P	73.3	Confident	81.3	Confident	40 Å²	40	79.1 Å²	79.1	26%	0.26	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-66.4	158.3	173	29.2	-33.4	0	0	0	110.8	C221	P215-C221 HydrophobicContact CB-CB 4.46Å; P215-C221 HydrophobicContact CG-CB 4.44Å
216	P	71.4	Confident	80.5	Confident	80 Å²	80	80.3 Å²	80.3	52%	0.519	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-52.8	146.9	169.9	-22.6	32.8	0	0	0	111.6	G218 E219	P216-G218 PolarHBondContact O-N 2.97Å; P216-G218 VanDerWaalsContact O-N 3.09Å; P216-E219 HydrophobicContact CB-CB 4.49Å; P216-E219 HydrophobicContact CB-CG 4.45Å; P216-E219 PolarHBondContact O-N 2.66Å
217	A	69.1	Low	79.5	Confident	110 Å²	110	86.3 Å²	86.3	91%	0.909	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	117.3	-176.1	0	0	0	0	0	111.6
218	G	66.7	Low	78.8	Confident	91 Å²	91	90.4 Å²	90.4	94%	0.938	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.9	-0.3	179.8	0	0	0	0	0	115.3	P216	P216-G218 PolarHBondContact O-N 2.97Å; P216-G218 VanDerWaalsContact O-N 3.09Å
219	E	77	Confident	78.6	Confident	128 Å²	128	88.1 Å²	88.1	60%	0.598	48%	0.478	S	S	*	.			trans	-104.6	144.2	177.6	-67.2	-176.8	-163.6	0	0	112.4	P216	P216-E219 HydrophobicContact CB-CB 4.49Å; P216-E219 HydrophobicContact CB-CG 4.45Å; P216-E219 PolarHBondContact O-N 2.66Å
220	K	79.3	Confident	78.7	Confident	197 Å²	197	90.7 Å²	90.7	86%	0.857	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-74.4	141.1	171.4	-68	-175.9	179.3	-176.8	0	109.1
221	C	84.7	Confident	79.2	Confident	29 Å²	29	93.4 Å²	93.4	20%	0.196	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-63.4	131.4	177	-171.1	0	0	0	0	111.9	T207 C209 P215	T207-C221 WeakPolarHBondContact CB-SG 3.19Å; T207-C221 HydrophobicContact CG2-CB 4.41Å; T207-C221 PolarHBondContact OG1-SG 3.44Å; T207-C221 VanDerWaalsContact OG1-SG 3.33Å; C209-C221 VanDerWaalsContact CA-SG 3.57Å; C209-C221 HydrophobicContact CB-CB 3.77Å; C209-C221 WeakPolarHBondContact CB-SG 3.5Å; C209-C221 PolarHBondContact N-SG 2.92Å; C209-C221 WeakPolarHBondContact SG-CB 3.27Å; C209-C221 CovalentContact SG-SG 2Å; C209-C221 PolarHBondContact SG-SG 3.09Å; P215-C221 HydrophobicContact CB-CB 4.46Å; P215-C221 HydrophobicContact CG-CB 4.44Å
222	P	87	Confident	80	Confident	78 Å²	78	89.1 Å²	89.1	51%	0.506	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-63.2	137	173.9	-21.9	33.1	0	0	0	112.8	T207 V208	T207-P222 WeakPolarHBondContact CA-O 3.34Å; T207-P222 VanDerWaalsContact CB-O 3.29Å; T207-P222 WeakPolarHBondContact CB-O 3.33Å; V208-P222 HydrophobicContact CG2-CB 4.03Å; V208-P222 HydrophobicContact CG2-CG 4.17Å; V208-P222 PolarHBondContact N-O 3.44Å; V208-P222 VanDerWaalsContact N-O 3.12Å
223	I	89.2	Confident	81	Confident	65 Å²	65	79.1 Å²	79.1	33%	0.333	44%	0.442	S	S	.	.	B	Isolated β-bridge	trans	-65.5	138.7	171.8	-63	-179.2	0	0	0	109.3	A181 Q205 T225	A181-I223 HydrophobicContact CB-CD1 4.49Å; A181-I223 HydrophobicContact CB-CG1 4.08Å; Q205-I223 HydrophobicContact CB-CG2 4.04Å; Q205-I223 HydrophobicContact CG-CG2 3.65Å; I223-T225 PolarHBondContact O-N 3.16Å
224	M	86.4	Confident	81.9	Confident	41 Å²	41	72.5 Å²	72.5	20%	0.202	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-75	118.2	174	-169.2	177.7	-66.4	0	0	109.3	Q205 E206 V208 C226 S229	Q205-M224 PolarHBondContact NE2-O 3.09Å; Q205-M224 VanDerWaalsContact NE2-O 3.09Å; E206-M224 HydrophobicContact CG-CE 4.49Å; E206-M224 VanDerWaalsContact O-CB 3.31Å; E206-M224 WeakPolarHBondContact O-CB 3.24Å; E206-M224 PolarHBondContact O-N 3.12Å; V208-M224 HydrophobicContact CG1-CB 4.23Å; V208-M224 HydrophobicContact CG1-CE 4.35Å; V208-M224 HydrophobicContact CG1-CG 4.36Å; M224-C226 HydrophobicContact CG-CB 4.43Å; M224-C226 PolarHBondContact SD-SG 3.04Å; M224-S229 VanDerWaalsContact O-CB 3.32Å; M224-S229 WeakPolarHBondContact O-CB 3.48Å; M224-S229 PolarHBondContact O-OG 3.41Å
225	T	79.9	Confident	83	Confident	135 Å²	135	70.2 Å²	70.2	83%	0.828	40%	0.402	S	S	*	.			trans	-93.8	7.9	-175.8	59	0	0	0	0	113.8	I223	I223-T225 PolarHBondContact O-N 3.16Å
226	C	76.1	Confident	84.1	Confident	50 Å²	50	68.6 Å²	68.6	34%	0.338	39%	0.391	S	S	.	.	S	Bend	trans	-71.8	151.6	178.4	72.5	0	0	0	0	111	M224 F228 S229	M224-C226 HydrophobicContact CG-CB 4.43Å; M224-C226 PolarHBondContact SD-SG 3.04Å; C226-F228 PolarHBondContact O-N 3.14Å; C226-F228 VanDerWaalsContact O-N 3.16Å; C226-S229 VanDerWaalsContact O-CB 3.29Å; C226-S229 WeakPolarHBondContact O-CB 3.33Å; C226-S229 PolarHBondContact O-N 3.38Å; C226-S229 PolarHBondContact O-OG 2.9Å; C226-S229 PolarHBondContact SG-N 3.3Å
227	E	71.8	Confident	85.2	Confident	147 Å²	147	66.3 Å²	66.3	69%	0.687	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.5	177.7	-160.6	178.3	165.4	0	0	112.5	Q257 A259	E227-Q257 WeakPolarHBondContact O-CB 3.29Å; E227-Q257 WeakPolarHBondContact O-CG 3.31Å; E227-A259 HydrophobicContact CB-CB 4.17Å; E227-A259 HydrophobicContact CG-CB 3.62Å
228	F	76.8	Confident	86.4	Confident	88 Å²	88	61.1 Å²	61.1	39%	0.386	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-2.6	176.9	-52	-78.8	0	0	0	113.7	C226 H230 A259 A260 E263	C226-F228 PolarHBondContact O-N 3.14Å; C226-F228 VanDerWaalsContact O-N 3.16Å; F228-H230 PolarHBondContact O-N 3.25Å; F228-A259 HydrophobicContact CD1-CB 3.91Å; F228-A259 VanDerWaalsContact CE1-C 3.5Å; F228-A259 HydrophobicContact CE1-CB 3.63Å; F228-A259 HydrophobicContact CZ-CB 4.2Å; F228-A260 HydrophobicContact CD1-CB 3.87Å; F228-E263 WeakPolarHBondContact CE1-OE2 3.41Å; F228-E263 WeakPolarHBondContact CZ-OE2 3.04Å
229	S	84.8	Confident	87.4	Confident	4 Å²	4	59.6 Å²	59.6	3%	0.028	30%	0.304	C	S	.	.			trans	-63.6	125.5	-175.8	57.6	0	0	0	0	111	Q205 M224 C226 K231 Q257	Q205-S229 PolarHBondContact NE2-OG 3.49Å; M224-S229 VanDerWaalsContact O-CB 3.32Å; M224-S229 WeakPolarHBondContact O-CB 3.48Å; M224-S229 PolarHBondContact O-OG 3.41Å; C226-S229 VanDerWaalsContact O-CB 3.29Å; C226-S229 WeakPolarHBondContact O-CB 3.33Å; C226-S229 PolarHBondContact O-N 3.38Å; C226-S229 PolarHBondContact O-OG 2.9Å; C226-S229 PolarHBondContact SG-N 3.3Å; S229-K231 PolarHBondContact O-N 2.78Å; S229-Q257 WeakPolarHBondContact O-CG 3.36Å
230	H	91	Very high	87.6	Confident	58 Å²	58	55.4 Å²	55.4	27%	0.269	29%	0.286	S	S	.	.			trans	-64.9	136.1	-178.3	-63.4	103.9	0	0	0	110.7	F180 E206 F228 I254	F180-H230 HydrophobicContact CE1-CB 4.06Å; F180-H230 HydrophobicContact CZ-CB 4.32Å; E206-H230 HydrophobicContact CB-CB 4.23Å; E206-H230 WeakPolarHBondContact CB-O 3.3Å; E206-H230 PolarHBondContact N-O 2.87Å; E206-H230 IonicContact OE1-ND1 3.69Å; E206-H230 WeakPolarHBondContact OE2-CB 3.19Å; E206-H230 IonicContact OE2-CE1 3.84Å; E206-H230 IonicContact OE2-CG 3.45Å; E206-H230 PolarHBondContact OE2-N 3.38Å; E206-H230 IonicContact OE2-ND1 2.77Å; E206-H230 PolarHBondContact OE2-ND1 2.83Å; F228-H230 PolarHBondContact O-N 3.25Å; H230-I254 HydrophobicContact CB-CG2 3.74Å
231	K	92.8	Very high	87.3	Confident	60 Å²	60	48.3 Å²	48.3	26%	0.261	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	146.7	169.7	-66.5	178.8	-176	159.3	0	108.9	I89 I204 Q205 S229 Y255	I89-K231 HydrophobicContact CD1-CB 4.24Å; I204-K231 CarbonylContact O-C 3.37Å; I204-K231 WeakPolarHBondContact O-CA 3.48Å; Q205-K231 HydrophobicContact CG-CG 4.34Å; S229-K231 PolarHBondContact O-N 2.78Å; K231-Y255 PolarHBondContact N-O 2.93Å; K231-Y255 PolarHBondContact O-N 3.24Å
232	G	94.1	Very high	86.1	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	160.6	177.9	0	0	0	0	0	112.6	I89 T203 I204 E253	I89-G232 WeakPolarHBondContact CD1-O 3.28Å; T203-G232 CarbonylContact C-O 3.34Å; T203-G232 VanDerWaalsContact CA-O 3.26Å; T203-G232 WeakPolarHBondContact CA-O 3.12Å; I204-G232 PolarHBondContact N-O 3.01Å; I204-G232 PolarHBondContact O-N 2.86Å; G232-E253 CarbonylContact C-O 3.5Å; G232-E253 WeakPolarHBondContact CA-O 3.4Å
233	F	96.8	Very high	84.6	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.018	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	121.8	171.8	176.9	-114.7	0	0	0	109.4	Y53 I89 L186 E201 T203 K235 C252 E253 Y255	Y53-F233 AromaticContact CE1-CE2 3.99Å; Y53-F233 HydrophobicContact CE1-CE2 3.99Å; Y53-F233 AromaticContact CE1-CZ 3.65Å; Y53-F233 HydrophobicContact CE1-CZ 3.65Å; I89-F233 HydrophobicContact CD1-CB 4.17Å; L186-F233 HydrophobicContact CD1-CD2 4.29Å; L186-F233 HydrophobicContact CD1-CE2 4.02Å; E201-F233 HydrophobicContact CB-CE2 3.88Å; E201-F233 HydrophobicContact CB-CZ 3.81Å; E201-F233 HydrophobicContact CG-CZ 4.32Å; E201-F233 WeakPolarHBondContact OE2-CZ 3.25Å; T203-F233 HydrophobicContact CG2-CD2 4.28Å; F233-K235 HydrophobicContact CE1-CG 4.09Å; F233-K235 HydrophobicContact CZ-CG 4.38Å; F233-C252 WeakPolarHBondContact O-CA 3.28Å; F233-E253 PolarHBondContact N-O 3.37Å; F233-E253 PolarHBondContact O-N 3.41Å; F233-Y255 HydrophobicContact CB-CE2 3.79Å
234	C	97.8	Very high	83	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	140.9	-175.5	-62.4	0	0	0	0	111.5	E201 Y202 I204 E251 C252	E201-C234 VanDerWaalsContact CA-O 3.28Å; E201-C234 WeakPolarHBondContact CA-O 3.36Å; Y202-C234 HydrophobicContact CD1-CB 4.27Å; Y202-C234 HydrophobicContact CD2-CB 3.98Å; Y202-C234 HydrophobicContact CE1-CB 3.86Å; Y202-C234 HydrophobicContact CE2-CB 3.52Å; Y202-C234 HydrophobicContact CG-CB 4.33Å; Y202-C234 VanDerWaalsContact CZ-CB 3.44Å; Y202-C234 PolarHBondContact N-O 2.91Å; Y202-C234 PolarHBondContact O-N 3.09Å; I204-C234 WeakPolarHBondContact CD1-SG 3.29Å; C234-E251 CarbonylContact C-O 3.52Å; C234-E251 VanDerWaalsContact CA-O 3.27Å; C234-E251 WeakPolarHBondContact CA-O 3.36Å; C234-C252 HydrophobicContact CB-CB 4.09Å; C234-C252 WeakPolarHBondContact CB-SG 3.31Å; C234-C252 WeakPolarHBondContact SG-CB 2.9Å; C234-C252 CovalentContact SG-SG 2.04Å; C234-C252 PolarHBondContact SG-SG 3.01Å
235	K	97.3	Very high	81.8	Confident	70 Å²	70	58.9 Å²	58.9	30%	0.304	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	118.7	166.6	-61.7	178.8	-176.2	167	0	107.7	E201 F233 V250 E251	E201-K235 HydrophobicContact CG-CG 4.18Å; F233-K235 HydrophobicContact CE1-CG 4.09Å; F233-K235 HydrophobicContact CZ-CG 4.38Å; K235-V250 WeakPolarHBondContact O-CA 3.38Å; K235-E251 PolarHBondContact N-O 2.91Å; K235-E251 PolarHBondContact O-N 2.97Å
236	A	96.9	Very high	81.4	Confident	5 Å²	5	56.7 Å²	56.7	4%	0.041	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	144.7	178.3	0	0	0	0	0	110.9	T162 S166 N199 V200 Y202 S249 V250	T162-A236 HydrophobicContact CG2-CB 3.91Å; S166-A236 VanDerWaalsContact CB-CB 3.46Å; S166-A236 WeakPolarHBondContact OG-CB 3.38Å; N199-A236 CarbonylContact C-O 3.58Å; N199-A236 WeakPolarHBondContact CA-O 3.4Å; V200-A236 PolarHBondContact N-O 3.28Å; V200-A236 PolarHBondContact O-N 2.89Å; Y202-A236 HydrophobicContact CE1-CB 3.86Å; A236-S249 CarbonylContact C-O 3.59Å; A236-S249 VanDerWaalsContact CA-O 3.24Å; A236-S249 WeakPolarHBondContact CA-O 3.26Å; A236-V250 HydrophobicContact CB-CG2 4.46Å
237	S	94.8	Very high	81.7	Confident	32 Å²	32	58.9 Å²	58.9	22%	0.224	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	131.7	173.2	-163.8	0	0	0	0	109.5	Y198 N199 I248 S249	Y198-S237 CarbonylContact O-C 3.52Å; Y198-S237 VanDerWaalsContact O-CA 3.31Å; Y198-S237 WeakPolarHBondContact O-CA 3.5Å; N199-S237 WeakPolarHBondContact OD1-CB 3.21Å; N199-S237 PolarHBondContact OD1-OG 3.35Å; S237-I248 WeakPolarHBondContact O-CA 3.49Å; S237-S249 PolarHBondContact N-O 3.42Å; S237-S249 PolarHBondContact O-N 3.06Å
238	L	92.4	Very high	82.7	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.8	174.6	177.7	70	0	0	0	108.9	T162 Y197 Y198 E246 I248	T162-L238 HydrophobicContact CG2-CB 3.91Å; T162-L238 VanDerWaalsContact OG1-CB 3.29Å; T162-L238 WeakPolarHBondContact OG1-CB 3.35Å; T162-L238 WeakPolarHBondContact OG1-CD2 3.41Å; Y197-L238 CarbonylContact C-O 3.5Å; Y197-L238 VanDerWaalsContact CA-O 3.25Å; Y197-L238 WeakPolarHBondContact CA-O 3.35Å; Y198-L238 HydrophobicContact CD2-CD2 4.46Å; Y198-L238 PolarHBondContact N-O 2.82Å; Y198-L238 PolarHBondContact O-N 3.5Å; L238-E246 HydrophobicContact CD1-CB 4.02Å; L238-I248 HydrophobicContact CD1-CB 4.14Å; L238-I248 HydrophobicContact CD1-CD1 4.43Å; L238-I248 HydrophobicContact CD1-CG1 4.42Å
239	I	89.4	Confident	83.5	Confident	60 Å²	60	52.2 Å²	52.2	31%	0.308	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120.4	174.6	-55.1	175.6	0	0	0	108.7	D195 T241 D247	D195-I239 HydrophobicContact CB-CG2 4.01Å; I239-T241 HydrophobicContact CG2-CG2 4.09Å; I239-T241 PolarHBondContact O-N 2.73Å; I239-T241 VanDerWaalsContact O-N 3.09Å; I239-D247 PolarHBondContact N-O 3.18Å
240	N	79.9	Confident	84.1	Confident	40 Å²	40	53.3 Å²	53.3	21%	0.214	32%	0.316	C	S	.	.			trans	-80.7	88.7	178.9	-78.8	1.5	0	0	0	110.4	D195 M196	D195-N240 WeakPolarHBondContact CB-O 3.17Å; M196-N240 PolarHBondContact O-N 2.79Å
241	T	72.6	Confident	84.4	Confident	47 Å²	47	56.9 Å²	56.9	29%	0.288	33%	0.333	S	S	.	.			trans	-85.1	133.5	175.3	56.2	0	0	0	0	110.7	I239 A243 D245	I239-T241 HydrophobicContact CG2-CG2 4.09Å; I239-T241 PolarHBondContact O-N 2.73Å; I239-T241 VanDerWaalsContact O-N 3.09Å; T241-A243 PolarHBondContact O-N 2.92Å; T241-D245 PolarHBondContact OG1-O 2.84Å
242	P	60	Low	84.5	Confident	117 Å²	117	55.1 Å²	55.1	76%	0.76	33%	0.328	S	S	*	.	S	Bend	trans	-68.4	-12	178.2	-21.7	32.3	0	0	0	114.8
243	A	56.1	Low	84.6	Confident	85 Å²	85	57.8 Å²	57.8	70%	0.702	34%	0.34	S	S	*	.	S	Bend	trans	-110.7	71.6	-172.6	0	0	0	0	0	111.5	T241 D245	T241-A243 PolarHBondContact O-N 2.92Å; A243-D245 PolarHBondContact O-N 2.83Å
244	A	54.4	Low	84.5	Confident	95 Å²	95	60.3 Å²	60.3	79%	0.785	35%	0.353	S	S	*	.	S	Bend	trans	65.7	-5.6	153.7	0	0	0	0	0	121.7
245	D	63	Low	84.1	Confident	139 Å²	139	61.5 Å²	61.5	74%	0.743	36%	0.358	S	S	*	.			trans	-141.5	111.9	164.3	-78.1	-47.7	0	0	0	110.3	T241 A243 D247	T241-D245 PolarHBondContact OG1-O 2.84Å; A243-D245 PolarHBondContact O-N 2.83Å; D245-D247 PolarHBondContact O-N 3.03Å
246	E	69.7	Low	83.5	Confident	88 Å²	88	63 Å²	63	41%	0.411	37%	0.366	S	S	.	.			trans	-63.7	118.3	172.7	-65.6	172.5	176.1	0	0	108.8	K161 L238 I248	K161-E246 WeakPolarHBondContact CE-OE2 3.45Å; K161-E246 IonicContact NZ-OE1 3.25Å; K161-E246 PolarHBondContact NZ-OE1 2.64Å; K161-E246 IonicContact NZ-OE2 2.6Å; K161-E246 PolarHBondContact NZ-OE2 3.42Å; L238-E246 HydrophobicContact CD1-CB 4.02Å; E246-I248 PolarHBondContact O-N 3.07Å
247	D	83.6	Confident	82.7	Confident	97 Å²	97	64.3 Å²	64.3	52%	0.519	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	115.2	179.7	-171.3	14.7	0	0	0	109.3	I239 D245	I239-D247 PolarHBondContact N-O 3.18Å; D245-D247 PolarHBondContact O-N 3.03Å
248	I	91.9	Very high	81.7	Confident	25 Å²	25	66.8 Å²	66.8	13%	0.128	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	119.3	178.4	-166.6	166.8	0	0	0	111	R165 K169 S237 L238 E246	R165-I248 HydrophobicContact CB-CD1 3.3Å; K169-I248 HydrophobicContact CD-CG2 3.96Å; K169-I248 PolarHBondContact NZ-O 3.25Å; S237-I248 WeakPolarHBondContact O-CA 3.49Å; L238-I248 HydrophobicContact CD1-CB 4.14Å; L238-I248 HydrophobicContact CD1-CD1 4.43Å; L238-I248 HydrophobicContact CD1-CG1 4.42Å; E246-I248 PolarHBondContact O-N 3.07Å
249	S	94.3	Very high	80.7	Confident	70 Å²	70	67.3 Å²	67.3	49%	0.49	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	138.7	173.1	-176	0	0	0	0	109.7	A236 S237	A236-S249 CarbonylContact C-O 3.59Å; A236-S249 VanDerWaalsContact CA-O 3.24Å; A236-S249 WeakPolarHBondContact CA-O 3.26Å; S237-S249 PolarHBondContact N-O 3.42Å; S237-S249 PolarHBondContact O-N 3.06Å
250	V	96.6	Very high	79.9	Confident	26 Å²	26	65.6 Å²	65.6	16%	0.158	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	130.8	175.7	63.7	0	0	0	0	109.5	K169 F170 K235 A236	K169-V250 HydrophobicContact CB-CG1 4.27Å; K169-V250 HydrophobicContact CD-CG1 4.17Å; K169-V250 HydrophobicContact CG-CG1 4.13Å; F170-V250 HydrophobicContact CB-CG1 4.22Å; F170-V250 HydrophobicContact CB-CG2 4.38Å; K235-V250 WeakPolarHBondContact O-CA 3.38Å; A236-V250 HydrophobicContact CB-CG2 4.46Å
251	E	97.1	Very high	79.4	Confident	134 Å²	134	67.4 Å²	67.4	63%	0.626	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	123.2	172.3	-176.1	178.7	-168.7	0	0	107.7	C234 K235	C234-E251 CarbonylContact C-O 3.52Å; C234-E251 VanDerWaalsContact CA-O 3.27Å; C234-E251 WeakPolarHBondContact CA-O 3.36Å; K235-E251 PolarHBondContact N-O 2.91Å; K235-E251 PolarHBondContact O-N 2.97Å
252	C	96.6	Very high	79.4	Confident	23 Å²	23	72.3 Å²	72.3	16%	0.155	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131.5	178.8	-59.2	0	0	0	0	110.3	F170 I204 F233 C234	F170-C252 HydrophobicContact CD2-CB 3.79Å; F170-C252 HydrophobicContact CE1-CB 4.31Å; F170-C252 HydrophobicContact CE2-CB 3.49Å; F170-C252 VanDerWaalsContact CE2-CB 3.49Å; F170-C252 HydrophobicContact CG-CB 4.33Å; F170-C252 HydrophobicContact CZ-CB 3.78Å; I204-C252 HydrophobicContact CD1-CB 4.4Å; F233-C252 WeakPolarHBondContact O-CA 3.28Å; C234-C252 HydrophobicContact CB-CB 4.09Å; C234-C252 WeakPolarHBondContact CB-SG 3.31Å; C234-C252 WeakPolarHBondContact SG-CB 2.9Å; C234-C252 CovalentContact SG-SG 2.04Å; C234-C252 PolarHBondContact SG-SG 3.01Å
253	E	95.1	Very high	80	Confident	56 Å²	56	70.5 Å²	70.5	26%	0.262	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	123.3	168.2	-64.4	-177.4	-157.5	0	0	108.5	R92 G232 F233 Y255	R92-E253 IonicContact CZ-OE2 2.72Å; R92-E253 VanDerWaalsContact CZ-OE2 3.25Å; R92-E253 IonicContact NH1-OE1 3.24Å; R92-E253 IonicContact NH1-OE2 3.69Å; R92-E253 PolarHBondContact NH1-OE2 3.03Å; R92-E253 IonicContact NH2-OE2 3.25Å; R92-E253 PolarHBondContact NH2-OE2 2.85Å; G232-E253 CarbonylContact C-O 3.5Å; G232-E253 WeakPolarHBondContact CA-O 3.4Å; F233-E253 PolarHBondContact N-O 3.37Å; F233-E253 PolarHBondContact O-N 3.41Å; E253-Y255 HydrophobicContact CB-CE1 3.94Å; E253-Y255 HydrophobicContact CB-CE2 4.29Å; E253-Y255 WeakPolarHBondContact CB-OH 3.36Å; E253-Y255 PolarHBondContact OE2-OH 2.87Å
254	I	94.3	Very high	80.7	Confident	56 Å²	56	71 Å²	71	29%	0.287	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	137.6	176.3	-53.2	-54.5	0	0	0	109.2	F170 L176 F180 I204 H230	F170-I254 HydrophobicContact CE1-CD1 4.13Å; F170-I254 HydrophobicContact CZ-CD1 3.82Å; F170-I254 HydrophobicContact CZ-CG1 4.1Å; L176-I254 HydrophobicContact CD1-CG1 3.97Å; F180-I254 HydrophobicContact CD1-CD1 4.39Å; F180-I254 HydrophobicContact CE1-CD1 3.92Å; F180-I254 HydrophobicContact CE1-CG2 4.31Å; F180-I254 HydrophobicContact CZ-CD1 4.02Å; F180-I254 HydrophobicContact CZ-CG1 4.38Å; F180-I254 HydrophobicContact CZ-CG2 4.19Å; I204-I254 HydrophobicContact CD1-CD1 3.73Å; I204-I254 HydrophobicContact CG1-CD1 4.47Å; H230-I254 HydrophobicContact CB-CG2 3.74Å
255	Y	90.9	Very high	81.7	Confident	25 Å²	25	70.2 Å²	70.2	10%	0.098	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.6	-175.5	-51	-67.8	0	0	0	111.2	I89 S90 K231 F233 E253 Q257	I89-Y255 HydrophobicContact CD1-CD2 3.88Å; I89-Y255 HydrophobicContact CD1-CE2 3.91Å; I89-Y255 HydrophobicContact CG1-CD2 3.62Å; I89-Y255 HydrophobicContact CG1-CE2 3.61Å; S90-Y255 VanDerWaalsContact CB-CZ 3.47Å; K231-Y255 PolarHBondContact N-O 2.93Å; K231-Y255 PolarHBondContact O-N 3.24Å; F233-Y255 HydrophobicContact CB-CE2 3.79Å; E253-Y255 HydrophobicContact CB-CE1 3.94Å; E253-Y255 HydrophobicContact CB-CE2 4.29Å; E253-Y255 WeakPolarHBondContact CB-OH 3.36Å; E253-Y255 PolarHBondContact OE2-OH 2.87Å; Y255-Q257 PolarHBondContact O-NE2 2.72Å
256	E	83.6	Confident	82.1	Confident	102 Å²	102	69.1 Å²	69.1	48%	0.477	34%	0.342	S	S	.	.			trans	-65.6	136.7	166.1	-69.9	-179.7	-158.8	0	0	109.5	E261 K264	E256-E261 HydrophobicContact CB-CG 4.32Å; E256-K264 IonicContact OE2-NZ 3.56Å
257	Q	80.1	Confident	81.9	Confident	32 Å²	32	71 Å²	71	15%	0.15	35%	0.351	C	S	.	.			trans	-79.4	153.7	179.5	-60.4	-57.3	-79.1	0	0	110.9	E227 S229 Y255 A259 A260 E261	E227-Q257 WeakPolarHBondContact O-CB 3.29Å; E227-Q257 WeakPolarHBondContact O-CG 3.31Å; S229-Q257 WeakPolarHBondContact O-CG 3.36Å; Y255-Q257 PolarHBondContact O-NE2 2.72Å; Q257-A259 PolarHBondContact O-N 2.81Å; Q257-A259 VanDerWaalsContact O-N 3.15Å; Q257-A260 WeakPolarHBondContact O-CA 3.42Å; Q257-A260 VanDerWaalsContact O-CB 3.32Å; Q257-A260 WeakPolarHBondContact O-CB 2.98Å; Q257-A260 PolarHBondContact O-N 2.86Å; Q257-E261 PolarHBondContact O-N 2.04Å; Q257-E261 VanDerWaalsContact O-N 3.16Å
258	E	73.4	Confident	81.2	Confident	85 Å²	85	71.9 Å²	71.9	40%	0.397	35%	0.354	S	S	.	.	H	α-helix	trans	-56.9	-33.4	-177.4	-74	176.7	-152.5	0	0	113.5	R91 A260 E261 R262	R91-E258 IonicContact CZ-OE1 3.75Å; R91-E258 IonicContact NE-OE1 2.79Å; R91-E258 PolarHBondContact NE-OE1 2.9Å; R91-E258 IonicContact NH2-OE1 3.35Å; R91-E258 PolarHBondContact NH2-OE1 2.81Å; E258-A260 VanDerWaalsContact C-N 3.33Å; E258-A260 PolarHBondContact O-N 3.41Å; E258-E261 PolarHBondContact O-N 2.95Å; E258-R262 WeakPolarHBondContact O-CB 3.23Å; E258-R262 VanDerWaalsContact O-CG 3.26Å; E258-R262 WeakPolarHBondContact O-CG 3.45Å; E258-R262 PolarHBondContact O-N 2.99Å
259	A	72.8	Confident	80	Confident	12 Å²	12	76.5 Å²	76.5	10%	0.099	38%	0.379	C	S	.	.	H	α-helix	trans	-60.6	-43	174.6	0	0	0	0	0	111.9	E227 F228 Q257 R262 E263	E227-A259 HydrophobicContact CB-CB 4.17Å; E227-A259 HydrophobicContact CG-CB 3.62Å; F228-A259 HydrophobicContact CD1-CB 3.91Å; F228-A259 VanDerWaalsContact CE1-C 3.5Å; F228-A259 HydrophobicContact CE1-CB 3.63Å; F228-A259 HydrophobicContact CZ-CB 4.2Å; Q257-A259 PolarHBondContact O-N 2.81Å; Q257-A259 VanDerWaalsContact O-N 3.15Å; A259-R262 PolarHBondContact O-N 3.18Å; A259-E263 WeakPolarHBondContact O-CB 3.45Å; A259-E263 PolarHBondContact O-N 3.33Å
260	A	70.9	Confident	78.1	Confident	23 Å²	23	74.6 Å²	74.6	19%	0.19	37%	0.371	C	S	.	.	H	α-helix	trans	-64.5	-44.3	177.8	0	0	0	0	0	111.2	F228 Q257 E258 E263 K264	F228-A260 HydrophobicContact CD1-CB 3.87Å; Q257-A260 WeakPolarHBondContact O-CA 3.42Å; Q257-A260 VanDerWaalsContact O-CB 3.32Å; Q257-A260 WeakPolarHBondContact O-CB 2.98Å; Q257-A260 PolarHBondContact O-N 2.86Å; E258-A260 VanDerWaalsContact C-N 3.33Å; E258-A260 PolarHBondContact O-N 3.41Å; A260-E263 PolarHBondContact O-N 2.86Å; A260-K264 WeakPolarHBondContact O-CB 3.27Å; A260-K264 PolarHBondContact O-N 3.32Å
261	E	70.9	Confident	75.9	Confident	79 Å²	79	79.3 Å²	79.3	37%	0.369	40%	0.395	S	S	.	.	H	α-helix	trans	-67	-38.1	178	-72.3	-75	-168.6	0	0	111.9	E256 Q257 E258 K264 V265	E256-E261 HydrophobicContact CB-CG 4.32Å; Q257-E261 PolarHBondContact O-N 2.04Å; Q257-E261 VanDerWaalsContact O-N 3.16Å; E258-E261 PolarHBondContact O-N 2.95Å; E261-K264 PolarHBondContact O-N 3.47Å; E261-K264 IonicContact OE1-NZ 3.71Å; E261-K264 WeakPolarHBondContact OE2-CD 3.06Å; E261-K264 IonicContact OE2-NZ 3.35Å; E261-K264 PolarHBondContact OE2-NZ 3.5Å; E261-V265 VanDerWaalsContact O-CG2 3.3Å; E261-V265 WeakPolarHBondContact O-CG2 3.47Å; E261-V265 PolarHBondContact O-N 3.31Å
262	R	72.6	Confident	73.7	Confident	150 Å²	150	77 Å²	77	57%	0.566	40%	0.398	S	S	*	.	H	α-helix	trans	-63.1	-45.9	174.6	-77.5	176.7	-175.4	-121.2	7.2	111.5	E258 A259 V265 Q266	E258-R262 WeakPolarHBondContact O-CB 3.23Å; E258-R262 VanDerWaalsContact O-CG 3.26Å; E258-R262 WeakPolarHBondContact O-CG 3.45Å; E258-R262 PolarHBondContact O-N 2.99Å; A259-R262 PolarHBondContact O-N 3.18Å; R262-V265 PolarHBondContact O-N 3.14Å; R262-Q266 WeakPolarHBondContact O-CG 3.24Å; R262-Q266 PolarHBondContact O-N 2.89Å
263	E	71.5	Confident	71.5	Confident	79 Å²	79	80.1 Å²	80.1	37%	0.369	42%	0.417	S	S	.	.	H	α-helix	trans	-61.5	-45.3	176.8	-177.4	172.5	-170.7	0	0	110.9	F228 A259 A260 V265 Q266 H267	F228-E263 WeakPolarHBondContact CE1-OE2 3.41Å; F228-E263 WeakPolarHBondContact CZ-OE2 3.04Å; A259-E263 WeakPolarHBondContact O-CB 3.45Å; A259-E263 PolarHBondContact O-N 3.33Å; A260-E263 PolarHBondContact O-N 2.86Å; E263-V265 VanDerWaalsContact C-N 3.33Å; E263-V265 PolarHBondContact O-N 2.6Å; E263-Q266 WeakPolarHBondContact O-CB 3.41Å; E263-Q266 PolarHBondContact O-N 2.84Å; E263-Q266 VanDerWaalsContact O-N 3.09Å; E263-H267 PolarHBondContact O-CD2 2.86Å; E263-H267 PolarHBondContact O-N 2.04Å
264	K	72.3	Confident	69.1	Low	95 Å²	95	83.4 Å²	83.4	41%	0.413	44%	0.436	S	S	.	.	H	α-helix	trans	-57.6	-42.7	174.1	-179.2	-177.5	177.9	-174.5	0	112.7	E256 A260 E261 H267 L268	E256-K264 IonicContact OE2-NZ 3.56Å; A260-K264 WeakPolarHBondContact O-CB 3.27Å; A260-K264 PolarHBondContact O-N 3.32Å; E261-K264 PolarHBondContact O-N 3.47Å; E261-K264 IonicContact OE1-NZ 3.71Å; E261-K264 WeakPolarHBondContact OE2-CD 3.06Å; E261-K264 IonicContact OE2-NZ 3.35Å; E261-K264 PolarHBondContact OE2-NZ 3.5Å; K264-H267 PolarHBondContact O-N 2.84Å; K264-L268 VanDerWaalsContact O-CG 3.32Å; K264-L268 WeakPolarHBondContact O-CG 3.07Å; K264-L268 PolarHBondContact O-N 2.81Å
265	V	74.9	Confident	66.6	Low	78 Å²	78	88 Å²	88	47%	0.473	46%	0.456	S	S	.	.	H	α-helix	trans	-64.4	-41.2	174.6	170.2	0	0	0	0	111.3	E261 R262 E263 L268 L269	E261-V265 VanDerWaalsContact O-CG2 3.3Å; E261-V265 WeakPolarHBondContact O-CG2 3.47Å; E261-V265 PolarHBondContact O-N 3.31Å; R262-V265 PolarHBondContact O-N 3.14Å; E263-V265 VanDerWaalsContact C-N 3.33Å; E263-V265 PolarHBondContact O-N 2.6Å; V265-L268 PolarHBondContact O-N 3.42Å; V265-L269 HydrophobicContact CG1-CD1 4.09Å; V265-L269 WeakPolarHBondContact O-CD1 3.35Å; V265-L269 PolarHBondContact O-N 2.85Å
266	Q	72.1	Confident	64.3	Low	116 Å²	116	92.6 Å²	92.6	54%	0.542	49%	0.49	S	S	.	.	H	α-helix	trans	-63	-42.1	175.9	-73.2	176	-2.7	0	0	111.8	R262 E263 L269 G270	R262-Q266 WeakPolarHBondContact O-CG 3.24Å; R262-Q266 PolarHBondContact O-N 2.89Å; E263-Q266 WeakPolarHBondContact O-CB 3.41Å; E263-Q266 PolarHBondContact O-N 2.84Å; E263-Q266 VanDerWaalsContact O-N 3.09Å; Q266-L269 PolarHBondContact O-N 2.89Å; Q266-G270 PolarHBondContact O-N 2.71Å
267	H	64.9	Low	62.3	Low	129 Å²	129	95.9 Å²	95.9	60%	0.597	50%	0.504	S	S	*	.	H	α-helix	trans	-59.7	-45.8	173.8	-90.3	-84.5	0	0	0	112.1	E263 K264 L269 G270 D271	E263-H267 PolarHBondContact O-CD2 2.86Å; E263-H267 PolarHBondContact O-N 2.04Å; K264-H267 PolarHBondContact O-N 2.84Å; H267-L269 VanDerWaalsContact C-N 3.27Å; H267-L269 PolarHBondContact O-N 3Å; H267-G270 PolarHBondContact O-N 2.88Å; H267-G270 VanDerWaalsContact O-N 3.16Å; H267-D271 WeakPolarHBondContact O-CB 3.46Å; H267-D271 PolarHBondContact O-N 3.25Å
268	L	68.5	Low	60.2	Low	114 Å²	114	100.6 Å²	100.6	60%	0.597	53%	0.531	S	S	*	.	H	α-helix	trans	-63.7	-31.4	177.2	-69.7	170.9	0	0	0	112.9	K264 V265	K264-L268 VanDerWaalsContact O-CG 3.32Å; K264-L268 WeakPolarHBondContact O-CG 3.07Å; K264-L268 PolarHBondContact O-N 2.81Å; V265-L268 PolarHBondContact O-N 3.42Å
269	L	66.8	Low	59	Low	122 Å²	122	102.9 Å²	102.9	64%	0.639	55%	0.545	S	S	*	.	H	α-helix	trans	-73.4	-38.3	172.9	-100.3	77.9	0	0	0	112.3	V265 Q266 H267 A272	V265-L269 HydrophobicContact CG1-CD1 4.09Å; V265-L269 WeakPolarHBondContact O-CD1 3.35Å; V265-L269 PolarHBondContact O-N 2.85Å; Q266-L269 PolarHBondContact O-N 2.89Å; H267-L269 VanDerWaalsContact C-N 3.27Å; H267-L269 PolarHBondContact O-N 3Å; L269-A272 WeakPolarHBondContact O-CB 3.35Å; L269-A272 PolarHBondContact O-N 2.89Å
270	G	54.5	Low	57.4	Low	31 Å²	31	107.4 Å²	107.4	32%	0.32	57%	0.572	S	S	.	*	H	α-helix	trans	-65.7	-41.9	177	0	0	0	0	0	112.8	Q266 H267 A272 T273 D274	Q266-G270 PolarHBondContact O-N 2.71Å; H267-G270 PolarHBondContact O-N 2.88Å; H267-G270 VanDerWaalsContact O-N 3.16Å; G270-A272 PolarHBondContact O-N 2.94Å; G270-T273 WeakPolarHBondContact O-CA 3.32Å; G270-T273 PolarHBondContact O-N 2.8Å; G270-T273 PolarHBondContact O-OG1 2.73Å; G270-D274 PolarHBondContact O-N 2.72Å
271	D	49.9	Very low	56.1	Low	124 Å²	124	113.8 Å²	113.8	66%	0.663	60%	0.598	S	S	*	*	H	α-helix	trans	-66.4	-23.8	178.2	-148.2	32.7	0	0	0	112.1	H267 T273	H267-D271 WeakPolarHBondContact O-CB 3.46Å; H267-D271 PolarHBondContact O-N 3.25Å; D271-T273 VanDerWaalsContact C-N 3.3Å
272	A	51.4	Low	54.2	Low	85 Å²	85	121.5 Å²	121.5	70%	0.702	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-16.8	171.5	0	0	0	0	0	113.4	L269 G270	L269-A272 WeakPolarHBondContact O-CB 3.35Å; L269-A272 PolarHBondContact O-N 2.89Å; G270-A272 PolarHBondContact O-N 2.94Å
273	T	49.5	Very low	52.7	Low	89 Å²	89	122.3 Å²	122.3	55%	0.546	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.1	-9.8	176.4	45	0	0	0	0	114.1	G270 D271 H275	G270-T273 WeakPolarHBondContact O-CA 3.32Å; G270-T273 PolarHBondContact O-N 2.8Å; G270-T273 PolarHBondContact O-OG1 2.73Å; D271-T273 VanDerWaalsContact C-N 3.3Å; T273-H275 PolarHBondContact O-CE1 2.78Å; T273-H275 PolarHBondContact O-N 3.09Å; T273-H275 PolarHBondContact O-ND1 3.21Å
274	D	44.4	Very low	50.7	Low	125 Å²	125	127.4 Å²	127.4	67%	0.668	66%	0.657	S	S	*	*			trans	-78.5	115.5	175.6	-77.9	-25.4	0	0	0	111	G270	G270-D274 PolarHBondContact O-N 2.72Å
275	H	42.5	Very low	49.1	Very low	152 Å²	152	131.6 Å²	131.6	70%	0.704	68%	0.678	S	S	*	*			trans	-83.9	143.8	-178.4	-42.2	-24.2	0	0	0	109.3	T273 H277	T273-H275 PolarHBondContact O-CE1 2.78Å; T273-H275 PolarHBondContact O-N 3.09Å; T273-H275 PolarHBondContact O-ND1 3.21Å; H275-H277 PolarHBondContact O-N 2.83Å
276	P	42.5	Very low	47	Very low	123 Å²	123	131.4 Å²	131.4	80%	0.799	69%	0.691	S	S	*	*			trans	-68	123.2	169.1	27	-31.3	0	0	0	109.8	N278	P276-N278 PolarHBondContact O-N 3.4Å
277	H	41.2	Very low	45.4	Very low	170 Å²	170	135.4 Å²	135.4	79%	0.787	71%	0.707	S	S	*	*			trans	-67.2	113.7	165.4	-71.1	-79.4	0	0	0	108.8	H275 D279	H275-H277 PolarHBondContact O-N 2.83Å; H277-D279 PolarHBondContact O-N 2.88Å
278	N	37.6	Very low	43.8	Very low	132 Å²	132	132.8 Å²	132.8	71%	0.706	72%	0.715	S	S	*	*			trans	-87.3	85.4	169.8	-176.9	27	0	0	0	108.1	P276 T280	P276-N278 PolarHBondContact O-N 3.4Å; N278-T280 PolarHBondContact O-N 3.09Å
279	D	46.6	Very low	42.2	Very low	132 Å²	132	135.7 Å²	135.7	71%	0.706	73%	0.725	S	S	*	*			trans	-73.5	73.8	177.9	-72.1	-31.3	0	0	0	111.1	H277 H281	H277-D279 PolarHBondContact O-N 2.88Å; D279-H281 PolarHBondContact O-N 3.2Å
280	T	39.4	Very low	40.6	Very low	107 Å²	107	136.9 Å²	136.9	66%	0.656	73%	0.732	S	S	*	*			trans	-91.6	77.1	163	44.2	0	0	0	0	110.1	N278	N278-T280 PolarHBondContact O-N 3.09Å
281	H	44.2	Very low	39.8	Very low	157 Å²	157	144 Å²	144	73%	0.727	76%	0.757	S	S	*	*			trans	-109.7	108.2	161.9	-72.1	-66.7	0	0	0	109.9	D279 H283	D279-H281 PolarHBondContact O-N 3.2Å; H281-H283 PolarHBondContact O-N 2.91Å
282	R	31.9	Very low	39	Very low	241 Å²	241	145.2 Å²	145.2	91%	0.909	76%	0.763	S	S	*	*			trans	-69.5	116.8	169.6	-92.5	169.2	61.1	178.9	-2.5	108.5	E284	R282-E284 PolarHBondContact O-N 2.76Å
283	H	39.7	Very low	38.3	Very low	168 Å²	168	151.3 Å²	151.3	78%	0.778	77%	0.774	S	S	*	*			trans	-73.5	116.3	165.9	-68.7	-73.1	0	0	0	109.7	H281	H281-H283 PolarHBondContact O-N 2.91Å
284	E	29.8	Very low	37.4	Very low	186 Å²	186	155.5 Å²	155.5	87%	0.869	79%	0.787	S	S	*	*			trans	-86.1	115.8	171	-152.3	173.9	-158.4	0	0	107.9	R282 G286	R282-E284 PolarHBondContact O-N 2.76Å; E284-G286 PolarHBondContact O-N 3.01Å
285	H	38.7	Very low	36.8	Very low	183 Å²	183	158.1 Å²	158.1	85%	0.847	80%	0.795	S	S	*	*			trans	-70.2	99.2	180	-71.2	-72.5	0	0	0	110.7
286	G	31.9	Very low	36	Very low	73 Å²	73	154.6 Å²	154.6	75%	0.753	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-75.4	136.7	169.9	0	0	0	0	0	112.1	E284	E284-G286 PolarHBondContact O-N 3.01Å
287	K	36.7	Very low	35.7	Very low	201 Å²	201	159.2 Å²	159.2	87%	0.874	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-62.7	148	-168.2	-65.8	174.3	175.7	-179.4	0	114.4
288	G	32.2	Very low	35	Very low	74 Å²	74	154.1 Å²	154.1	76%	0.763	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-67.2	165.4	-179.7	0	0	0	0	0	115.4
289	H	35.7	Very low	34.6	Very low	174 Å²	174	157 Å²	157	81%	0.806	81%	0.81	S	S	*	*			trans	-126	114.7	168.2	-83.1	-79.5	0	0	0	109.7
290	D	32.2	Very low	33.9	Very low	147 Å²	147	155.8 Å²	155.8	79%	0.786	81%	0.811	S	S	*	*			trans	-58.7	140	163.7	-85.3	-46.9	0	0	0	111
291	H	37.4	Very low	33.4	Very low	182 Å²	182	163 Å²	163	84%	0.843	83%	0.827	S	S	*	*			trans	-132.1	95.6	153.8	-78.7	-56.8	0	0	0	110.6
292	D	33.1	Very low	32.5	Very low	149 Å²	149	158.7 Å²	158.7	80%	0.797	83%	0.825	S	S	*	*			trans	-59.6	124.3	156.3	-79.7	-42	0	0	0	110.8
293	K	36.6	Very low	32.3	Very low	213 Å²	213	156.9 Å²	156.9	93%	0.926	83%	0.826	S	S	*	*			trans	-143.6	122.7	144.2	-76.4	-159.7	179.2	174.7	0	111.4
294	E	30.3	Very low	31.6	Very low	177 Å²	177	151.7 Å²	151.7	83%	0.827	82%	0.818	S	S	*	*			trans	-67.2	137.1	-178.5	-76.1	179.8	115.5	0	0	115.6
295	H	32.8	Very low	31.5	Very low	179 Å²	179	151.9 Å²	151.9	83%	0.829	82%	0.818	S	S	*	*			trans	44	125.2	131.1	-60.5	-53.9	0	0	0	123.9
296	G	26.7	Very low	30.9	Very low	79 Å²	79	153.9 Å²	153.9	81%	0.814	82%	0.819	S	S	*	*			trans	-150.4	111.8	149.1	0	0	0	0	0	111.9
297	K	34.6	Very low	31.2	Very low	219 Å²	219	159.7 Å²	159.7	95%	0.952	83%	0.826	S	S	*	*			trans	-61	154.4	-179.8	-65	175.1	176.1	177.3	0	113.5
298	G	26.5	Very low	30.8	Very low	63 Å²	63	154 Å²	154	65%	0.649	82%	0.824	S	S	*	*			trans	160.3	91	147.9	0	0	0	0	0	119.1
299	H	30.1	Very low	30.8	Very low	193 Å²	193	160.3 Å²	160.3	89%	0.894	83%	0.833	S	S	*	*			trans	71.7	129.5	139.2	-61.4	-69.1	0	0	0	123.7
300	S	30.6	Very low	30.4	Very low	106 Å²	106	156.1 Å²	156.1	74%	0.741	84%	0.837	S	S	*	*			trans	-59.7	150.1	168.6	-10.2	0	0	0	0	115.8
301	R	30	Very low	30.2	Very low	259 Å²	259	153.1 Å²	153.1	98%	0.977	84%	0.842	S	S	*	*			trans	159.5	132.9	142.4	-89.3	163.2	-175	-173.1	2.7	105.8
302	G	24.8	Very low	29.8	Very low	66 Å²	66	149.8 Å²	149.8	68%	0.68	84%	0.838	S	S	*	*			cis	151.1	157.9	16.2	0	0	0	0	0	107.1
303	H	28.8	Very low	29.6	Very low	203 Å²	203	151.5 Å²	151.5	94%	0.94	84%	0.842	S	S	*	*			trans	79.5	124.8	177.4	-73.5	-75.7	0	0	0	117.4
304	G	24.5	Very low	29.2	Very low	59 Å²	59	149.6 Å²	149.6	61%	0.608	84%	0.836	S	S	*	*			cis	122.6	107.4	0.5	0	0	0	0	0	113.2
305	H	28.2	Very low	29.2	Very low	190 Å²	190	150 Å²	150	88%	0.88	84%	0.837	S	S	*	*			trans	64.6	156.8	152.9	-68.1	-50.4	0	0	0	119.2
306	R	24.7	Very low	28.9	Very low	226 Å²	226	145.1 Å²	145.1	85%	0.853	84%	0.836	S	S	*	*			cis	-179	157.6	-14.7	179	179.8	-160.1	-167.1	5.1	105.3
307	H	39.3	Very low	29.3	Very low	194 Å²	194	151.3 Å²	151.3	90%	0.898	84%	0.843	S	S	*	*			trans	-50	153	172.3	-63.7	-86.2	0	0	0	116.7
308	G	27	Very low	28.9	Very low	81 Å²	81	144.9 Å²	144.9	84%	0.835	84%	0.839	S	S	*	*			trans	-166.4	133.9	163.4	0	0	0	0	0	113.6
309	Q	33.8	Very low	29.1	Very low	207 Å²	207	146 Å²	146	97%	0.967	85%	0.85	S	S	*	*			trans	-74.7	160.8	-177.8	-72.3	169.4	-31.1	0	0	115
310	G	26.1	Very low	29	Very low	86 Å²	86	140.7 Å²	140.7	89%	0.887	85%	0.848	S	S	*	*			trans	122.7	127.7	137.7	0	0	0	0	0	116.8
311	G	27.8	Very low	28.9	Very low	85 Å²	85	144.4 Å²	144.4	88%	0.876	85%	0.853	S	S	*	*			trans	149.7	96.7	160.4	0	0	0	0	0	116
312	S	29.8	Very low	28.8	Very low	111 Å²	111	136 Å²	136	78%	0.776	85%	0.847	S	S	*	*			trans	-69.5	155.8	171.3	46.3	0	0	0	0	114.8
313	H	28.1	Very low	29.1	Very low	186 Å²	186	140.9 Å²	140.9	86%	0.861	85%	0.852	S	S	*	*			trans	-152.2	126.2	144.5	-122.8	-80.2	0	0	0	112.6
314	E	28.3	Very low	29	Very low	172 Å²	172	134.5 Å²	134.5	80%	0.804	84%	0.84	S	S	*	*			trans	-85.2	158.2	170	-75.3	177.1	121.8	0	0	112.5
315	H	30.3	Very low	29.4	Very low	186 Å²	186	141 Å²	141	86%	0.861	86%	0.855	S	S	*	*				-178.7	142	128.2	-80.4	-61.5	0	0	0	105.6
316	G	27.6	Very low	29.4	Very low	77 Å²	77	135.5 Å²	135.5	79%	0.794	85%	0.85	S	S	*	*			cis	163.3	142.7	7.7	0	0	0	0	0	107.5
317	Q	33.4	Very low	29.6	Very low	209 Å²	209	128.3 Å²	128.3	98%	0.977	85%	0.847	S	S	*	*			trans	-86.9	169.3	-163.8	-63.3	172.7	-17.9	0	0	116.8
318	G	27.1	Very low	29.1	Very low	83 Å²	83	124.1 Å²	124.1	86%	0.856	84%	0.839	S	S	*	*			trans	168.9	128.8	142.2	0	0	0	0	0	110.4
319	G	30.1	Very low	29.2	Very low	86 Å²	86	131.6 Å²	131.6	89%	0.887	84%	0.842	S	S	*	*			cis	137.3	129.1	11.1	0	0	0	0	0	108.3
320	G	28.4	Very low	28.9	Very low	82 Å²	82	124.8 Å²	124.8	85%	0.845	83%	0.827	S	S	*	*			trans	152.4	102.7	164.7	0	0	0	0	0	119.5
321	H	29.2	Very low	29	Very low	184 Å²	184	129.8 Å²	129.8	85%	0.852	83%	0.827	S	S	*	*			trans	-50.8	161.4	175.3	-75.3	-91.5	0	0	0	121.2
322	G	28.3	Very low	28.9	Very low	82 Å²	82	128.7 Å²	128.7	85%	0.845	82%	0.816	S	S	*	*			trans	-172.8	106.8	147.4	0	0	0	0	0	114.1
323	H	30.6	Very low	28.8	Very low	170 Å²	170	131.6 Å²	131.6	79%	0.787	82%	0.817	S	S	*	*			trans	-93.7	159.1	179.3	-81.2	-86.9	0	0	0	113.7
324	G	27	Very low	28.9	Very low	68 Å²	68	131.3 Å²	131.3	70%	0.701	82%	0.815	S	S	*	*			trans	168	92.1	151	0	0	0	0	0	110.7
325	Q	32.5	Very low	28.8	Very low	195 Å²	195	126.8 Å²	126.8	91%	0.911	82%	0.815	S	S	*	*				46.9	134.2	88.3	-69.1	-169.4	13.7	0	0	114
326	G	28.8	Very low	28.6	Very low	75 Å²	75	121.8 Å²	121.8	77%	0.773	81%	0.814	S	S	*	*			cis	-166.4	155.5	9.2	0	0	0	0	0	108.8
327	G	28.5	Very low	28.6	Very low	76 Å²	76	123.1 Å²	123.1	78%	0.784	81%	0.811	S	S	*	*				100.9	140.4	91.5	0	0	0	0	0	109.1
328	S	28.4	Very low	28.3	Very low	106 Å²	106	120.8 Å²	120.8	74%	0.741	80%	0.8	S	S	*	*			cis	-168	149.1	8.3	-82.3	0	0	0	0	108.3
329	R	29.4	Very low	28.4	Very low	238 Å²	238	122.9 Å²	122.9	90%	0.898	79%	0.787	S	S	*	*			trans	28.4	138.3	132.3	-58	170.9	177.1	158.4	-1.9	118.6
330	G	27.4	Very low	28.3	Very low	63 Å²	63	128 Å²	128	65%	0.649	78%	0.779	S	S	*	*			cis	160.9	-179.4	10.6	0	0	0	0	0	112
331	H	27.8	Very low	28.5	Very low	191 Å²	191	127.5 Å²	127.5	88%	0.884	78%	0.775	S	S	*	*			trans	62.1	136.1	161.3	-56.3	-73.2	0	0	0	117.9
332	G	26.9	Very low	28.6	Very low	62 Å²	62	127.1 Å²	127.1	64%	0.639	77%	0.773	S	S	*	*			cis	165.6	166.5	3.4	0	0	0	0	0	109.6
333	H	27.1	Very low	28.5	Very low	173 Å²	173	127.4 Å²	127.4	80%	0.801	78%	0.776	S	S	*	*			trans	92.2	135.6	155.2	-66.8	-74.6	0	0	0	123.6
334	H	29	Very low	28.4	Very low	179 Å²	179	123.4 Å²	123.4	83%	0.829	78%	0.781	S	S	*	*			trans	95.5	107.8	150.7	-69.7	-62	0	0	0	120.2
335	G	26.2	Very low	28.3	Very low	78 Å²	78	123.7 Å²	123.7	80%	0.804	78%	0.784	S	S	*	*			trans	-85.2	164.8	149.8	0	0	0	0	0	111.8
336	G	26.3	Very low	28.1	Very low	81 Å²	81	126.8 Å²	126.8	84%	0.835	79%	0.787	S	S	*	*			trans	160.1	118.8	173.9	0	0	0	0	0	112.2
337	S	27.9	Very low	28	Very low	104 Å²	104	126.6 Å²	126.6	73%	0.727	79%	0.786	S	S	*	*			trans	-85.5	-177.7	-174	42.7	0	0	0	0	114.8
338	H	27.8	Very low	27.9	Very low	160 Å²	160	132.4 Å²	132.4	74%	0.741	79%	0.792	S	S	*	*			trans	92.7	140.3	168.7	-66.7	-91.9	0	0	0	115.1
339	E	28.9	Very low	27.8	Very low	127 Å²	127	131 Å²	131	59%	0.593	80%	0.795	S	S	*	*			cis	-170.9	157.9	15.9	-126.8	176.6	170.6	0	0	113.6
340	R	28	Very low	27.7	Very low	193 Å²	193	127.7 Å²	127.7	73%	0.728	79%	0.789	S	S	*	*			trans	50.2	131.7	140.2	-78.2	165.6	-160.1	-144.9	1.3	123.2
341	G	32	Very low	27.7	Very low	72 Å²	72	133.9 Å²	133.9	74%	0.742	80%	0.8	S	S	*	*			trans	-97.4	165.1	138.9	0	0	0	0	0	113.2
342	Q	31.4	Very low	27.6	Very low	177 Å²	177	131.6 Å²	131.6	83%	0.827	80%	0.795	S	S	*	*			trans	-142.4	127.8	158.1	-75.3	-176.9	1.5	0	0	105.2
343	G	27.6	Very low	27.5	Very low	87 Å²	87	139.9 Å²	139.9	90%	0.897	81%	0.807	S	S	*	*				90.1	133.5	74.8	0	0	0	0	0	109.4
344	G	27.4	Very low	27.5	Very low	87 Å²	87	136.9 Å²	136.9	90%	0.897	81%	0.805	S	S	*	*			cis	174.8	-176.7	1.7	0	0	0	0	0	108.9
345	G	25.9	Very low	27.4	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	80%	0.802	S	S	*	*			trans	135.6	95.6	149.8	0	0	0	0	0	121.5
346	R	27.8	Very low	27.2	Very low	259 Å²	259	140.5 Å²	140.5	98%	0.977	80%	0.801	S	S	*	*				57.3	134.3	129.9	-60.9	-179.3	179.6	-169.1	-0.9	123.8
347	G	26.1	Very low	27.3	Very low	72 Å²	72	143.9 Å²	143.9	74%	0.742	80%	0.795	S	S	*	*			trans	151.8	84.2	138.1	0	0	0	0	0	121.2
348	H	27.2	Very low	27.1	Very low	198 Å²	198	141.4 Å²	141.4	92%	0.917	79%	0.786	S	S	*	*			trans	24.8	140.1	146.8	-64	-79.3	0	0	0	126
349	G	26.7	Very low	26.9	Very low	77 Å²	77	142.8 Å²	142.8	79%	0.794	79%	0.792	S	S	*	*			trans	159.8	116.7	145.2	0	0	0	0	0	116.5
350	H	27.1	Very low	26.6	Very low	167 Å²	167	139.8 Å²	139.8	77%	0.773	80%	0.796	S	S	*	*			trans	-72.3	154.6	-169.7	-79.9	-105.6	0	0	0	117.1
351	H	27.1	Very low	26.4	Very low	193 Å²	193	143.1 Å²	143.1	89%	0.894	81%	0.808	S	S	*	*				-169	141.5	113.7	-92.4	-65.8	0	0	0	113.4
352	N	25.2	Very low	26.1	Very low	144 Å²	144	142.9 Å²	142.9	77%	0.77	81%	0.806	S	S	*	*			trans	-61.2	142	-174.3	-78.8	-26.3	0	0	0	116.2
353	R	25.3	Very low	25.8	Very low	236 Å²	236	141.7 Å²	141.7	89%	0.891	80%	0.8	S	S	*	*				-171.6	123	102.8	-105	178.4	-175.4	174.4	2	112.8
354	S	25.9	Very low	25.6	Very low	110 Å²	110	146.4 Å²	146.4	77%	0.769	79%	0.791	S	S	*	*			trans	60.8	90.8	141.3	-47.1	0	0	0	0	119.4
355	H	26.6	Very low	25.5	Very low	164 Å²	164	152.6 Å²	152.6	76%	0.759	79%	0.787	S	S	*	*			trans	-48.9	148.6	140.6	-96.4	-101.3	0	0	0	111.6
356	E	23.6	Very low	25.5	Very low	169 Å²	169	152.4 Å²	152.4	79%	0.79	79%	0.785	S	S	*	*				-153.5	130.8	100.9	-98.9	-173.3	158.9	0	0	112.9
357	H	26.9	Very low	25.4	Very low	152 Å²	152	149 Å²	149	70%	0.704	78%	0.78	S	S	*	*			trans	39.2	122.6	160	-57.2	-67.9	0	0	0	121.2
358	G	23.8	Very low	25.3	Very low	52 Å²	52	153.9 Å²	153.9	54%	0.536	79%	0.788	S	S	.	*			cis	115.8	110.8	11.3	0	0	0	0	0	112.7
359	H	24.7	Very low	25.4	Very low	188 Å²	188	155.3 Å²	155.3	87%	0.87	79%	0.785	S	S	*	*			trans	69.2	142.5	143.8	-51	-73.8	0	0	0	118.3
360	G	23	Very low	25.3	Very low	65 Å²	65	159.3 Å²	159.3	67%	0.67	79%	0.788	S	S	*	*			cis	155.7	133.5	5.5	0	0	0	0	0	110.7
361	R	24.2	Very low	25.5	Very low	263 Å²	263	156.2 Å²	156.2	99%	0.992	79%	0.785	S	S	*	*			trans	39.9	132	140.8	-64.3	-174.4	178.1	-143.1	-2	121.4
362	G	24.6	Very low	25.5	Very low	67 Å²	67	156.2 Å²	156.2	69%	0.691	79%	0.785	S	S	*	*				168	103	128.4	0	0	0	0	0	113.6
363	Q	25.2	Very low	25.5	Very low	152 Å²	152	158.1 Å²	158.1	71%	0.71	79%	0.789	S	S	*	*				82.6	118.6	91.1	-129.3	171.9	-0.4	0	0	112.4
364	W	24.3	Very low	25.6	Very low	186 Å²	186	154.4 Å²	154.4	71%	0.705	79%	0.787	S	S	*	*				-176.9	150.7	66.9	-85.9	96.9	0	0	0	114.6
365	R	25.1	Very low	25.8	Very low	217 Å²	217	156.6 Å²	156.6	82%	0.819	79%	0.785	S	S	*	*			trans	58.4	100	143.1	-88.7	162.9	-171.9	-103.3	3	122.9
366	G	24.8	Very low	25.8	Very low	69 Å²	69	156.8 Å²	156.8	71%	0.711	79%	0.79	S	S	*	*				54.8	109	100	0	0	0	0	0	122.2
367	H	25.9	Very low	26.3	Very low	189 Å²	189	155.9 Å²	155.9	88%	0.875	79%	0.785	S	S	*	*				175.6	152.4	114.6	-106.6	-78.4	0	0	0	110.3
368	L	24.8	Very low	26.4	Very low	173 Å²	173	154.9 Å²	154.9	91%	0.906	79%	0.785	S	S	*	*			trans	125.1	149.1	152.9	-72	134.8	0	0	0	117.4
369	R	27.8	Very low	27.1	Very low	228 Å²	228	159.9 Å²	159.9	86%	0.86	79%	0.794	S	S	*	*			trans	-70.9	165.7	176.6	-72.8	177.6	165.7	-175.2	-4.8	111.7
370	L	25.3	Very low	27.7	Very low	161 Å²	161	156.4 Å²	156.4	84%	0.843	79%	0.786	S	S	*	*			trans	80.2	126.2	158.5	-77.1	135.5	0	0	0	117.8
371	S	31.7	Very low	28.4	Very low	102 Å²	102	162 Å²	162	71%	0.713	79%	0.792	S	S	*	*			trans	18.4	118.9	148.4	-163	0	0	0	0	119
372	E	27.3	Very low	28.8	Very low	194 Å²	194	157.1 Å²	157.1	91%	0.907	79%	0.786	S	S	*	*			trans	-174.5	137.3	140.6	-103.3	159.7	-160.8	0	0	111.1
373	H	25.9	Very low	29.3	Very low	184 Å²	184	161 Å²	161	85%	0.852	79%	0.785	S	S	*	*			trans	-91.5	136	175.6	-79.3	-85	0	0	0	110
374	D	26.3	Very low	29.7	Very low	158 Å²	158	159 Å²	159	85%	0.845	79%	0.789	S	S	*	*			trans	-87.5	139.9	-176.8	-161.5	7.9	0	0	0	111.5
375	H	29.5	Very low	30.2	Very low	156 Å²	156	158.1 Å²	158.1	72%	0.722	79%	0.792	S	S	*	*			trans	-112.7	123.2	173	-71.5	-60.3	0	0	0	110.4
376	I	28.1	Very low	30.6	Very low	168 Å²	168	156.4 Å²	156.4	86%	0.862	79%	0.793	S	S	*	*			trans	-71.5	127.2	171.2	-84	170.4	0	0	0	110.1
377	H	33.1	Very low	31.3	Very low	149 Å²	149	160.6 Å²	160.6	69%	0.69	80%	0.799	S	S	*	*			trans	-108	134.6	165.9	-71.5	-64.3	0	0	0	111.1
378	D	29.2	Very low	31.9	Very low	132 Å²	132	156.1 Å²	156.1	71%	0.706	79%	0.785	S	S	*	*			trans	-85.2	121	171.6	-175.7	5.1	0	0	0	109.9	T380	D378-T380 PolarHBondContact OD1-N 2.86Å
379	H	39.4	Very low	32.6	Very low	157 Å²	157	154 Å²	154	73%	0.727	78%	0.781	S	S	*	*			trans	-121.5	68.2	175.8	-65.2	-61	0	0	0	110.9	K381	H379-K381 VanDerWaalsContact C-N 3.35Å; H379-K381 PolarHBondContact O-N 3.16Å
380	T	36	Very low	33.1	Very low	114 Å²	114	150.8 Å²	150.8	70%	0.699	78%	0.775	S	S	*	*			trans	-82.4	78.6	159.7	53.7	0	0	0	0	110.1	D378	D378-T380 PolarHBondContact OD1-N 2.86Å
381	K	37.2	Very low	33.7	Very low	184 Å²	184	148.4 Å²	148.4	80%	0.8	77%	0.77	S	S	*	*	S	Bend	trans	-177.6	140.2	140.6	-70.7	-137.5	-179.4	170.2	0	110.7	H379	H379-K381 VanDerWaalsContact C-N 3.35Å; H379-K381 PolarHBondContact O-N 3.16Å
382	D	32.8	Very low	34	Very low	160 Å²	160	152.1 Å²	152.1	86%	0.856	78%	0.781	S	S	*	*			trans	-77.8	138.3	-172.9	-152.4	-14.3	0	0	0	112.4
383	H	34.7	Very low	34.9	Very low	147 Å²	147	146.3 Å²	146.3	68%	0.681	77%	0.774	S	S	*	*			trans	-128.2	111.7	175	-63.5	-55.1	0	0	0	109.7	H385	H383-H385 PolarHBondContact O-N 2.91Å
384	S	34.2	Very low	35.3	Very low	112 Å²	112	141.6 Å²	141.6	78%	0.783	76%	0.762	S	S	*	*			trans	-75.5	109.5	171.4	41.3	0	0	0	0	110.4
385	H	35.2	Very low	35.9	Very low	166 Å²	166	143.5 Å²	143.5	77%	0.769	76%	0.762	S	S	*	*			trans	-75.8	131.6	170.2	-79.7	-92.9	0	0	0	110.7	H383	H383-H385 PolarHBondContact O-N 2.91Å
386	H	34	Very low	36.2	Very low	182 Å²	182	143.3 Å²	143.3	84%	0.843	76%	0.761	S	S	*	*			trans	-93.1	111.2	162.8	-77.7	-70	0	0	0	108.7	V388	H386-V388 PolarHBondContact O-N 2.9Å
387	D	39.4	Very low	36.4	Very low	156 Å²	156	144 Å²	144	83%	0.834	76%	0.76	S	S	*	*			trans	-76.2	103.1	172.8	-75	-40.5	0	0	0	110.6
388	V	38.1	Very low	36.4	Very low	96 Å²	96	144.3 Å²	144.3	58%	0.582	76%	0.762	S	S	*	*			trans	-135	121.5	159.2	-173.5	0	0	0	0	108.8	H386	H386-V388 PolarHBondContact O-N 2.9Å
389	P	38.9	Very low	36.7	Very low	127 Å²	127	144.1 Å²	144.1	83%	0.825	77%	0.766	S	S	*	*			trans	-74.1	132.7	175.1	-10.8	26.1	0	0	0	110.9
390	H	37.9	Very low	36.8	Very low	161 Å²	161	144 Å²	144	75%	0.745	77%	0.765	S	S	*	*			trans	-121.1	150.1	171.4	-74.7	-59	0	0	0	111.8
391	P	39.2	Very low	36.9	Very low	112 Å²	112	146.3 Å²	146.3	73%	0.727	77%	0.774	S	S	*	*			trans	-80.3	161.9	-170	33.5	-35.9	0	0	0	113.4
392	D	37.5	Very low	37.3	Very low	179 Å²	179	144.4 Å²	144.4	96%	0.957	77%	0.767	S	S	*	*	S	Bend	trans	-67.1	130.4	-168.3	-142.6	-3.8	0	0	0	113.2
393	G	45.1	Very low	37.5	Very low	73 Å²	73	145.7 Å²	145.7	75%	0.753	77%	0.765	S	S	*	*			trans	117.2	10.2	175.8	0	0	0	0	0	118
394	S	35.3	Very low	37.5	Very low	84 Å²	84	145.3 Å²	145.3	59%	0.587	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-87.9	126.9	177.8	-168.8	0	0	0	0	112.6
395	K	38.7	Very low	37.9	Very low	198 Å²	198	143.9 Å²	143.9	86%	0.861	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-80	126.3	167.5	-66.3	-174.1	179.7	-175	0	109.2
396	H	36.5	Very low	38.3	Very low	152 Å²	152	139.7 Å²	139.7	70%	0.704	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-84.6	127	179.2	-42.5	-63.1	0	0	0	110.9
397	H	31.5	Very low	38.5	Very low	182 Å²	182	136 Å²	136	84%	0.843	77%	0.769	S	S	*	*			trans	-104.6	125.1	154.1	-92.9	-116.5	0	0	0	107.1
398	H	33.7	Very low	38.4	Very low	156 Å²	156	137.9 Å²	137.9	72%	0.722	77%	0.766	S	S	*	*			trans	-97.3	114.5	164.9	-63.8	-67.8	0	0	0	108.3
399	T	35.4	Very low	38.2	Very low	128 Å²	128	144.9 Å²	144.9	79%	0.785	78%	0.782	S	S	*	*			trans	-96.9	124.7	162.8	28.4	0	0	0	0	108.5
400	H	40.6	Very low	38.2	Very low	154 Å²	154	147 Å²	147	71%	0.713	78%	0.78	S	S	*	*			trans	-103.2	109.4	170.9	-75	-78.3	0	0	0	109
401	D	38.8	Very low	37.8	Very low	164 Å²	164	142.9 Å²	142.9	88%	0.877	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-87.9	128.2	168.5	-82.8	-26	0	0	0	110.1
402	H	44.7	Very low	37.5	Very low	144 Å²	144	145.6 Å²	145.6	67%	0.667	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-98.7	145.7	170	-65.3	-69.3	0	0	0	110.8
403	K	38.4	Very low	37.1	Very low	186 Å²	186	141.9 Å²	141.9	81%	0.809	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-67	143.3	162.6	-86.6	-176.5	177.1	176.3	0	109.5	G405	K403-G405 PolarHBondContact O-N 3.02Å; K403-G405 VanDerWaalsContact O-N 3.13Å
404	P	33.3	Very low	36.4	Very low	139 Å²	139	145.9 Å²	145.9	90%	0.903	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	118.8	179.2	-17.9	29.3	0	0	0	110.8
405	G	43.6	Very low	36.2	Very low	82 Å²	82	147.6 Å²	147.6	85%	0.845	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	113.7	11.2	169.5	0	0	0	0	0	118.6	K403	K403-G405 PolarHBondContact O-N 3.02Å; K403-G405 VanDerWaalsContact O-N 3.13Å
406	S	43.6	Very low	35.9	Very low	79 Å²	79	146.1 Å²	146.1	55%	0.552	79%	0.785	S	S	*	*			trans	-82.4	125.1	173.7	58.6	0	0	0	0	112.8	Y408	S406-Y408 PolarHBondContact O-N 3.29Å
407	A	38.2	Very low	35.5	Very low	104 Å²	104	146 Å²	146	86%	0.86	79%	0.79	S	S	*	*			trans	-93.6	27.9	-173.5	0	0	0	0	0	115.5
408	Y	37.3	Very low	35.7	Very low	196 Å²	196	145.6 Å²	145.6	77%	0.769	79%	0.787	S	S	*	*			trans	-112	121.1	179.7	-108.8	-102.2	0	0	0	110.7	S406	S406-Y408 PolarHBondContact O-N 3.29Å
409	R	34.6	Very low	35.4	Very low	242 Å²	242	141.4 Å²	141.4	91%	0.913	79%	0.787	S	S	*	*			trans	-106.7	141.3	167.5	-67.4	-176.1	177.5	-163.5	-0.6	108.4
410	H	38.3	Very low	35.6	Very low	172 Å²	172	142.8 Å²	142.8	80%	0.796	79%	0.788	S	S	*	*			trans	-115.6	136.6	168.1	-81.9	-55.6	0	0	0	110
411	G	29.3	Very low	35.5	Very low	74 Å²	74	143.1 Å²	143.1	76%	0.763	80%	0.795	S	S	*	*			trans	-94.1	146.1	166.9	0	0	0	0	0	110.7
412	H	32.7	Very low	35.3	Very low	169 Å²	169	138.8 Å²	138.8	78%	0.782	79%	0.789	S	S	*	*			trans	-108.5	128.2	170.7	-103.1	35.8	0	0	0	108.2	H414	H412-H414 AromaticContact CD2-NE2 3.81Å
413	A	28.7	Very low	35.1	Very low	102 Å²	102	139.1 Å²	139.1	84%	0.843	80%	0.795	S	S	*	*			trans	-115.5	124.6	168	0	0	0	0	0	108
414	H	32.2	Very low	34.8	Very low	157 Å²	157	138.6 Å²	138.6	73%	0.727	80%	0.795	S	S	*	*			trans	-103.5	130.7	171.3	-68.5	-73.1	0	0	0	108.6	H412	H412-H414 AromaticContact CD2-NE2 3.81Å
415	S	30.6	Very low	34.8	Very low	120 Å²	120	138.4 Å²	138.4	84%	0.839	79%	0.787	S	S	*	*			trans	-115.2	131.5	169.5	-176.4	0	0	0	0	108.2
416	H	31.9	Very low	34.3	Very low	166 Å²	166	142.2 Å²	142.2	77%	0.769	78%	0.782	S	S	*	*			trans	-121.5	131	172	-92	-81.8	0	0	0	109.8
417	D	28.9	Very low	33.7	Very low	151 Å²	151	144.1 Å²	144.1	81%	0.807	79%	0.791	S	S	*	*			trans	-98.9	141	173.6	-174.3	20.3	0	0	0	109.5
418	H	34.7	Very low	33.3	Very low	172 Å²	172	148 Å²	148	80%	0.796	79%	0.79	S	S	*	*			trans	-119	108.9	174.2	-77.3	-63.1	0	0	0	110.3
419	G	27.8	Very low	33	Very low	69 Å²	69	142 Å²	142	71%	0.711	78%	0.782	S	S	*	*			trans	-73.4	134.6	169.2	0	0	0	0	0	113
420	I	39.6	Very low	32.7	Very low	156 Å²	156	140.2 Å²	140.2	80%	0.8	78%	0.776	S	S	*	*	S	Bend	trans	-4.5	111.9	153	-50.9	176.4	0	0	0	115.6
421	D	39.4	Very low	32.4	Very low	162 Å²	162	142 Å²	142	87%	0.866	79%	0.785	S	S	*	*			trans	163.5	119.5	133.1	-83.4	-28.4	0	0	0	110.3
422	G	34.4	Very low	32.6	Very low	72 Å²	72	142.3 Å²	142.3	74%	0.742	78%	0.78	S	S	*	*			trans	159.4	85.2	171.3	0	0	0	0	0	115.5
423	D	40.1	Very low	33	Very low	151 Å²	151	144.2 Å²	144.2	81%	0.807	79%	0.786	S	S	*	*			trans	-65.2	116.7	171.2	-174.1	24.4	0	0	0	111.7
424	H	32.7	Very low	33.1	Very low	175 Å²	175	144.4 Å²	144.4	81%	0.81	79%	0.787	S	S	*	*			trans	-149.4	114.7	165.3	-78.3	-55.4	0	0	0	112.8
425	D	32.8	Very low	33.2	Very low	136 Å²	136	145.1 Å²	145.1	73%	0.727	79%	0.791	S	S	*	*			trans	-85	132.8	179.3	-164.8	12.5	0	0	0	111.2
426	H	32.4	Very low	33.2	Very low	161 Å²	161	145.9 Å²	145.9	75%	0.745	79%	0.786	S	S	*	*			trans	-136.1	105.7	169.7	-83.8	-61.6	0	0	0	112
427	V	30.6	Very low	33.4	Very low	120 Å²	120	146.4 Å²	146.4	73%	0.727	79%	0.788	S	S	*	*			trans	-75.3	124.6	170.3	175.4	0	0	0	0	110.1
428	H	30.8	Very low	33.6	Very low	185 Å²	185	145.1 Å²	145.1	86%	0.856	79%	0.786	S	S	*	*			trans	-105.2	109.4	164.5	-76.6	-74	0	0	0	110.9
429	A	30.8	Very low	33.5	Very low	71 Å²	71	140.8 Å²	140.8	59%	0.587	79%	0.788	S	S	*	*			trans	-100.7	140.8	167.3	0	0	0	0	0	110.3
430	Y	29	Very low	33.7	Very low	203 Å²	203	140.7 Å²	140.7	80%	0.796	79%	0.787	S	S	*	*			trans	90.1	101.4	165.7	-64.5	-84.4	0	0	0	119.7
431	H	32	Very low	33.4	Very low	210 Å²	210	143.4 Å²	143.4	97%	0.972	79%	0.793	S	S	*	*			trans	-129	98.8	134	-78.4	-73.6	0	0	0	110
432	A	32.5	Very low	33.6	Very low	81 Å²	81	140.6 Å²	140.6	67%	0.669	78%	0.784	S	S	*	*			trans	-114	95.8	162.9	0	0	0	0	0	107.8
433	K	40.7	Very low	34	Very low	209 Å²	209	144 Å²	144	91%	0.909	79%	0.785	S	S	*	*			trans	165	74	153.7	-90.6	164.2	-171	-174.4	0	109.5
434	A	32.1	Very low	33.6	Very low	105 Å²	105	144.7 Å²	144.7	87%	0.868	78%	0.783	S	S	*	*			trans	-99.4	112.5	153.3	0	0	0	0	0	106.7
435	Q	34.2	Very low	33.5	Very low	173 Å²	173	145 Å²	145	81%	0.808	79%	0.785	S	S	*	*			trans	-72.6	139.2	173	-76.3	-176.9	-21.5	0	0	109.8
436	N	29.3	Very low	33.6	Very low	135 Å²	135	145.5 Å²	145.5	72%	0.722	78%	0.782	S	S	*	*			trans	-71.6	121.7	-178.2	-168.9	13.4	0	0	0	110.5
437	H	36.9	Very low	33.5	Very low	177 Å²	177	144.3 Å²	144.3	82%	0.819	78%	0.782	S	S	*	*			trans	-115	87.4	165.1	-75	-70	0	0	0	110
438	T	33.7	Very low	33.7	Very low	125 Å²	125	147.5 Å²	147.5	77%	0.767	78%	0.782	S	S	*	*			trans	-76.4	121.1	156.1	27.5	0	0	0	0	109.9
439	G	32.5	Very low	33.7	Very low	81 Å²	81	144.1 Å²	144.1	84%	0.835	77%	0.774	S	S	*	*			trans	163	113.5	166.1	0	0	0	0	0	112.6
440	G	31.5	Very low	33.9	Very low	67 Å²	67	148.2 Å²	148.2	69%	0.691	78%	0.781	S	S	*	*			trans	-88.4	178.6	-169.6	0	0	0	0	0	117.5
441	F	32.4	Very low	33.9	Very low	212 Å²	212	144.2 Å²	144.2	93%	0.93	78%	0.78	S	S	*	*			trans	107	146.9	166.2	-62	-69.1	0	0	0	117.9
442	P	43.3	Very low	34	Very low	103 Å²	103	139.4 Å²	139.4	67%	0.669	78%	0.777	S	S	*	*			trans	-108.3	161.7	-137.3	39.6	-31.4	0	0	0	114.4
443	N	42.7	Very low	34.4	Very low	145 Å²	145	138.5 Å²	138.5	78%	0.775	78%	0.775	S	S	*	*			trans	62	96.4	168.1	-62.7	-7.3	0	0	0	116.9
444	Q	32.5	Very low	33.9	Very low	164 Å²	164	135.6 Å²	135.6	77%	0.766	78%	0.775	S	S	*	*			trans	-132	101.5	151	-66.2	-166.7	15.8	0	0	109.7
445	H	31.1	Very low	34.3	Very low	183 Å²	183	139.5 Å²	139.5	85%	0.847	78%	0.775	S	S	*	*			trans	-78.7	117.9	158.9	-74	-87.9	0	0	0	107.4	N447	H445-N447 PolarHBondContact O-N 3.06Å
446	H	33.6	Very low	34.3	Very low	145 Å²	145	137.7 Å²	137.7	67%	0.671	78%	0.776	S	S	*	*			trans	-83	104.5	168.6	-69.6	-66.7	0	0	0	109.3	Y448	H446-Y448 HydrophobicContact CB-CD2 4.35Å; H446-Y448 PolarHBondContact O-N 3.39Å
447	N	30.4	Very low	34.4	Very low	137 Å²	137	139 Å²	139	73%	0.733	78%	0.777	S	S	*	*			trans	-71.3	105	163.4	178.5	7.2	0	0	0	108.5	H445	H445-N447 PolarHBondContact O-N 3.06Å
448	Y	36	Very low	34	Very low	186 Å²	186	136.9 Å²	136.9	73%	0.729	77%	0.772	S	S	*	*			trans	-103.6	105	168.3	-103.5	-92.6	0	0	0	109.1	H446 H450	H446-Y448 HydrophobicContact CB-CD2 4.35Å; H446-Y448 PolarHBondContact O-N 3.39Å; Y448-H450 AromaticContact CD1-NE2 3.95Å
449	T	30.7	Very low	33.8	Very low	114 Å²	114	139.2 Å²	139.2	70%	0.699	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-101.1	123.1	166.2	4.5	0	0	0	0	108.1
450	H	34	Very low	33.8	Very low	157 Å²	157	142.6 Å²	142.6	73%	0.727	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-93.5	128.2	169.6	-73.8	-73.6	0	0	0	110.1	Y448	Y448-H450 AromaticContact CD1-NE2 3.95Å
451	P	30.4	Very low	33.8	Very low	120 Å²	120	148.1 Å²	148.1	78%	0.779	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-71.4	147.9	166.9	2.3	12.4	0	0	0	110.3
452	A	33.1	Very low	33.8	Very low	109 Å²	109	147.4 Å²	147.4	90%	0.901	78%	0.78	S	S	*	*	S	Bend	trans	-70.6	133.9	-176.6	0	0	0	0	0	113.1
453	G	40.2	Very low	33.5	Very low	62 Å²	62	151.5 Å²	151.5	64%	0.639	79%	0.79	S	S	*	*			trans	114.4	135.9	159.7	0	0	0	0	0	115
454	T	30.3	Very low	33.1	Very low	148 Å²	148	149 Å²	149	91%	0.908	79%	0.789	S	S	*	*			trans	82.4	96.9	171.2	58.9	0	0	0	0	117.7
455	H	41.1	Very low	33.2	Very low	187 Å²	187	148.8 Å²	148.8	87%	0.866	79%	0.792	S	S	*	*			trans	-68.3	139	157.6	-59.8	-87.1	0	0	0	110.4
456	T	34.7	Very low	33.9	Very low	134 Å²	134	146.9 Å²	146.9	82%	0.822	79%	0.789	S	S	*	*			trans	-166.9	127	140.2	42.9	0	0	0	0	109.3
457	H	31.1	Very low	33.8	Very low	162 Å²	162	147.9 Å²	147.9	75%	0.75	79%	0.793	S	S	*	*				157.2	128.4	105	-152.4	-78	0	0	0	112.4
458	D	28.7	Very low	34.2	Very low	133 Å²	133	150.6 Å²	150.6	71%	0.711	80%	0.801	S	S	*	*			trans	-68.9	162.7	177.4	-73.3	-52.7	0	0	0	114.9
459	H	30	Very low	34	Very low	174 Å²	174	148 Å²	148	81%	0.806	80%	0.796	S	S	*	*			trans	-148.7	137.5	130.6	-82.6	-55.3	0	0	0	114.1
460	D	32.3	Very low	34.1	Very low	152 Å²	152	150.7 Å²	150.7	81%	0.813	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-62.2	153.7	-171.4	-76.9	-56.7	0	0	0	118.2
461	H	31.8	Very low	33.7	Very low	184 Å²	184	149.4 Å²	149.4	85%	0.852	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-95.7	123.3	159.8	-70.3	-85.4	0	0	0	110.3
462	E	32.5	Very low	33.7	Very low	197 Å²	197	148.5 Å²	148.5	92%	0.921	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-87.6	135.3	165.3	-81.9	-159.3	162.2	0	0	112.1
463	H	36.2	Very low	33.6	Very low	189 Å²	189	150.9 Å²	150.9	88%	0.875	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-60.1	140.6	-174.9	-82.4	1.4	0	0	0	116.4
464	A	34.2	Very low	33	Very low	92 Å²	92	156.1 Å²	156.1	76%	0.76	81%	0.808	S	S	*	*			trans	-147.3	101.5	141.4	0	0	0	0	0	112.2
465	L	33.8	Very low	32.9	Very low	159 Å²	159	156.7 Å²	156.7	83%	0.832	80%	0.8	S	S	*	*			trans	61.8	97.5	134.3	-55.8	172.3	0	0	0	119.7	H467	L465-H467 PolarHBondContact O-N 3.49Å
466	D	47.4	Very low	32.4	Very low	143 Å²	143	156.4 Å²	156.4	77%	0.765	80%	0.799	S	S	*	*			trans	25	91.2	130	-159.8	10.6	0	0	0	117.6
467	H	31.1	Very low	32.3	Very low	166 Å²	166	157.8 Å²	157.8	77%	0.769	80%	0.795	S	S	*	*			trans	-147.3	113.8	144.6	-80.1	-57.9	0	0	0	109.1	L465 H469	L465-H467 PolarHBondContact O-N 3.49Å; H467-H469 PolarHBondContact O-N 2.93Å; H467-H469 VanDerWaalsContact O-N 3.09Å
468	E	38.6	Very low	32.2	Very low	194 Å²	194	157.1 Å²	157.1	91%	0.907	79%	0.793	S	S	*	*			trans	-56	111.7	160.6	-84.1	-178.6	150.6	0	0	109.1
469	H	31.8	Very low	32.3	Very low	131 Å²	131	157.3 Å²	157.3	61%	0.606	79%	0.789	S	S	*	*			trans	-125.7	111.3	161.7	-92.5	83.4	0	0	0	108.2	H467 H471	H467-H469 PolarHBondContact O-N 2.93Å; H467-H469 VanDerWaalsContact O-N 3.09Å; H469-H471 AromaticContact CD2-CE1 3.61Å; H469-H471 AromaticContact CD2-NE2 3.1Å; H469-H471 PolarHBondContact CD2-NE2 3.38Å; H469-H471 AromaticContact CG-NE2 3.64Å; H469-H471 PolarHBondContact O-N 2.97Å
470	N	31.8	Very low	32.2	Very low	172 Å²	172	156.1 Å²	156.1	92%	0.92	78%	0.783	S	S	*	*			trans	-79.4	103.6	162.2	-75.1	-25.7	0	0	0	107.6
471	H	27.3	Very low	32.2	Very low	129 Å²	129	156.2 Å²	156.2	60%	0.597	78%	0.779	S	S	*	*			trans	-112.9	137.3	164.3	-67.6	-61.3	0	0	0	109.4	H469 H473	H469-H471 AromaticContact CD2-CE1 3.61Å; H469-H471 AromaticContact CD2-NE2 3.1Å; H469-H471 PolarHBondContact CD2-NE2 3.38Å; H469-H471 AromaticContact CG-NE2 3.64Å; H469-H471 PolarHBondContact O-N 2.97Å; H471-H473 PolarHBondContact O-N 3.15Å
472	A	30.4	Very low	32.2	Very low	102 Å²	102	154.2 Å²	154.2	84%	0.843	77%	0.769	S	S	*	*			trans	-73.2	117.5	164.9	0	0	0	0	0	108
473	H	30.5	Very low	32.1	Very low	158 Å²	158	153.2 Å²	153.2	73%	0.731	76%	0.764	S	S	*	*			trans	-80	120.1	165.3	-70.7	-80.3	0	0	0	107.9	H471 H475	H471-H473 PolarHBondContact O-N 3.15Å; H473-H475 PolarHBondContact O-N 3.24Å
474	L	27.6	Very low	31.9	Very low	173 Å²	173	150.7 Å²	150.7	91%	0.906	75%	0.753	S	S	*	*			trans	-70.3	110.2	158.5	-122	90	0	0	0	105.9	E476	L474-E476 PolarHBondContact O-N 3.08Å
475	H	28.2	Very low	31.6	Very low	160 Å²	160	154.1 Å²	154.1	74%	0.741	76%	0.757	S	S	*	*			trans	-69.6	111.9	160.1	-74.7	-80.4	0	0	0	106.5	H473 H477	H473-H475 PolarHBondContact O-N 3.24Å; H475-H477 PolarHBondContact O-N 3.47Å
476	E	31.2	Very low	31.6	Very low	181 Å²	181	152.5 Å²	152.5	85%	0.846	75%	0.745	S	S	*	*			trans	-53.9	123.1	143	-121.6	174.7	174.4	0	0	104.5	L474 E478	L474-E476 PolarHBondContact O-N 3.08Å; E476-E478 PolarHBondContact O-N 2.94Å
477	H	31.2	Very low	30.7	Very low	162 Å²	162	154.6 Å²	154.6	75%	0.75	75%	0.75	S	S	*	*			trans	-65.3	79.8	166.9	-114.4	90.7	0	0	0	105.9	H475 H479	H475-H477 PolarHBondContact O-N 3.47Å; H477-H479 VanDerWaalsContact C-N 3.25Å; H477-H479 PolarHBondContact O-N 3.4Å
478	E	29.7	Very low	30.6	Very low	149 Å²	149	154 Å²	154	70%	0.696	75%	0.748	S	S	*	*			trans	-65.6	102.3	159	-140.2	175.4	-170.5	0	0	103.2	E476 H480	E476-E478 PolarHBondContact O-N 2.94Å; E478-H480 PolarHBondContact O-CD2 2.89Å; E478-H480 PolarHBondContact O-N 3.42Å
479	H	31	Very low	30.2	Very low	137 Å²	137	151.2 Å²	151.2	63%	0.634	74%	0.735	S	S	*	*			trans	-56.3	92.4	168.1	-69.9	-91.3	0	0	0	105.6	H477 H481	H477-H479 VanDerWaalsContact C-N 3.25Å; H477-H479 PolarHBondContact O-N 3.4Å; H479-H481 PolarHBondContact O-N 2.9Å
480	H	28.4	Very low	30	Very low	148 Å²	148	151.8 Å²	151.8	69%	0.685	75%	0.747	S	S	*	*			trans	-59.5	98.7	165.1	-77	-79.6	0	0	0	104.3	E478 H482	E478-H480 PolarHBondContact O-CD2 2.89Å; E478-H480 PolarHBondContact O-N 3.42Å; H480-H482 PolarHBondContact O-N 3.38Å
481	H	32	Very low	30.3	Very low	155 Å²	155	148.2 Å²	148.2	72%	0.718	73%	0.725	S	S	*	*			trans	-60.8	86.5	166.3	-70	-71.3	0	0	0	105.5	H479 H483	H479-H481 PolarHBondContact O-N 2.9Å; H481-H483 PolarHBondContact O-N 2.79Å
482	H	31	Very low	30.6	Very low	142 Å²	142	149.1 Å²	149.1	66%	0.657	73%	0.73	S	S	*	*			trans	-58.7	101.6	151.4	-75.6	-77.1	0	0	0	103.9	H480 H484	H480-H482 PolarHBondContact O-N 3.38Å; H482-H484 PolarHBondContact O-N 3.47Å
483	H	30.2	Very low	31	Very low	175 Å²	175	150.5 Å²	150.5	81%	0.81	72%	0.718	S	S	*	*			trans	-63.6	71.7	160.4	-72.9	-76	0	0	0	106.7	H481 L485	H481-H483 PolarHBondContact O-N 2.79Å; H483-L485 VanDerWaalsContact C-N 3.33Å; H483-L485 PolarHBondContact O-N 2.85Å; H483-L485 VanDerWaalsContact O-N 3.11Å
484	H	32.7	Very low	32.1	Very low	136 Å²	136	146 Å²	146	63%	0.63	70%	0.7	S	S	*	*			trans	-59.3	113.9	147.1	-69.4	-68.7	0	0	0	103.6	H482 H486	H482-H484 PolarHBondContact O-N 3.47Å; H484-H486 PolarHBondContact O-N 3.16Å
485	L	28.6	Very low	33.8	Very low	165 Å²	165	145.6 Å²	145.6	86%	0.864	69%	0.693	S	S	*	*			trans	-53.1	98	154.6	-91.8	136.1	0	0	0	104.7	H483 E487	H483-L485 VanDerWaalsContact C-N 3.33Å; H483-L485 PolarHBondContact O-N 2.85Å; H483-L485 VanDerWaalsContact O-N 3.11Å; L485-E487 PolarHBondContact O-N 3.43Å
486	H	34	Very low	36	Very low	124 Å²	124	139.2 Å²	139.2	57%	0.574	67%	0.666	S	S	*	*			trans	-59.4	99.1	155	-63.3	-74.8	0	0	0	103.3	H484 H488	H484-H486 PolarHBondContact O-N 3.16Å; H486-H488 PolarHBondContact O-N 2.94Å
487	E	27.2	Very low	38.3	Very low	187 Å²	187	136.7 Å²	136.7	87%	0.874	65%	0.654	S	S	*	*			trans	-56.9	95.1	142.5	-74.6	-170.6	165	0	0	103.6	L485 E489	L485-E487 PolarHBondContact O-N 3.43Å; E487-E489 PolarHBondContact O-N 3.38Å
488	H	30	Very low	40.8	Very low	154 Å²	154	130.7 Å²	130.7	71%	0.713	64%	0.637	S	S	*	*			trans	-48.2	128.6	161.6	-71	-78.9	0	0	0	104.8	H486 T490	H486-H488 PolarHBondContact O-N 2.94Å; H488-T490 VanDerWaalsContact C-N 3.31Å; H488-T490 PolarHBondContact O-N 2.93Å
489	E	29.2	Very low	43.6	Very low	136 Å²	136	128 Å²	128	64%	0.636	63%	0.627	S	S	*	*			trans	-46.7	110.8	159.1	-101.6	175.8	155	0	0	105.7	E487 E491	E487-E489 PolarHBondContact O-N 3.38Å; E489-E491 PolarHBondContact O-N 2.96Å
490	T	28	Very low	46.4	Very low	142 Å²	142	124.1 Å²	124.1	87%	0.871	61%	0.61	S	S	*	*			trans	-78.8	4.9	176.8	40	0	0	0	0	110.3	H488 Q492	H488-T490 VanDerWaalsContact C-N 3.31Å; H488-T490 PolarHBondContact O-N 2.93Å; T490-Q492 PolarHBondContact O-N 3.28Å
491	E	37	Very low	49.5	Very low	98 Å²	98	121.1 Å²	121.1	46%	0.458	59%	0.593	S	S	.	*			trans	-65.4	106	168.3	-69.4	-162	172.7	0	0	108.6	E489 H493	E489-E491 PolarHBondContact O-N 2.96Å; E491-H493 VanDerWaalsContact C-N 3.34Å; E491-H493 PolarHBondContact O-N 2.92Å
492	Q	34.4	Very low	52.2	Low	148 Å²	148	118.6 Å²	118.6	69%	0.692	59%	0.588	S	S	*	*			trans	-54.4	98.8	165.2	-171.3	173.2	9.7	0	0	107.9	T490 D494	T490-Q492 PolarHBondContact O-N 3.28Å; Q492-D494 PolarHBondContact O-N 3.47Å
493	H	39.5	Very low	55.1	Low	130 Å²	130	113 Å²	113	60%	0.602	56%	0.563	S	S	*	*			trans	-66	104.3	163.3	-68.1	-56.6	0	0	0	106.1	E491 E495	E491-H493 VanDerWaalsContact C-N 3.34Å; E491-H493 PolarHBondContact O-N 2.92Å; H493-E495 PolarHBondContact O-N 3.35Å
494	D	52.9	Low	57.9	Low	65 Å²	65	106.9 Å²	106.9	35%	0.348	54%	0.539	S	S	.	.			trans	-64.9	91.6	165.2	-67.6	-42.1	0	0	0	106.5	Q492 K532	Q492-D494 PolarHBondContact O-N 3.47Å; D494-K532 IonicContact OD1-NZ 3.21Å; D494-K532 IonicContact OD2-NZ 4Å; D494-K532 PolarHBondContact OD2-NZ 3.34Å
495	E	63.5	Low	60.5	Low	163 Å²	163	100.6 Å²	100.6	76%	0.762	51%	0.511	S	S	*	.			trans	-54.2	131.2	165.9	-72.1	-176.4	159	0	0	107.3	H493	H493-E495 PolarHBondContact O-N 3.35Å
496	P	75.3	Confident	63.3	Low	27 Å²	27	95.4 Å²	95.4	18%	0.175	48%	0.483	C	S	.	.			trans	-60.4	144	-177.8	25.9	-34.1	0	0	0	110.3	D48 L126 Y127 Y129 G498	D48-P496 HydrophobicContact CB-CG 3.97Å; D48-P496 VanDerWaalsContact CG-CG 3.45Å; D48-P496 VanDerWaalsContact OD1-CD 3.31Å; D48-P496 WeakPolarHBondContact OD1-CD 3.42Å; D48-P496 WeakPolarHBondContact OD1-CG 3.46Å; L126-P496 HydrophobicContact CB-CB 4.46Å; L126-P496 HydrophobicContact CD2-CB 4.13Å; L126-P496 HydrophobicContact CD2-CG 4.23Å; L126-P496 HydrophobicContact CG-CB 4.05Å; L126-P496 WeakPolarHBondContact O-CB 3.29Å; Y127-P496 WeakPolarHBondContact O-CA 3.46Å; Y129-P496 HydrophobicContact CD1-CB 4.29Å; Y129-P496 HydrophobicContact CE1-CB 4.32Å; Y129-P496 HydrophobicContact CE1-CG 4.15Å; P496-G498 VanDerWaalsContact C-N 3.32Å; P496-G498 PolarHBondContact O-N 2.77Å
497	E	79.4	Confident	65.7	Low	127 Å²	127	94 Å²	94	59%	0.593	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	92.3	168.5	-70.2	-179.2	-172.1	0	0	109.1	Y127 K128 Y129	Y127-E497 PolarHBondContact O-N 2.89Å; K128-E497 WeakPolarHBondContact CA-O 3.46Å; K128-E497 HydrophobicContact CG-CB 4.25Å; K128-E497 IonicContact NZ-OE2 3.65Å; K128-E497 PolarHBondContact NZ-OE2 2.88Å; Y129-E497 PolarHBondContact N-O 3.37Å
498	G	83.1	Confident	68.2	Low	37 Å²	37	90.3 Å²	90.3	38%	0.381	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	130.3	-176.8	0	0	0	0	0	114	P496	P496-G498 VanDerWaalsContact C-N 3.32Å; P496-G498 PolarHBondContact O-N 2.77Å
499	L	88.2	Confident	70.1	Confident	92 Å²	92	88.4 Å²	88.4	48%	0.482	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.2	170.5	-174.8	65.6	0	0	0	111.2	Y129 D130 C131 R501	Y129-L499 PolarHBondContact O-N 3.02Å; D130-L499 WeakPolarHBondContact CA-O 3.2Å; C131-L499 PolarHBondContact N-O 3.28Å; L499-R501 HydrophobicContact CD2-CG 4.13Å; L499-R501 HydrophobicContact CG-CG 4.13Å
500	I	90.3	Very high	71.8	Confident	55 Å²	55	85.9 Å²	85.9	28%	0.282	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124.3	170.9	-53.3	-63.3	0	0	0	109.2	R49 F55 Y129 C131 I133	R49-I500 HydrophobicContact CG-CD1 4.44Å; R49-I500 HydrophobicContact CG-CG1 4.31Å; F55-I500 HydrophobicContact CE2-CD1 4.2Å; Y129-I500 HydrophobicContact CD2-CD1 4.32Å; Y129-I500 HydrophobicContact CE2-CD1 3.65Å; Y129-I500 HydrophobicContact CE2-CG1 4.31Å; C131-I500 HydrophobicContact CB-CD1 3.44Å; C131-I500 VanDerWaalsContact CB-CD1 3.44Å; C131-I500 CarbonylContact O-C 3.57Å; C131-I500 WeakPolarHBondContact O-CA 3.03Å; C131-I500 VanDerWaalsContact SG-CD1 3.59Å; I133-I500 HydrophobicContact CD1-CG2 4.38Å
501	R	92.3	Very high	72.9	Confident	86 Å²	86	86.9 Å²	86.9	33%	0.325	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	113.8	176.2	-66.2	173.7	63.1	177.3	1.9	110.2	C131 V132 I133 L499	C131-R501 PolarHBondContact O-N 3.32Å; V132-R501 WeakPolarHBondContact CA-O 3.42Å; V132-R501 HydrophobicContact CG2-CB 4.38Å; I133-R501 PolarHBondContact N-O 3Å; L499-R501 HydrophobicContact CD2-CG 4.13Å; L499-R501 HydrophobicContact CG-CG 4.13Å
502	T	90.1	Very high	73.4	Confident	101 Å²	101	86.6 Å²	86.6	62%	0.62	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	120.1	168.5	-50.2	0	0	0	0	109.3	I133	I133-T502 HydrophobicContact CD1-CG2 4.48Å; I133-T502 HydrophobicContact CG1-CG2 4.17Å; I133-T502 WeakPolarHBondContact O-CA 3.38Å
503	L	91.4	Very high	73.6	Confident	24 Å²	24	83.6 Å²	83.6	13%	0.126	45%	0.446	C	S	.	.			trans	-104.1	158.9	174.5	-56.9	179.1	0	0	0	110.1	V132 I133 R134 P135 M510 L575	V132-L503 HydrophobicContact CG1-CD1 3.37Å; V132-L503 HydrophobicContact CG1-CG 3.86Å; I133-L503 PolarHBondContact O-N 2.76Å; R134-L503 HydrophobicContact CG-CB 3.84Å; R134-L503 VanDerWaalsContact NH1-CB 3.25Å; P135-L503 WeakPolarHBondContact CD-O 3.16Å; L503-M510 HydrophobicContact CD1-SD 4.18Å; L503-L575 HydrophobicContact CD1-CD1 3.51Å
504	P	88.1	Confident	73.4	Confident	48 Å²	48	83.1 Å²	83.1	31%	0.312	46%	0.457	S	S	.	.			trans	-58.2	167	172.4	-23.8	34.6	0	0	0	112.3	R134 Q508	R134-P504 WeakPolarHBondContact CD-O 3.35Å; R134-P504 WeakPolarHBondContact CG-O 3.43Å; R134-P504 PolarHBondContact NH1-O 3.11Å; P504-Q508 HydrophobicContact CB-CB 3.83Å
505	A	87.5	Confident	72.9	Confident	4 Å²	4	87.7 Å²	87.7	3%	0.033	47%	0.474	C	S	.	.			trans	-56.9	152.9	169.9	0	0	0	0	0	110.9	P135 P137 D507 Q508	P135-A505 HydrophobicContact CG-CB 4.25Å; P135-A505 WeakPolarHBondContact O-CA 3.36Å; P135-A505 WeakPolarHBondContact O-CB 3.5Å; P137-A505 HydrophobicContact CG-CB 4.29Å; A505-D507 WeakPolarHBondContact CB-OD1 3.5Å; A505-D507 PolarHBondContact O-N 3.12Å; A505-D507 VanDerWaalsContact O-N 3.15Å; A505-Q508 HydrophobicContact CB-CG 4.36Å; A505-Q508 WeakPolarHBondContact O-CB 3.3Å; A505-Q508 PolarHBondContact O-N 2Å
506	I	88.3	Confident	71.6	Confident	56 Å²	56	84.8 Å²	84.8	29%	0.287	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-28	-174.2	-173.5	-178.9	0	0	0	113.6	P137 Q508 L569 D573	P137-I506 HydrophobicContact CG-CG2 3.48Å; P137-I506 VanDerWaalsContact CG-CG2 3.48Å; I506-Q508 VanDerWaalsContact C-N 3.31Å; I506-L569 HydrophobicContact CG2-CD2 4.18Å; I506-D573 HydrophobicContact CD1-CB 3.91Å
507	D	83.5	Confident	70.2	Confident	94 Å²	94	90.2 Å²	90.2	50%	0.503	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-7.8	177.8	63.2	-32	0	0	0	113.5	P137 A505	P137-D507 HydrophobicContact CB-CB 4.44Å; P137-D507 WeakPolarHBondContact CB-OD1 3.32Å; P137-D507 HydrophobicContact CG-CB 4.49Å; A505-D507 WeakPolarHBondContact CB-OD1 3.5Å; A505-D507 PolarHBondContact O-N 3.12Å; A505-D507 VanDerWaalsContact O-N 3.15Å
508	Q	81	Confident	68.4	Low	109 Å²	109	89.1 Å²	89.1	51%	0.509	50%	0.499	S	S	.	.	S	Bend	trans	-97	142.3	179.7	-65.7	-175.2	-5	0	0	111.7	P504 A505 I506 M510	P504-Q508 HydrophobicContact CB-CB 3.83Å; A505-Q508 HydrophobicContact CB-CG 4.36Å; A505-Q508 WeakPolarHBondContact O-CB 3.3Å; A505-Q508 PolarHBondContact O-N 2Å; I506-Q508 VanDerWaalsContact C-N 3.31Å; Q508-M510 PolarHBondContact O-N 3.19Å
509	P	70.1	Confident	66	Low	114 Å²	114	92.3 Å²	92.3	74%	0.74	51%	0.513	S	S	*	.			trans	-64.4	128.1	179.7	25.9	-32.9	0	0	0	110.9	I511	P509-I511 PolarHBondContact O-N 3.24Å
510	M	64.4	Low	63.5	Low	84 Å²	84	93.2 Å²	93.2	41%	0.414	53%	0.534	S	S	.	.			trans	-80.5	110.6	168.2	-82.1	-173	-79.1	0	0	109.6	R134 L503 Q508 L512	R134-M510 PolarHBondContact NH2-SD 3.48Å; L503-M510 HydrophobicContact CD1-SD 4.18Å; Q508-M510 PolarHBondContact O-N 3.19Å; M510-L512 HydrophobicContact CB-CD1 4.39Å; M510-L512 PolarHBondContact O-N 3.33Å; M510-L512 HydrophobicContact SD-CD1 4.18Å
511	I	51	Low	61.1	Low	162 Å²	162	93.6 Å²	93.6	83%	0.831	55%	0.545	S	S	*	.			trans	-83.6	81.3	157.6	-51.6	176.4	0	0	0	105.8	P509 P513	P509-I511 PolarHBondContact O-N 3.24Å; I511-P513 WeakPolarHBondContact O-CD 3.26Å
512	L	47.4	Very low	58.5	Low	93 Å²	93	92 Å²	92	49%	0.487	56%	0.556	S	S	.	*			trans	-66.1	122.1	165.9	-93.3	144.1	0	0	0	106.7	M510 S514	M510-L512 HydrophobicContact CB-CD1 4.39Å; M510-L512 PolarHBondContact O-N 3.33Å; M510-L512 HydrophobicContact SD-CD1 4.18Å; L512-S514 PolarHBondContact O-N 2.7Å; L512-S514 VanDerWaalsContact O-N 3.14Å
513	P	37.7	Very low	55.9	Low	84 Å²	84	93.4 Å²	93.4	55%	0.545	57%	0.566	S	S	.	*			trans	-58.5	124.7	158.2	26.3	-30	0	0	0	105.9	I511 F515	I511-P513 WeakPolarHBondContact O-CD 3.26Å; P513-F515 HydrophobicContact CB-CD2 3.66Å; P513-F515 HydrophobicContact CB-CE2 3.54Å; P513-F515 HydrophobicContact CG-CD2 3.79Å; P513-F515 HydrophobicContact CG-CE2 3.85Å; P513-F515 PolarHBondContact O-N 3.3Å
514	S	36.1	Very low	53.3	Low	121 Å²	121	100.4 Å²	100.4	85%	0.846	60%	0.598	S	S	*	*			trans	-67.4	74.5	179.4	50.7	0	0	0	0	109.5	L512	L512-S514 PolarHBondContact O-N 2.7Å; L512-S514 VanDerWaalsContact O-N 3.14Å
515	F	41.4	Very low	50.9	Low	160 Å²	160	104.3 Å²	104.3	70%	0.702	62%	0.621	S	S	*	*			trans	-94.4	128.1	162.7	-69.7	-75.1	0	0	0	106.6	P513 D517	P513-F515 HydrophobicContact CB-CD2 3.66Å; P513-F515 HydrophobicContact CB-CE2 3.54Å; P513-F515 HydrophobicContact CG-CD2 3.79Å; P513-F515 HydrophobicContact CG-CE2 3.85Å; P513-F515 PolarHBondContact O-N 3.3Å; F515-D517 PolarHBondContact O-N 2.86Å
516	P	37.6	Very low	48.3	Very low	103 Å²	103	107.4 Å²	107.4	67%	0.669	65%	0.654	S	S	*	*			trans	-60.5	126.4	171.6	24.3	-30.2	0	0	0	108.4	V518	P516-V518 PolarHBondContact O-N 2.77Å
517	D	45.4	Very low	45.5	Very low	140 Å²	140	110.4 Å²	110.4	75%	0.749	67%	0.674	S	S	*	*	S	Bend	trans	-65.1	7.5	173.9	-66.3	-54.3	0	0	0	112.8	F515	F515-D517 PolarHBondContact O-N 2.86Å
518	V	40.9	Very low	43.3	Very low	104 Å²	104	112.5 Å²	112.5	63%	0.63	69%	0.691	S	S	*	*	S	Bend	trans	-131.4	121.3	-178.1	-171.3	0	0	0	0	107.3	P516 A520	P516-V518 PolarHBondContact O-N 2.77Å; V518-A520 PolarHBondContact O-N 2.83Å
519	P	34	Very low	41.8	Very low	104 Å²	104	114 Å²	114	68%	0.675	70%	0.701	S	S	*	*			trans	-51.4	135.2	167.2	-21.7	31.7	0	0	0	109.2	A521	P519-A521 PolarHBondContact O-N 2.93Å
520	A	35.1	Very low	41	Very low	112 Å²	112	114.1 Å²	114.1	93%	0.926	70%	0.702	S	S	*	*	S	Bend	trans	-66.6	13.8	177.1	0	0	0	0	0	113.9	V518 G522	V518-A520 PolarHBondContact O-N 2.83Å; A520-G522 PolarHBondContact O-N 3.41Å
521	A	40.6	Very low	40.9	Very low	62 Å²	62	116.3 Å²	116.3	51%	0.512	72%	0.715	S	S	.	*			trans	-74.7	119.1	167.2	0	0	0	0	0	107.3	P519	P519-A521 PolarHBondContact O-N 2.93Å
522	G	37.6	Very low	42.1	Very low	54 Å²	54	112.6 Å²	112.6	56%	0.557	69%	0.693	S	S	*	*			trans	-56.7	-173.3	167.4	0	0	0	0	0	111.8	A520 E524	A520-G522 PolarHBondContact O-N 3.41Å; G522-E524 PolarHBondContact O-N 2.84Å
523	P	34.4	Very low	43.7	Very low	129 Å²	129	112.9 Å²	112.9	84%	0.838	70%	0.7	S	S	*	*	S	Bend	trans	-49.2	114.8	-177.7	21.1	-31.7	0	0	0	109.4	V525	P523-V525 PolarHBondContact O-N 3.39Å
524	E	37.8	Very low	45.6	Very low	171 Å²	171	109.2 Å²	109.2	80%	0.799	68%	0.676	S	S	*	*			trans	-58.2	113.9	179.5	-68.7	-160.9	155.8	0	0	106.8	G522 G526	G522-E524 PolarHBondContact O-N 2.84Å; E524-G526 PolarHBondContact O-N 3.32Å
525	V	36.3	Very low	47.6	Very low	131 Å²	131	106.6 Å²	106.6	79%	0.794	66%	0.656	S	S	*	*			trans	-58.2	110.6	166.2	176.3	0	0	0	0	104.5	P523 V527	P523-V525 PolarHBondContact O-N 3.39Å; V525-V527 PolarHBondContact O-N 3.09Å
526	G	33.8	Very low	49.5	Very low	69 Å²	69	101.8 Å²	101.8	71%	0.711	64%	0.642	S	S	*	*			trans	-50.8	102.2	-176.8	0	0	0	0	0	110.2	E524 T528	E524-G526 PolarHBondContact O-N 3.32Å; G526-T528 PolarHBondContact O-N 3.37Å
527	V	30.4	Very low	51.5	Low	118 Å²	118	96.9 Å²	96.9	72%	0.715	61%	0.61	S	S	*	*			trans	-78.1	115.3	165.2	178.9	0	0	0	0	104.3	V525 L529	V525-V527 PolarHBondContact O-N 3.09Å; V527-L529 PolarHBondContact O-N 3.02Å
528	T	35.8	Very low	53.1	Low	139 Å²	139	96.1 Å²	96.1	85%	0.853	61%	0.613	S	S	*	*			trans	-62.5	91.7	171.4	-18.8	0	0	0	0	107.2	G526	G526-T528 PolarHBondContact O-N 3.37Å
529	L	49.8	Very low	54.9	Low	141 Å²	141	95.4 Å²	95.4	74%	0.738	63%	0.627	S	S	*	*			trans	-60.9	135.1	173.8	-76.2	165.6	0	0	0	107.7	V527 L531	V527-L529 PolarHBondContact O-N 3.02Å; L529-L531 PolarHBondContact O-N 3.01Å
530	P	52.6	Low	57.2	Low	116 Å²	116	92.9 Å²	92.9	75%	0.753	61%	0.606	S	S	*	*			trans	-56.2	131.6	176.2	-20.9	31.7	0	0	0	109.6	K532	P530-K532 PolarHBondContact O-N 3.21Å
531	L	62.3	Low	59.5	Low	130 Å²	130	89.8 Å²	89.8	68%	0.681	58%	0.576	S	S	*	*			trans	-56.8	108.3	173.1	-72.7	164.1	0	0	0	109	L529 P533 T541	L529-L531 PolarHBondContact O-N 3.01Å; L531-P533 WeakPolarHBondContact O-CD 3.36Å; L531-T541 HydrophobicContact CB-CG2 3.84Å; L531-T541 HydrophobicContact CD2-CG2 4.44Å
532	K	77.6	Confident	61.6	Low	84 Å²	84	87.9 Å²	87.9	37%	0.365	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-74.5	122.8	177.4	-176.1	171.3	161.7	-143.7	0	108.7	D494 P530 T541 E542	D494-K532 IonicContact OD1-NZ 3.21Å; D494-K532 IonicContact OD2-NZ 4Å; D494-K532 PolarHBondContact OD2-NZ 3.34Å; P530-K532 PolarHBondContact O-N 3.21Å; K532-T541 CarbonylContact O-C 3.6Å; K532-T541 VanDerWaalsContact O-CA 3.22Å; K532-T541 WeakPolarHBondContact O-CA 3.49Å; K532-T541 WeakPolarHBondContact O-CB 2.96Å; K532-E542 WeakPolarHBondContact CD-OE2 3.39Å; K532-E542 VanDerWaalsContact CE-OE2 3.22Å; K532-E542 WeakPolarHBondContact CE-OE2 3.41Å; K532-E542 IonicContact NZ-OE1 2.61Å; K532-E542 PolarHBondContact NZ-OE1 2.92Å; K532-E542 IonicContact NZ-OE2 3.51Å; K532-E542 PolarHBondContact NZ-OE2 3.33Å; K532-E542 PolarHBondContact O-N 3.47Å
533	P	79.9	Confident	63.9	Low	98 Å²	98	85.8 Å²	85.8	64%	0.636	53%	0.533	S	S	*	.	B	Isolated β-bridge	trans	-59.2	140.3	172.9	-22.8	34.1	0	0	0	111.1	L531	L531-P533 WeakPolarHBondContact O-CD 3.36Å
534	D	77.5	Confident	66.3	Low	7 Å²	7	84.6 Å²	84.6	4%	0.037	52%	0.523	C	S	.	.	P	Polyproline II helix	trans	-74	122	176.5	-172.9	-52.7	0	0	0	109.6	R125 S536 I537 Q540 E542	R125-D534 IonicContact CZ-OD1 2.82Å; R125-D534 IonicContact CZ-OD2 2.96Å; R125-D534 VanDerWaalsContact NH1-CG 3.31Å; R125-D534 IonicContact NH1-OD1 2.82Å; R125-D534 PolarHBondContact NH1-OD1 2.71Å; R125-D534 VanDerWaalsContact NH1-OD1 3.15Å; R125-D534 IonicContact NH1-OD2 3.52Å; R125-D534 PolarHBondContact NH1-OD2 2.82Å; R125-D534 IonicContact NH2-OD1 2.67Å; R125-D534 PolarHBondContact NH2-OD1 3.22Å; R125-D534 IonicContact NH2-OD2 3.61Å; D534-S536 VanDerWaalsContact C-N 3.3Å; D534-S536 PolarHBondContact O-N 3.23Å; D534-S536 PolarHBondContact OD1-N 3.09Å; D534-I537 HydrophobicContact CB-CB 4.2Å; D534-I537 PolarHBondContact O-N 3.3Å; D534-I537 PolarHBondContact OD1-N 3.45Å; D534-Q540 HydrophobicContact CB-CB 4.42Å; D534-Q540 PolarHBondContact N-O 2.9Å; D534-E542 HydrophobicContact CB-CG 4.2Å
535	P	78.6	Confident	68.7	Low	67 Å²	67	78.8 Å²	78.8	44%	0.435	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-28.8	-174.7	25.1	-33.4	0	0	0	113.2	E542	P535-E542 WeakPolarHBondContact CD-OE1 3.29Å
536	S	81.1	Confident	71.2	Confident	58 Å²	58	75.7 Å²	75.7	41%	0.406	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-0.2	-178.2	-35.2	0	0	0	0	113.9	R125 D534	R125-S536 PolarHBondContact NH2-OG 2.89Å; D534-S536 VanDerWaalsContact C-N 3.3Å; D534-S536 PolarHBondContact O-N 3.23Å; D534-S536 PolarHBondContact OD1-N 3.09Å
537	I	80.1	Confident	73.7	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	48%	0.476	C	S	.	.	S	Bend	trans	-128.8	96.7	176.4	-49.4	-180	0	0	0	110	Y116 N118 H121 V123 D534 G539 Q540	Y116-I537 HydrophobicContact CE1-CD1 4.28Å; N118-I537 HydrophobicContact CB-CD1 3.9Å; H121-I537 HydrophobicContact CB-CD1 3.93Å; H121-I537 HydrophobicContact CB-CG1 3.92Å; V123-I537 HydrophobicContact CB-CD1 4.29Å; V123-I537 HydrophobicContact CG2-CD1 3.99Å; V123-I537 HydrophobicContact CG2-CG1 3.78Å; D534-I537 HydrophobicContact CB-CB 4.2Å; D534-I537 PolarHBondContact O-N 3.3Å; D534-I537 PolarHBondContact OD1-N 3.45Å; I537-G539 PolarHBondContact O-N 3.34Å; I537-Q540 HydrophobicContact CB-CB 4.15Å; I537-Q540 HydrophobicContact CG2-CB 3.87Å; I537-Q540 VanDerWaalsContact CG2-CD 3.48Å; I537-Q540 HydrophobicContact CG2-CG 3.69Å; I537-Q540 PolarHBondContact O-N 3.36Å; I537-Q540 VanDerWaalsContact O-N 3.12Å
538	P	79.9	Confident	76.5	Confident	124 Å²	124	74 Å²	74	81%	0.805	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	127.6	-179	-27.2	34.8	0	0	0	112.8	Q540	P538-Q540 VanDerWaalsContact C-N 3.29Å; P538-Q540 PolarHBondContact O-N 2.86Å
539	G	78.7	Confident	78.9	Confident	90 Å²	90	68.5 Å²	68.5	93%	0.928	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	1.4	177.1	0	0	0	0	0	115.4	I537	I537-G539 PolarHBondContact O-N 3.34Å
540	Q	81.2	Confident	80.5	Confident	50 Å²	50	68.5 Å²	68.5	23%	0.234	42%	0.423	C	S	.	.			trans	-101.8	164.4	169.5	-65.7	-168.3	15.9	0	0	111.1	D534 I537 P538	D534-Q540 HydrophobicContact CB-CB 4.42Å; D534-Q540 PolarHBondContact N-O 2.9Å; I537-Q540 HydrophobicContact CB-CB 4.15Å; I537-Q540 HydrophobicContact CG2-CB 3.87Å; I537-Q540 VanDerWaalsContact CG2-CD 3.48Å; I537-Q540 HydrophobicContact CG2-CG 3.69Å; I537-Q540 PolarHBondContact O-N 3.36Å; I537-Q540 VanDerWaalsContact O-N 3.12Å; P538-Q540 VanDerWaalsContact C-N 3.29Å; P538-Q540 PolarHBondContact O-N 2.86Å
541	T	84.4	Confident	82	Confident	47 Å²	47	66.3 Å²	66.3	29%	0.288	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-109	156.7	174.8	51.9	0	0	0	0	108.9	H68 L531 K532	H68-T541 PolarHBondContact CE1-O 3.38Å; H68-T541 PolarHBondContact NE2-O 2.86Å; L531-T541 HydrophobicContact CB-CG2 3.84Å; L531-T541 HydrophobicContact CD2-CG2 4.44Å; K532-T541 CarbonylContact O-C 3.6Å; K532-T541 VanDerWaalsContact O-CA 3.22Å; K532-T541 WeakPolarHBondContact O-CA 3.49Å; K532-T541 WeakPolarHBondContact O-CB 2.96Å
542	E	83.8	Confident	83	Confident	23 Å²	23	63.1 Å²	63.1	11%	0.107	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-67.7	146.4	173.5	-65.8	-172.6	155.6	0	0	110.8	K532 D534 P535	K532-E542 WeakPolarHBondContact CD-OE2 3.39Å; K532-E542 VanDerWaalsContact CE-OE2 3.22Å; K532-E542 WeakPolarHBondContact CE-OE2 3.41Å; K532-E542 IonicContact NZ-OE1 2.61Å; K532-E542 PolarHBondContact NZ-OE1 2.92Å; K532-E542 IonicContact NZ-OE2 3.51Å; K532-E542 PolarHBondContact NZ-OE2 3.33Å; K532-E542 PolarHBondContact O-N 3.47Å; D534-E542 HydrophobicContact CB-CG 4.2Å; P535-E542 WeakPolarHBondContact CD-OE1 3.29Å
543	P	85.8	Confident	83.5	Confident	9 Å²	9	59.3 Å²	59.3	6%	0.058	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-63.7	141.6	173.5	26.4	-34.1	0	0	0	111.3	H68 V74 Y116 Y127 I545	H68-P543 HydrophobicContact CB-CB 4.15Å; H68-P543 VanDerWaalsContact CE1-CA 3.47Å; H68-P543 WeakPolarHBondContact CE1-CA 3.43Å; V74-P543 HydrophobicContact CG2-CB 3.5Å; V74-P543 VanDerWaalsContact CG2-CB 3.5Å; V74-P543 HydrophobicContact CG2-CG 3.8Å; Y116-P543 HydrophobicContact CD2-CG 3.91Å; Y116-P543 HydrophobicContact CE2-CG 4.37Å; Y116-P543 HydrophobicContact CG-CG 4Å; Y127-P543 HydrophobicContact CE2-CG 3.73Å; Y127-P543 WeakPolarHBondContact OH-CD 2.83Å; P543-I545 HydrophobicContact CB-CD1 4.47Å; P543-I545 HydrophobicContact CG-CD1 4.24Å; P543-I545 PolarHBondContact O-N 3.09Å
544	T	85.8	Confident	83.7	Confident	104 Å²	104	59.6 Å²	59.6	64%	0.638	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-75.8	116.3	168.2	-59.4	0	0	0	0	109	L546	T544-L546 HydrophobicContact CG2-CD2 4.46Å; T544-L546 PolarHBondContact O-N 2.71Å
545	I	87.8	Confident	84	Confident	50 Å²	50	65 Å²	65	26%	0.256	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-81.1	118.7	179.2	-53.9	-57.5	0	0	0	109.6	V74 Y76 A114 Y127 P543	V74-I545 HydrophobicContact CG1-CD1 3.99Å; V74-I545 HydrophobicContact CG2-CD1 4.35Å; Y76-I545 HydrophobicContact CE1-CG2 4.33Å; A114-I545 HydrophobicContact CB-CG2 3.91Å; Y127-I545 HydrophobicContact CD1-CG1 4.18Å; Y127-I545 HydrophobicContact CD2-CD1 3.5Å; Y127-I545 HydrophobicContact CD2-CG1 4.02Å; Y127-I545 HydrophobicContact CE2-CD1 4.04Å; Y127-I545 HydrophobicContact CG-CD1 3.78Å; Y127-I545 HydrophobicContact CG-CG1 3.74Å; P543-I545 HydrophobicContact CB-CD1 4.47Å; P543-I545 HydrophobicContact CG-CD1 4.24Å; P543-I545 PolarHBondContact O-N 3.09Å
546	L	88.1	Confident	84.3	Confident	66 Å²	66	62 Å²	62	35%	0.346	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-89.6	163.5	-179.5	-61.9	175.6	0	0	0	111.2	I24 Y76 T544	I24-L546 HydrophobicContact CD1-CB 3.84Å; I24-L546 HydrophobicContact CD1-CD1 3.88Å; I24-L546 HydrophobicContact CG1-CD1 3.68Å; Y76-L546 HydrophobicContact CE1-CB 4.46Å; Y76-L546 VanDerWaalsContact CE1-O 3.3Å; Y76-L546 WeakPolarHBondContact CE1-O 3.31Å; Y76-L546 WeakPolarHBondContact OH-CB 3.44Å; Y76-L546 PolarHBondContact OH-N 2.86Å; T544-L546 HydrophobicContact CG2-CD2 4.46Å; T544-L546 PolarHBondContact O-N 2.71Å
547	P	86.7	Confident	83.8	Confident	111 Å²	111	62.9 Å²	62.9	72%	0.721	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-58	147.8	172.4	-24.1	34.6	0	0	0	112.2
548	F	89.1	Confident	83.1	Confident	40 Å²	40	67.7 Å²	67.7	18%	0.175	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-58.1	131.5	177.4	-70.2	-58.7	0	0	0	111.5	Y76 K112 A114 K128 D130 T550	Y76-F548 HydrophobicContact CD1-CD1 4.02Å; Y76-F548 HydrophobicContact CD1-CE1 4.34Å; K112-F548 HydrophobicContact CB-CD1 3.98Å; K112-F548 HydrophobicContact CB-CD2 3.77Å; K112-F548 HydrophobicContact CB-CE1 3.94Å; K112-F548 HydrophobicContact CB-CE2 3.7Å; K112-F548 HydrophobicContact CB-CG 3.91Å; K112-F548 HydrophobicContact CB-CZ 3.8Å; K112-F548 HydrophobicContact CD-CB 4.04Å; K112-F548 HydrophobicContact CD-CD2 4.01Å; K112-F548 HydrophobicContact CD-CG 4.02Å; A114-F548 HydrophobicContact CB-CE1 4.04Å; A114-F548 HydrophobicContact CB-CZ 4.49Å; K128-F548 HydrophobicContact CD-CE2 4.35Å; K128-F548 HydrophobicContact CG-CE2 4.35Å; K128-F548 HydrophobicContact CG-CZ 4.25Å; D130-F548 HydrophobicContact CB-CE2 4.47Å; F548-T550 PolarHBondContact O-N 3.42Å
549	P	86.8	Confident	82.3	Confident	23 Å²	23	62.5 Å²	62.5	15%	0.149	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-56	135.7	174.6	-27.5	36.9	0	0	0	111.7	I24 H64	I24-P549 HydrophobicContact CD1-CG 3.97Å; I24-P549 HydrophobicContact CG2-CG 3.73Å; H64-P549 HydrophobicContact CB-CG 3.91Å
550	T	83	Confident	81.3	Confident	142 Å²	142	62.1 Å²	62.1	87%	0.871	38%	0.381	S	S	*	.	S	Bend	trans	-89	-21.7	173.9	53.9	0	0	0	0	112	F548	F548-T550 PolarHBondContact O-N 3.42Å
551	S	82.9	Confident	80.3	Confident	70 Å²	70	68.6 Å²	68.6	49%	0.49	41%	0.411	S	S	.	.	S	Bend	trans	-76.7	153.2	173.5	52.8	0	0	0	0	111.7	N62 H64	N62-S551 PolarHBondContact ND2-O 3.29Å; H64-S551 PolarHBondContact CE1-O 2.71Å; H64-S551 PolarHBondContact NE2-OG 3.31Å
552	R	84.6	Confident	79.2	Confident	62 Å²	62	67.1 Å²	67.1	23%	0.234	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-98.7	139.9	170.8	-165.6	174.6	-177.8	-142.4	3.5	110.7	S61 N62 C556 A557 N558	S61-R552 PolarHBondContact O-NE 3.38Å; S61-R552 PolarHBondContact O-NH2 2.91Å; N62-R552 HydrophobicContact CB-CG 4.47Å; N62-R552 WeakPolarHBondContact OD1-CA 3.35Å; R552-C556 VanDerWaalsContact CZ-O 3.26Å; R552-C556 PolarHBondContact NH2-O 2.99Å; R552-A557 PolarHBondContact NH2-O 3.05Å; R552-N558 PolarHBondContact NH1-OD1 2.96Å
553	S	88.1	Confident	78.4	Confident	4 Å²	4	75.5 Å²	75.5	3%	0.028	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-66.5	133.2	171.3	176.5	0	0	0	0	110.5	G27 N62 V63 E555 C556	G27-S553 VanDerWaalsContact O-CB 3.26Å; G27-S553 WeakPolarHBondContact O-CB 3.5Å; G27-S553 PolarHBondContact O-OG 2.95Å; N62-S553 PolarHBondContact OD1-N 2.81Å; V63-S553 WeakPolarHBondContact O-CB 3.46Å; S553-E555 PolarHBondContact O-N 2.75Å; S553-E555 PolarHBondContact OG-N 2.93Å; S553-C556 PolarHBondContact O-N 3.33Å
554	A	83.1	Confident	78.3	Confident	105 Å²	105	76.8 Å²	76.8	87%	0.868	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-20.1	176.7	0	0	0	0	0	113	C556	A554-C556 VanDerWaalsContact C-N 3.26Å; A554-C556 PolarHBondContact O-N 3.28Å
555	E	84.5	Confident	78.3	Confident	119 Å²	119	72.2 Å²	72.2	56%	0.556	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	9.6	179.1	-62.3	180	-166	0	0	112.7	S28 C29 S553	S28-E555 VanDerWaalsContact CB-OE2 3.25Å; S28-E555 WeakPolarHBondContact CB-OE2 3.46Å; C29-E555 PolarHBondContact N-O 3.26Å; S553-E555 PolarHBondContact O-N 2.75Å; S553-E555 PolarHBondContact OG-N 2.93Å
556	C	84.9	Confident	78.3	Confident	5 Å²	5	70.5 Å²	70.5	3%	0.034	42%	0.415	C	S	.	.	S	Bend	trans	-109.7	102.5	171.4	-70.3	0	0	0	0	108.9	C29 R552 S553 A554	C29-C556 HydrophobicContact CB-CB 3.91Å; C29-C556 WeakPolarHBondContact CB-SG 3.39Å; C29-C556 PolarHBondContact N-SG 2.69Å; C29-C556 VanDerWaalsContact N-SG 3.44Å; C29-C556 WeakPolarHBondContact SG-CB 3.12Å; C29-C556 CovalentContact SG-SG 2.03Å; C29-C556 PolarHBondContact SG-SG 2.91Å; R552-C556 VanDerWaalsContact CZ-O 3.26Å; R552-C556 PolarHBondContact NH2-O 2.99Å; S553-C556 PolarHBondContact O-N 3.33Å; A554-C556 VanDerWaalsContact C-N 3.26Å; A554-C556 PolarHBondContact O-N 3.28Å
557	A	70.2	Confident	78.2	Confident	77 Å²	77	68.9 Å²	68.9	64%	0.636	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-59.5	148.1	-178.9	0	0	0	0	0	111.7	R552	R552-A557 PolarHBondContact NH2-O 3.05Å
558	N	66.6	Low	78.3	Confident	101 Å²	101	68.1 Å²	68.1	54%	0.54	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-54.3	145.6	166.8	-78.2	-38	0	0	0	110.1	R552 A560 P578	R552-N558 PolarHBondContact NH1-OD1 2.96Å; N558-A560 PolarHBondContact O-N 3.16Å; N558-A560 VanDerWaalsContact O-N 3.14Å; N558-P578 WeakPolarHBondContact OD1-CB 3.45Å
559	P	62	Low	78.3	Confident	14 Å²	14	66.3 Å²	66.3	9%	0.091	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-51.6	127	171.9	-10.4	19.6	0	0	0	107.7	E561 L571 P578	P559-E561 PolarHBondContact O-N 3.39Å; P559-L571 HydrophobicContact CB-CD2 4.1Å; P559-L571 HydrophobicContact CG-CD2 3.8Å; P559-P578 VanDerWaalsContact CD-CG 3.43Å; P559-P578 HydrophobicContact CG-CG 3.91Å
560	A	58.3	Low	78.4	Confident	83 Å²	83	65.3 Å²	65.3	69%	0.686	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-56.7	142.8	172.1	0	0	0	0	0	108.4	N558 G562	N558-A560 PolarHBondContact O-N 3.16Å; N558-A560 VanDerWaalsContact O-N 3.14Å; A560-G562 VanDerWaalsContact C-N 3.25Å; A560-G562 PolarHBondContact O-N 3.19Å
561	E	59.9	Low	78.6	Confident	185 Å²	185	61.4 Å²	61.4	86%	0.864	35%	0.35	S	S	*	.			trans	-56.8	93.2	174.2	-79.7	-173.7	174.6	0	0	109.2	P559 L571	P559-E561 PolarHBondContact O-N 3.39Å; E561-L571 HydrophobicContact CG-CD1 4.46Å
562	G	61	Low	78.8	Confident	17 Å²	17	62.5 Å²	62.5	18%	0.175	35%	0.348	C	S	.	.			trans	-75.6	145.3	179.6	0	0	0	0	0	110.1	A560 S564 N567	A560-G562 VanDerWaalsContact C-N 3.25Å; A560-G562 PolarHBondContact O-N 3.19Å; G562-S564 VanDerWaalsContact C-N 3.28Å; G562-N567 WeakPolarHBondContact CA-ND2 3.38Å
563	K	66.6	Low	78.9	Confident	199 Å²	199	59.7 Å²	59.7	87%	0.865	34%	0.337	S	S	*	.	S	Bend	trans	-72.8	-25	175.5	-66.6	-177.5	-179.7	178.3	0	112.5
564	S	83.6	Confident	78.8	Confident	36 Å²	36	63.7 Å²	63.7	25%	0.252	36%	0.363	S	S	.	.	S	Bend	trans	-70.1	148.9	-177.2	52.1	0	0	0	0	112.3	E102 G562 V566 N567 K568	E102-S564 WeakPolarHBondContact OE1-CA 3.42Å; E102-S564 WeakPolarHBondContact OE1-CB 3.5Å; G562-S564 VanDerWaalsContact C-N 3.28Å; S564-V566 VanDerWaalsContact C-N 3.28Å; S564-V566 PolarHBondContact O-N 2.75Å; S564-N567 PolarHBondContact O-N 2.71Å; S564-N567 WeakPolarHBondContact OG-CB 3.39Å; S564-N567 PolarHBondContact OG-ND2 2.82Å; S564-N567 PolarHBondContact OG-OD1 2.87Å; S564-K568 PolarHBondContact O-N 2.8Å
565	L	86.2	Confident	79	Confident	8 Å²	8	62.9 Å²	62.9	4%	0.042	34%	0.344	C	S	.	.	H	α-helix	trans	-55.2	-43.7	176	175.6	59.8	0	0	0	111.5	E102 V136 R140 V141 I144 N567 K568 L569	E102-L565 HydrophobicContact CG-CB 4.1Å; E102-L565 PolarHBondContact OE1-N 3.13Å; E102-L565 WeakPolarHBondContact OE2-CB 3.32Å; V136-L565 HydrophobicContact CB-CD2 4.4Å; V136-L565 HydrophobicContact CG1-CD2 4.42Å; R140-L565 HydrophobicContact CB-CD1 3.84Å; R140-L565 HydrophobicContact CB-CD2 4.16Å; R140-L565 HydrophobicContact CG-CD1 4.46Å; V141-L565 HydrophobicContact CG2-CD2 3.96Å; I144-L565 HydrophobicContact CD1-CB 4.21Å; I144-L565 HydrophobicContact CD1-CD2 4.14Å; L565-N567 PolarHBondContact O-N 2.99Å; L565-K568 PolarHBondContact O-N 3.46Å; L565-L569 HydrophobicContact CD1-CD1 4.12Å; L565-L569 HydrophobicContact CD1-CG 4.23Å; L565-L569 HydrophobicContact CG-CD1 3.98Å; L565-L569 WeakPolarHBondContact O-CG 3.32Å; L565-L569 PolarHBondContact O-N 3.22Å
566	V	88.1	Confident	79	Confident	14 Å²	14	57.6 Å²	57.6	9%	0.085	32%	0.319	C	S	.	.	H	α-helix	trans	-61.4	-42.4	-179.9	174	0	0	0	0	111.6	V82 P106 Y108 S564 K568 L569 F570	V82-V566 HydrophobicContact CG1-CG1 3.9Å; P106-V566 HydrophobicContact CB-CG2 4.39Å; P106-V566 HydrophobicContact CG-CG2 3.93Å; Y108-V566 HydrophobicContact CG-CG1 4.49Å; S564-V566 VanDerWaalsContact C-N 3.28Å; S564-V566 PolarHBondContact O-N 2.75Å; V566-K568 VanDerWaalsContact C-N 3.32Å; V566-K568 PolarHBondContact O-N 3.39Å; V566-L569 PolarHBondContact O-N 2.7Å; V566-F570 HydrophobicContact CG1-CD2 3.72Å; V566-F570 HydrophobicContact CG1-CE2 3.51Å; V566-F570 VanDerWaalsContact O-CD2 3.3Å; V566-F570 WeakPolarHBondContact O-CD2 3.03Å; V566-F570 PolarHBondContact O-N 3.22Å
567	N	86.9	Confident	78.8	Confident	31 Å²	31	62.7 Å²	62.7	17%	0.166	34%	0.341	C	S	.	.	H	α-helix	trans	-66.2	-37.8	180	-65.4	26.7	0	0	0	111.3	H58 G562 S564 L565 L569 F570 L571	H58-N567 PolarHBondContact CE1-OD1 3.47Å; H58-N567 PolarHBondContact NE2-OD1 3.32Å; H58-N567 VanDerWaalsContact NE2-OD1 3.13Å; G562-N567 WeakPolarHBondContact CA-ND2 3.38Å; S564-N567 PolarHBondContact O-N 2.71Å; S564-N567 WeakPolarHBondContact OG-CB 3.39Å; S564-N567 PolarHBondContact OG-ND2 2.82Å; S564-N567 PolarHBondContact OG-OD1 2.87Å; L565-N567 PolarHBondContact O-N 2.99Å; N567-L569 VanDerWaalsContact C-N 3.34Å; N567-F570 PolarHBondContact O-N 3.27Å; N567-L571 WeakPolarHBondContact O-CG 3.37Å; N567-L571 PolarHBondContact O-N 3.24Å
568	K	87.6	Confident	78.6	Confident	96 Å²	96	60.5 Å²	60.5	42%	0.417	32%	0.32	S	S	.	.	H	α-helix	trans	-62.9	-43	173.6	-66.2	172.2	-175.4	166.5	0	111.1	S564 L565 V566 F570 L571 E572	S564-K568 PolarHBondContact O-N 2.8Å; L565-K568 PolarHBondContact O-N 3.46Å; V566-K568 VanDerWaalsContact C-N 3.32Å; V566-K568 PolarHBondContact O-N 3.39Å; K568-F570 PolarHBondContact O-N 3.13Å; K568-L571 WeakPolarHBondContact O-CB 3.46Å; K568-L571 PolarHBondContact O-N 3.24Å; K568-E572 WeakPolarHBondContact O-CB 3.48Å; K568-E572 WeakPolarHBondContact O-CG 3.08Å; K568-E572 PolarHBondContact O-N 2.83Å
569	L	89.6	Confident	78.3	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-65.3	-37	179.8	-70.9	170.8	0	0	0	112.7	Y108 V136 P137 I506 L565 V566 N567 L571 E572 D573	Y108-L569 HydrophobicContact CD1-CD1 4.33Å; Y108-L569 HydrophobicContact CD2-CB 4.46Å; Y108-L569 HydrophobicContact CE1-CB 4.13Å; Y108-L569 HydrophobicContact CE1-CD1 3.83Å; Y108-L569 HydrophobicContact CE2-CB 3.84Å; V136-L569 HydrophobicContact CB-CD1 3.87Å; V136-L569 HydrophobicContact CG1-CD1 3.39Å; P137-L569 HydrophobicContact CG-CD2 4.44Å; I506-L569 HydrophobicContact CG2-CD2 4.18Å; L565-L569 HydrophobicContact CD1-CD1 4.12Å; L565-L569 HydrophobicContact CD1-CG 4.23Å; L565-L569 HydrophobicContact CG-CD1 3.98Å; L565-L569 WeakPolarHBondContact O-CG 3.32Å; L565-L569 PolarHBondContact O-N 3.22Å; V566-L569 PolarHBondContact O-N 2.7Å; N567-L569 VanDerWaalsContact C-N 3.34Å; L569-L571 PolarHBondContact O-N 3.31Å; L569-E572 PolarHBondContact O-N 3.23Å; L569-D573 WeakPolarHBondContact O-CB 3.5Å; L569-D573 PolarHBondContact O-N 3.41Å
570	F	89.3	Confident	77.6	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.009	39%	0.386	C	S	.	.	H	α-helix	trans	-62.1	-28.2	171.7	-84.3	-69.5	0	0	0	113.2	H58 D80 Y108 G109 V566 N567 K568 F576 K577	H58-F570 AromaticContact CD2-CD2 3.85Å; H58-F570 AromaticContact CD2-CE2 3.7Å; D80-F570 HydrophobicContact CB-CD1 4.28Å; D80-F570 HydrophobicContact CB-CE1 3.69Å; D80-F570 HydrophobicContact CB-CE2 4.35Å; D80-F570 HydrophobicContact CB-CZ 3.73Å; Y108-F570 HydrophobicContact CD2-CD1 4.17Å; Y108-F570 HydrophobicContact CD2-CD2 4.12Å; Y108-F570 AromaticContact CD2-CE1 3.94Å; Y108-F570 HydrophobicContact CD2-CE1 3.94Å; Y108-F570 AromaticContact CD2-CE2 3.89Å; Y108-F570 HydrophobicContact CD2-CE2 3.89Å; Y108-F570 HydrophobicContact CD2-CG 4.25Å; Y108-F570 AromaticContact CD2-CZ 3.79Å; Y108-F570 HydrophobicContact CD2-CZ 3.79Å; Y108-F570 HydrophobicContact CG-CE2 4.32Å; Y108-F570 HydrophobicContact CG-CZ 4.35Å; G109-F570 VanDerWaalsContact O-CE1 3.24Å; G109-F570 WeakPolarHBondContact O-CE1 3.45Å; G109-F570 VanDerWaalsContact O-CZ 3.24Å; G109-F570 WeakPolarHBondContact O-CZ 3.47Å; V566-F570 HydrophobicContact CG1-CD2 3.72Å; V566-F570 HydrophobicContact CG1-CE2 3.51Å; V566-F570 VanDerWaalsContact O-CD2 3.3Å; V566-F570 WeakPolarHBondContact O-CD2 3.03Å; V566-F570 PolarHBondContact O-N 3.22Å; N567-F570 PolarHBondContact O-N 3.27Å; K568-F570 PolarHBondContact O-N 3.13Å; F570-F576 HydrophobicContact CD1-CB 3.86Å; F570-F576 HydrophobicContact CD1-CG 4.39Å; F570-F576 HydrophobicContact CE1-CB 4.36Å; F570-F576 HydrophobicContact CE1-CG 4.47Å; F570-F576 CarbonylContact O-C 3.51Å; F570-K577 VanDerWaalsContact O-CA 3.28Å; F570-K577 WeakPolarHBondContact O-CA 3.46Å; F570-K577 PolarHBondContact O-N 3.36Å
571	L	86.6	Confident	78.5	Confident	60 Å²	60	65.8 Å²	65.8	31%	0.314	37%	0.371	S	S	.	.	H	α-helix	trans	-85.6	-30.4	176.7	-65.4	171.3	0	0	0	113	P559 E561 N567 K568 L569	P559-L571 HydrophobicContact CB-CD2 4.1Å; P559-L571 HydrophobicContact CG-CD2 3.8Å; E561-L571 HydrophobicContact CG-CD1 4.46Å; N567-L571 WeakPolarHBondContact O-CG 3.37Å; N567-L571 PolarHBondContact O-N 3.24Å; K568-L571 WeakPolarHBondContact O-CB 3.46Å; K568-L571 PolarHBondContact O-N 3.24Å; L569-L571 PolarHBondContact O-N 3.31Å
572	E	87.8	Confident	79.5	Confident	94 Å²	94	59.5 Å²	59.5	44%	0.439	35%	0.345	S	S	.	.	H	α-helix	trans	-84.2	-36.2	-178.4	-71.4	173	-176.5	0	0	112.6	R140 K568 L569 P574	R140-E572 IonicContact CZ-OE2 3.03Å; R140-E572 IonicContact NH2-OE1 3.79Å; R140-E572 PolarHBondContact NH2-OE1 3.31Å; R140-E572 IonicContact NH2-OE2 3.42Å; R140-E572 PolarHBondContact NH2-OE2 3.14Å; K568-E572 WeakPolarHBondContact O-CB 3.48Å; K568-E572 WeakPolarHBondContact O-CG 3.08Å; K568-E572 PolarHBondContact O-N 2.83Å; L569-E572 PolarHBondContact O-N 3.23Å; E572-P574 WeakPolarHBondContact O-CD 3.26Å
573	D	87.2	Confident	80.5	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.011	35%	0.354	C	S	.	.			trans	-68.6	118.1	-172.9	-165.8	-39.5	0	0	0	112.5	Y108 R134 I506 L569 L575 F576 K577	Y108-D573 PolarHBondContact OH-OD2 3.39Å; Y108-D573 VanDerWaalsContact OH-OD2 3.05Å; R134-D573 VanDerWaalsContact CD-OD2 3.29Å; R134-D573 WeakPolarHBondContact CD-OD2 3.16Å; R134-D573 IonicContact NE-OD2 2.71Å; R134-D573 PolarHBondContact NE-OD2 3.3Å; I506-D573 HydrophobicContact CD1-CB 3.91Å; L569-D573 WeakPolarHBondContact O-CB 3.5Å; L569-D573 PolarHBondContact O-N 3.41Å; D573-L575 PolarHBondContact O-N 3.1Å; D573-L575 WeakPolarHBondContact OD1-CB 3.49Å; D573-L575 PolarHBondContact OD1-N 3.36Å; D573-F576 HydrophobicContact CB-CB 4.35Å; D573-F576 HydrophobicContact CB-CD2 3.84Å; D573-F576 HydrophobicContact CB-CG 4.46Å; D573-F576 PolarHBondContact O-N 3.09Å; D573-F576 WeakPolarHBondContact OD2-CD2 3.13Å; D573-F576 WeakPolarHBondContact OD2-CE2 2.96Å; D573-K577 WeakPolarHBondContact O-CB 3.5Å; D573-K577 WeakPolarHBondContact O-CG 3.5Å; D573-K577 PolarHBondContact O-N 3.42Å
574	P	86	Confident	81.3	Confident	88 Å²	88	53.8 Å²	53.8	57%	0.571	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-25.2	179.6	-25.6	34.5	0	0	0	115.3	E572	E572-P574 WeakPolarHBondContact O-CD 3.26Å
575	L	85.3	Confident	81.2	Confident	89 Å²	89	54.9 Å²	54.9	47%	0.466	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-32.6	177.8	-70.1	-173.6	0	0	0	113.2	V132 L503 D573	V132-L575 HydrophobicContact CG1-CD1 4.28Å; L503-L575 HydrophobicContact CD1-CD1 3.51Å; D573-L575 PolarHBondContact O-N 3.1Å; D573-L575 WeakPolarHBondContact OD1-CB 3.49Å; D573-L575 PolarHBondContact OD1-N 3.36Å
576	F	86.5	Confident	80.9	Confident	8 Å²	8	58.1 Å²	58.1	4%	0.035	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-18.1	-171.7	-51.5	-46.7	0	0	0	113.3	Y108 Q110 V132 R134 F570 D573	Y108-F576 HydrophobicContact CD2-CD2 4.14Å; Y108-F576 HydrophobicContact CD2-CE2 4.22Å; Y108-F576 AromaticContact CE2-CD2 3.6Å; Y108-F576 HydrophobicContact CE2-CD2 3.6Å; Y108-F576 AromaticContact CE2-CE2 3.77Å; Y108-F576 HydrophobicContact CE2-CE2 3.77Å; Q110-F576 HydrophobicContact CB-CD1 3.55Å; Q110-F576 HydrophobicContact CB-CE1 3.82Å; Q110-F576 HydrophobicContact CB-CG 4.44Å; V132-F576 HydrophobicContact CB-CE1 4.05Å; V132-F576 HydrophobicContact CB-CZ 4.34Å; V132-F576 HydrophobicContact CG1-CE1 4.11Å; V132-F576 HydrophobicContact CG1-CZ 4.03Å; V132-F576 WeakPolarHBondContact O-CE1 3.31Å; V132-F576 VanDerWaalsContact O-CZ 3.28Å; V132-F576 WeakPolarHBondContact O-CZ 3.18Å; R134-F576 HydrophobicContact CG-CE2 4.31Å; F570-F576 HydrophobicContact CD1-CB 3.86Å; F570-F576 HydrophobicContact CD1-CG 4.39Å; F570-F576 HydrophobicContact CE1-CB 4.36Å; F570-F576 HydrophobicContact CE1-CG 4.47Å; F570-F576 CarbonylContact O-C 3.51Å; D573-F576 HydrophobicContact CB-CB 4.35Å; D573-F576 HydrophobicContact CB-CD2 3.84Å; D573-F576 HydrophobicContact CB-CG 4.46Å; D573-F576 PolarHBondContact O-N 3.09Å; D573-F576 WeakPolarHBondContact OD2-CD2 3.13Å; D573-F576 WeakPolarHBondContact OD2-CE2 2.96Å
577	K	79	Confident	80.4	Confident	111 Å²	111	61.2 Å²	61.2	48%	0.483	37%	0.367	S	S	.	.	S	Bend	trans	-55.1	136.5	178	69.7	-179	-177.3	-179.6	0	109.5	F570 D573 A579	F570-K577 VanDerWaalsContact O-CA 3.28Å; F570-K577 WeakPolarHBondContact O-CA 3.46Å; F570-K577 PolarHBondContact O-N 3.36Å; D573-K577 WeakPolarHBondContact O-CB 3.5Å; D573-K577 WeakPolarHBondContact O-CG 3.5Å; D573-K577 PolarHBondContact O-N 3.42Å; K577-A579 PolarHBondContact O-N 3.47Å
578	P	67.3	Low	79.9	Confident	31 Å²	31	63.5 Å²	63.5	20%	0.201	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-56.7	136.2	174.1	-19.1	28.5	0	0	0	110.2	N558 P559 A580	N558-P578 WeakPolarHBondContact OD1-CB 3.45Å; P559-P578 VanDerWaalsContact CD-CG 3.43Å; P559-P578 HydrophobicContact CG-CG 3.91Å; P578-A580 PolarHBondContact O-N 3Å
579	A	60.4	Low	79.2	Confident	73 Å²	73	60.8 Å²	60.8	60%	0.603	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-58.7	129	166.9	0	0	0	0	0	108.5	K577	K577-A579 PolarHBondContact O-N 3.47Å
580	A	45.6	Very low	78.3	Confident	171 Å²	171	66.3 Å²	66.3	100%	1.413	41%	0.413	S	S	*	.			trans	-70.5	0	-176.4	0	0	0	0	0	112.9	P578	P578-A580 PolarHBondContact O-N 3Å

Retrieved 580 of 580 residues in 398.4 ms (Link to these results)

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