A0A087Y7N5_POEFO Loading...

Beta-2-glycoprotein 1

Binds to various kinds of negatively charged substances such as heparin, phospholipids, and dextran sulfate. May prevent activation of the intrinsic blood coagulation cascade by binding to phospholipids on the surface of damaged cells.

AlphaFold DB , UniProt , Accession A0A087Y7N5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 348 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.7	Very low	36.3	Very low	240 Å²	240	151.7 Å²	151.7	100%	1.182	81%	0.809	S	S	*	*				0	111.7	0	-105.8	176.1	-97.1	0	0	107.4
2	E	34.7	Very low	36.6	Very low	147 Å²	147	152.3 Å²	152.3	69%	0.687	81%	0.811	S	S	*	*			trans	37.7	132.6	145.3	-92.3	-171.9	122.1	0	0	124
3	R	35.6	Very low	36.7	Very low	204 Å²	204	149.1 Å²	149.1	77%	0.77	80%	0.8	S	S	*	*			trans	79.6	144.6	140.8	-68.1	-176.2	-169.8	-137.1	3.1	117.9
4	L	31.3	Very low	36.7	Very low	139 Å²	139	146.1 Å²	146.1	73%	0.728	79%	0.79	S	S	*	*			cis	-167.2	159.4	-8.3	-145.7	89	0	0	0	107.4
5	F	37.2	Very low	36.8	Very low	182 Å²	182	144.1 Å²	144.1	80%	0.798	79%	0.785	S	S	*	*			trans	-9.3	143.8	168.4	-71.5	-82.8	0	0	0	121.8
6	L	32.4	Very low	36.8	Very low	156 Å²	156	142.7 Å²	142.7	82%	0.817	78%	0.782	S	S	*	*				-175.5	123.8	112	-95.6	152.9	0	0	0	114.1
7	L	41.7	Very low	37.1	Very low	153 Å²	153	141.4 Å²	141.4	80%	0.801	78%	0.779	S	S	*	*			trans	7.5	130.1	152.2	-71.1	155.1	0	0	0	119.9
8	C	35.4	Very low	37.6	Very low	131 Å²	131	137.4 Å²	137.4	89%	0.885	76%	0.763	S	S	*	*			trans	-148.3	103.4	137.6	-153.6	0	0	0	0	111.2	G10	C8-G10 PolarHBondContact O-N 3.29Å
9	S	40.6	Very low	38.5	Very low	94 Å²	94	138.5 Å²	138.5	66%	0.657	76%	0.762	S	S	*	*			trans	-65.4	107.3	169	43.5	0	0	0	0	110.4	L11	S9-L11 VanDerWaalsContact C-N 3.32Å; S9-L11 PolarHBondContact O-N 3.06Å
10	G	38.6	Very low	39.7	Very low	80 Å²	80	139.3 Å²	139.3	83%	0.825	76%	0.759	S	S	*	*			trans	-76.7	81	169.2	0	0	0	0	0	110.9	C8 L12	C8-G10 PolarHBondContact O-N 3.29Å; G10-L12 PolarHBondContact O-N 3.14Å
11	L	38.3	Very low	41.6	Very low	143 Å²	143	135.7 Å²	135.7	75%	0.749	74%	0.739	S	S	*	*			trans	-71.3	109.1	161.1	-100.7	125.1	0	0	0	107.9	S9 V13	S9-L11 VanDerWaalsContact C-N 3.32Å; S9-L11 PolarHBondContact O-N 3.06Å; L11-V13 VanDerWaalsContact C-N 3.29Å; L11-V13 PolarHBondContact O-N 3.31Å
12	L	39.7	Very low	44.2	Very low	159 Å²	159	126.5 Å²	126.5	83%	0.832	70%	0.697	S	S	*	*			trans	-61.3	94.8	158.4	-92.4	137.6	0	0	0	107.7	G10 T14	G10-L12 PolarHBondContact O-N 3.14Å; L12-T14 VanDerWaalsContact C-N 3.26Å; L12-T14 PolarHBondContact O-N 2.94Å; L12-T14 VanDerWaalsContact O-N 3.1Å
13	V	37.8	Very low	46.7	Very low	110 Å²	110	119.6 Å²	119.6	67%	0.667	67%	0.665	S	S	*	*			trans	-76.9	87.6	162.2	-175.4	0	0	0	0	106.2	L11 T15	L11-V13 VanDerWaalsContact C-N 3.29Å; L11-V13 PolarHBondContact O-N 3.31Å; V13-T15 VanDerWaalsContact C-N 3.33Å; V13-T15 HydrophobicContact CG1-CG2 3.86Å; V13-T15 PolarHBondContact O-N 3.1Å; V13-T15 VanDerWaalsContact O-N 3.14Å
14	T	36.3	Very low	49.3	Very low	108 Å²	108	113.4 Å²	113.4	66%	0.663	65%	0.653	S	S	*	*			trans	-68.4	102.6	152.7	44.4	0	0	0	0	105.8	L12 V16	L12-T14 VanDerWaalsContact C-N 3.26Å; L12-T14 PolarHBondContact O-N 2.94Å; L12-T14 VanDerWaalsContact O-N 3.1Å; T14-V16 PolarHBondContact O-N 3.05Å
15	T	38.3	Very low	52	Low	116 Å²	116	112.9 Å²	112.9	71%	0.712	64%	0.641	S	S	*	*			trans	-65.1	87.6	164.9	49.7	0	0	0	0	107.3	V13 T17	V13-T15 VanDerWaalsContact C-N 3.33Å; V13-T15 HydrophobicContact CG1-CG2 3.86Å; V13-T15 PolarHBondContact O-N 3.1Å; V13-T15 VanDerWaalsContact O-N 3.14Å; T15-T17 VanDerWaalsContact C-N 3.3Å; T15-T17 PolarHBondContact O-N 2.8Å
16	V	36.6	Very low	54.4	Low	121 Å²	121	105.1 Å²	105.1	73%	0.733	61%	0.609	S	S	*	*			trans	-67.4	99.8	158.7	178.7	0	0	0	0	104.8	T14 S18	T14-V16 PolarHBondContact O-N 3.05Å; V16-S18 PolarHBondContact O-N 2.84Å
17	T	41.7	Very low	57	Low	120 Å²	120	106.4 Å²	106.4	74%	0.736	61%	0.611	S	S	*	*			trans	-60.2	93.6	164.3	41.5	0	0	0	0	107.3	T15 Q19	T15-T17 VanDerWaalsContact C-N 3.3Å; T15-T17 PolarHBondContact O-N 2.8Å; T17-Q19 PolarHBondContact O-N 2.93Å
18	S	46.7	Very low	59.3	Low	71 Å²	71	101.2 Å²	101.2	50%	0.497	58%	0.583	S	S	.	*			trans	-72.6	82.9	164.9	177.5	0	0	0	0	108	V16 H20	V16-S18 PolarHBondContact O-N 2.84Å; S18-H20 PolarHBondContact O-N 2.9Å; S18-H20 VanDerWaalsContact O-N 3.13Å; S18-H20 PolarHBondContact OG-CD2 3.36Å; S18-H20 PolarHBondContact OG-CE1 2.8Å; S18-H20 PolarHBondContact OG-NE2 3.13Å
19	Q	54.3	Low	61.7	Low	158 Å²	158	99.6 Å²	99.6	74%	0.738	57%	0.574	S	S	*	*			trans	-75.7	81.6	152.8	-93.8	179.2	-21.2	0	0	106.4	T17 N21	T17-Q19 PolarHBondContact O-N 2.93Å; Q19-N21 PolarHBondContact O-N 3.47Å
20	H	63.7	Low	64	Low	153 Å²	153	97.6 Å²	97.6	71%	0.708	57%	0.568	S	S	*	*			trans	-68.2	88	162.3	-76.3	-45.9	0	0	0	107.3	S18 V22	S18-H20 PolarHBondContact O-N 2.9Å; S18-H20 VanDerWaalsContact O-N 3.13Å; S18-H20 PolarHBondContact OG-CD2 3.36Å; S18-H20 PolarHBondContact OG-CE1 2.8Å; S18-H20 PolarHBondContact OG-NE2 3.13Å; H20-V22 HydrophobicContact CB-CB 4.47Å; H20-V22 HydrophobicContact CB-CG2 3.85Å; H20-V22 PolarHBondContact O-N 2.87Å
21	N	79.3	Confident	66.7	Low	64 Å²	64	96.3 Å²	96.3	34%	0.342	54%	0.542	S	S	.	.			trans	-71	60.1	169.6	-70.1	-7	0	0	0	109.6	Q19 P43 I68	Q19-N21 PolarHBondContact O-N 3.47Å; N21-P43 WeakPolarHBondContact O-CD 3.16Å; N21-P43 WeakPolarHBondContact O-CG 3.47Å; N21-I68 VanDerWaalsContact CB-O 3.28Å; N21-I68 WeakPolarHBondContact CB-O 3.27Å; N21-I68 PolarHBondContact ND2-O 2.78Å
22	V	87.8	Confident	69.3	Low	48 Å²	48	90 Å²	90	29%	0.291	51%	0.509	S	S	.	.			trans	-113.9	134.4	-173.5	-177.4	0	0	0	0	107.3	H20 F40 S41	H20-V22 HydrophobicContact CB-CB 4.47Å; H20-V22 HydrophobicContact CB-CG2 3.85Å; H20-V22 PolarHBondContact O-N 2.87Å; V22-F40 HydrophobicContact CG1-CB 3.73Å; V22-S41 WeakPolarHBondContact CG1-O 3.28Å
23	C	88.3	Confident	71.9	Confident	1 Å²	1	86.7 Å²	86.7	1%	0.007	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	129.1	-177.9	-59.9	0	0	0	0	110.9	F40 S41 C66 V71 W72	C23-F40 CarbonylContact O-C 3.55Å; C23-F40 VanDerWaalsContact O-CA 3.3Å; C23-F40 WeakPolarHBondContact O-CA 3.28Å; C23-S41 PolarHBondContact N-O 2.98Å; C23-S41 PolarHBondContact O-N 3.03Å; C23-C66 HydrophobicContact CB-CB 3.82Å; C23-C66 WeakPolarHBondContact CB-SG 3.02Å; C23-C66 PolarHBondContact N-SG 3.01Å; C23-C66 VanDerWaalsContact N-SG 3.43Å; C23-C66 WeakPolarHBondContact SG-CA 3.24Å; C23-C66 WeakPolarHBondContact SG-CB 3.3Å; C23-C66 CovalentContact SG-SG 2.03Å; C23-C66 PolarHBondContact SG-SG 2.86Å; C23-V71 VanDerWaalsContact SG-C 3.58Å; C23-V71 PolarHBondContact SG-N 3.29Å; C23-W72 HydrophobicContact CB-CD2 4.01Å; C23-W72 VanDerWaalsContact CB-CE2 3.42Å; C23-W72 HydrophobicContact CB-CG 4.29Å; C23-W72 HydrophobicContact CB-CH2 4.47Å; C23-W72 HydrophobicContact CB-CZ2 3.7Å
24	S	89.6	Confident	74.3	Confident	74 Å²	74	82.6 Å²	82.6	52%	0.517	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	170	170.5	60.4	0	0	0	0	111.9	W72	S24-W72 PolarHBondContact O-NE1 2.85Å
25	R	88.1	Confident	76	Confident	128 Å²	128	82 Å²	82	48%	0.483	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-49	122.3	175.4	-169.8	175.2	-176.7	98.5	-2.5	111.8	M34 G36 R39	R25-M34 HydrophobicContact CG-CE 4.48Å; R25-M34 HydrophobicContact CG-SD 3.64Å; R25-M34 PolarHBondContact NH1-SD 2.92Å; R25-G36 PolarHBondContact NH1-O 3.43Å; R25-R39 PolarHBondContact N-O 2.93Å
26	P	88	Confident	77.6	Confident	20 Å²	20	77.9 Å²	77.9	13%	0.13	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-70.5	147.9	-177.3	27.9	-33.6	0	0	0	111.6	L28 L47 I64 W72	P26-L28 HydrophobicContact CB-CD2 4.24Å; P26-L28 HydrophobicContact CB-CG 4.38Å; P26-L28 HydrophobicContact CG-CD1 4.42Å; P26-L28 HydrophobicContact CG-CD2 4.36Å; P26-L28 HydrophobicContact CG-CG 4.29Å; P26-L47 HydrophobicContact CG-CD2 3.64Å; P26-I64 HydrophobicContact CB-CD1 4.24Å; P26-I64 HydrophobicContact CG-CD1 4.12Å; P26-W72 HydrophobicContact CB-CG 4.27Å
27	Q	86.8	Confident	79.3	Confident	182 Å²	182	79.7 Å²	79.7	85%	0.85	45%	0.448	S	S	*	.			trans	-87.8	111.5	167.6	-61.6	-59.9	-55.3	0	0	108.4
28	L	89.4	Confident	80.8	Confident	44 Å²	44	79.6 Å²	79.6	23%	0.23	44%	0.439	C	S	.	.			trans	-105.7	137.3	-176.2	-60.4	169.6	0	0	0	109.8	P26 I32 M34 L49	P26-L28 HydrophobicContact CB-CD2 4.24Å; P26-L28 HydrophobicContact CB-CG 4.38Å; P26-L28 HydrophobicContact CG-CD1 4.42Å; P26-L28 HydrophobicContact CG-CD2 4.36Å; P26-L28 HydrophobicContact CG-CG 4.29Å; L28-I32 HydrophobicContact CB-CB 4.34Å; L28-I32 HydrophobicContact CB-CG2 4.48Å; L28-I32 HydrophobicContact CD1-CG2 4.17Å; L28-I32 HydrophobicContact CD2-CG2 4.45Å; L28-M34 HydrophobicContact CD1-CB 4.15Å; L28-L49 HydrophobicContact CD1-CD2 3.8Å; L28-L49 HydrophobicContact CD2-CD2 4.02Å
29	S	86.6	Confident	82.4	Confident	97 Å²	97	85.8 Å²	85.8	68%	0.678	45%	0.452	S	S	*	.			trans	-123	176.7	176.4	63.8	0	0	0	0	110.5	I32	S29-I32 WeakPolarHBondContact O-CD1 3.36Å; S29-I32 WeakPolarHBondContact O-CG1 3.02Å
30	G	89.3	Confident	83.9	Confident	52 Å²	52	85.1 Å²	85.1	54%	0.536	45%	0.447	S	S	.	.	S	Bend	trans	68.9	38	175.5	0	0	0	0	0	114.7	I32	G30-I32 VanDerWaalsContact C-N 3.29Å; G30-I32 PolarHBondContact O-N 3Å
31	N	94.1	Very high	85.1	Confident	54 Å²	54	78.1 Å²	78.1	29%	0.289	42%	0.415	S	S	.	.	S	Bend	trans	61.4	32.1	178.4	-54.1	-50.1	0	0	0	114.8	C51 K52 Y55 C79	N31-C51 WeakPolarHBondContact O-CA 3.01Å; N31-K52 HydrophobicContact CB-CD 4.48Å; N31-K52 PolarHBondContact O-N 3.43Å; N31-Y55 HydrophobicContact CB-CD1 3.7Å; N31-Y55 HydrophobicContact CB-CD2 3.9Å; N31-Y55 HydrophobicContact CB-CE1 3.84Å; N31-Y55 HydrophobicContact CB-CE2 4.02Å; N31-Y55 HydrophobicContact CB-CG 3.76Å; N31-Y55 VanDerWaalsContact CG-CE1 3.5Å; N31-Y55 WeakPolarHBondContact ND2-CE1 3.48Å; N31-Y55 PolarHBondContact ND2-OH 2.79Å; N31-C79 HydrophobicContact CB-CB 4.43Å
32	I	94	Very high	85.6	Confident	10 Å²	10	77.9 Å²	77.9	5%	0.051	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	143.8	174.2	-54.3	168.4	0	0	0	109.7	L28 S29 G30 L49 A50 T75 L77	L28-I32 HydrophobicContact CB-CB 4.34Å; L28-I32 HydrophobicContact CB-CG2 4.48Å; L28-I32 HydrophobicContact CD1-CG2 4.17Å; L28-I32 HydrophobicContact CD2-CG2 4.45Å; S29-I32 WeakPolarHBondContact O-CD1 3.36Å; S29-I32 WeakPolarHBondContact O-CG1 3.02Å; G30-I32 VanDerWaalsContact C-N 3.29Å; G30-I32 PolarHBondContact O-N 3Å; I32-L49 HydrophobicContact CG2-CB 4.06Å; I32-L49 HydrophobicContact CG2-CD1 4.24Å; I32-L49 HydrophobicContact CG2-CD2 4.24Å; I32-L49 HydrophobicContact CG2-CG 4.43Å; I32-A50 CarbonylContact C-O 3.52Å; I32-A50 WeakPolarHBondContact CA-O 3.44Å; I32-A50 WeakPolarHBondContact CG2-O 3.42Å; I32-T75 HydrophobicContact CD1-CG2 4.17Å; I32-L77 HydrophobicContact CD1-CB 4.17Å; I32-L77 HydrophobicContact CD1-CG 4.44Å; I32-L77 VanDerWaalsContact CD1-O 3.31Å; I32-L77 WeakPolarHBondContact CD1-O 3.46Å; I32-L77 HydrophobicContact CG1-CD2 4.37Å; I32-L77 HydrophobicContact CG2-CD2 4.03Å
33	E	92.5	Very high	85.8	Confident	90 Å²	90	78.5 Å²	78.5	42%	0.421	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	167.8	172.4	65	-177.6	-163.9	0	0	111.4	L49 A50 K52	E33-L49 WeakPolarHBondContact O-CA 3.18Å; E33-A50 HydrophobicContact CG-CB 4.09Å; E33-A50 PolarHBondContact N-O 3.05Å; E33-A50 PolarHBondContact O-N 3.32Å; E33-K52 HydrophobicContact CB-CG 4.28Å; E33-K52 HydrophobicContact CG-CG 4.48Å
34	M	88.8	Confident	85.8	Confident	23 Å²	23	81 Å²	81	11%	0.113	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	142.7	179.8	62.5	-177.2	-74.4	0	0	111.1	R25 L28 G36 L47	R25-M34 HydrophobicContact CG-CE 4.48Å; R25-M34 HydrophobicContact CG-SD 3.64Å; R25-M34 PolarHBondContact NH1-SD 2.92Å; L28-M34 HydrophobicContact CD1-CB 4.15Å; M34-G36 VanDerWaalsContact CE-O 3.27Å; M34-G36 WeakPolarHBondContact CE-O 3.3Å; M34-G36 PolarHBondContact O-N 2.66Å; M34-G36 VanDerWaalsContact O-N 3.13Å; M34-L47 HydrophobicContact CB-CD1 4.4Å; M34-L47 HydrophobicContact CB-CD2 4.04Å; M34-L47 HydrophobicContact CB-CG 4.37Å; M34-L47 HydrophobicContact CE-CD1 3.69Å; M34-L47 HydrophobicContact CE-CD2 3.87Å; M34-L47 HydrophobicContact CE-CG 4.4Å; M34-L47 HydrophobicContact SD-CD2 4.31Å
35	S	71.6	Confident	85.8	Confident	97 Å²	97	80.7 Å²	80.7	68%	0.678	44%	0.44	S	S	*	.	S	Bend	trans	-83.8	28	-177.1	-168.8	0	0	0	0	114.1	A48	S35-A48 PolarHBondContact N-O 3.13Å; S35-A48 VanDerWaalsContact N-O 3.1Å
36	G	72.6	Confident	86	Confident	29 Å²	29	80 Å²	80	30%	0.299	44%	0.442	S	S	.	.			trans	-157.9	165.1	-172.1	0	0	0	0	0	117.3	R25 M34	R25-G36 PolarHBondContact NH1-O 3.43Å; M34-G36 VanDerWaalsContact CE-O 3.27Å; M34-G36 WeakPolarHBondContact CE-O 3.3Å; M34-G36 PolarHBondContact O-N 2.66Å; M34-G36 VanDerWaalsContact O-N 3.13Å
37	I	72	Confident	86	Confident	158 Å²	158	79.7 Å²	79.7	81%	0.81	44%	0.439	S	S	*	.			trans	-105.9	-6.1	-175.9	-51.2	167.8	0	0	0	111.9	R39	I37-R39 PolarHBondContact O-N 3.49Å
38	Q	74.2	Confident	86.3	Confident	119 Å²	119	73.5 Å²	73.5	56%	0.556	42%	0.419	S	S	*	.			trans	-58.4	131.2	-179.9	-83.1	173.7	-29.9	0	0	111.7
39	R	79.5	Confident	86.4	Confident	200 Å²	200	71.7 Å²	71.7	76%	0.755	41%	0.41	S	S	*	.	S	Bend	trans	-87.7	-27.4	-179.5	-66.3	-175.1	-179.9	-177.6	-0.2	112.6	R25 I37	R25-R39 PolarHBondContact N-O 2.93Å; I37-R39 PolarHBondContact O-N 3.49Å
40	F	86.7	Confident	86.8	Confident	145 Å²	145	68.7 Å²	68.7	64%	0.636	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.7	140.3	-175	-60.4	-72.4	0	0	0	109.9	V22 C23	V22-F40 HydrophobicContact CG1-CB 3.73Å; C23-F40 CarbonylContact O-C 3.55Å; C23-F40 VanDerWaalsContact O-CA 3.3Å; C23-F40 WeakPolarHBondContact O-CA 3.28Å
41	S	87.9	Confident	87	Confident	5 Å²	5	67 Å²	67	4%	0.035	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	135.3	-179.3	-70	0	0	0	0	112.3	V22 C23 E45 C66	V22-S41 WeakPolarHBondContact CG1-O 3.28Å; C23-S41 PolarHBondContact N-O 2.98Å; C23-S41 PolarHBondContact O-N 3.03Å; S41-E45 WeakPolarHBondContact CA-OE2 3.15Å; S41-E45 WeakPolarHBondContact CB-OE2 3.33Å; S41-E45 PolarHBondContact OG-OE2 2.76Å; S41-C66 PolarHBondContact O-SG 3.11Å; S41-C66 VanDerWaalsContact O-SG 3.36Å
42	S	90.5	Very high	87.1	Confident	60 Å²	60	69 Å²	69	42%	0.42	38%	0.377	S	S	.	.			trans	-71.2	152.5	-179.8	-46.2	0	0	0	0	111.5	G44 E45 C66	S42-G44 PolarHBondContact O-N 2.03Å; S42-E45 VanDerWaalsContact CB-OE1 3.32Å; S42-E45 WeakPolarHBondContact CB-OE1 3.12Å; S42-E45 PolarHBondContact N-OE1 3.45Å; S42-E45 PolarHBondContact N-OE2 2.92Å; S42-E45 VanDerWaalsContact N-OE2 3.13Å; S42-E45 WeakPolarHBondContact O-CB 3.37Å; S42-E45 PolarHBondContact O-N 3.36Å; S42-E45 PolarHBondContact OG-OE1 2.83Å; S42-C66 WeakPolarHBondContact O-CB 3.14Å
43	P	91.8	Very high	87.1	Confident	61 Å²	61	75.8 Å²	75.8	40%	0.396	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	131.5	171.4	-30.5	37.6	0	0	0	112.9	N21 I68	N21-P43 WeakPolarHBondContact O-CD 3.16Å; N21-P43 WeakPolarHBondContact O-CG 3.47Å; P43-I68 HydrophobicContact CB-CG2 4.36Å
44	G	87.9	Confident	87.3	Confident	54 Å²	54	71.5 Å²	71.5	56%	0.557	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.9	-12.8	-176.7	0	0	0	0	0	114.9	S42 C66	S42-G44 PolarHBondContact O-N 2.03Å; G44-C66 PolarHBondContact N-O 3.4Å
45	E	90.5	Very high	87.6	Confident	66 Å²	66	72.8 Å²	72.8	31%	0.308	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-68.3	138.8	174.5	-72.9	177.8	-166.7	0	0	111.6	S41 S42 V65 C66	S41-E45 WeakPolarHBondContact CA-OE2 3.15Å; S41-E45 WeakPolarHBondContact CB-OE2 3.33Å; S41-E45 PolarHBondContact OG-OE2 2.76Å; S42-E45 VanDerWaalsContact CB-OE1 3.32Å; S42-E45 WeakPolarHBondContact CB-OE1 3.12Å; S42-E45 PolarHBondContact N-OE1 3.45Å; S42-E45 PolarHBondContact N-OE2 2.92Å; S42-E45 VanDerWaalsContact N-OE2 3.13Å; S42-E45 WeakPolarHBondContact O-CB 3.37Å; S42-E45 PolarHBondContact O-N 3.36Å; S42-E45 PolarHBondContact OG-OE1 2.83Å; E45-V65 WeakPolarHBondContact O-CA 3.34Å; E45-C66 PolarHBondContact O-N 3.16Å
46	E	90.7	Very high	88.8	Confident	114 Å²	114	71 Å²	71	53%	0.533	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130.4	175.6	-52.2	-164.6	143.7	0	0	110.3	K63 I64 V65	E46-K63 WeakPolarHBondContact OE1-CE 3.32Å; E46-K63 IonicContact OE1-NZ 3.28Å; E46-K63 PolarHBondContact OE1-NZ 3.3Å; E46-K63 WeakPolarHBondContact OE2-CD 3.31Å; E46-K63 IonicContact OE2-NZ 2.73Å; E46-K63 PolarHBondContact OE2-NZ 2.73Å; E46-I64 CarbonylContact C-O 3.6Å; E46-I64 WeakPolarHBondContact CA-O 3.48Å; E46-V65 HydrophobicContact CG-CG2 4.16Å
47	L	89.6	Confident	89.8	Confident	13 Å²	13	71.4 Å²	71.4	7%	0.068	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	122.9	171.8	-178.6	68.2	0	0	0	109.9	P26 M34 K63 I64 W72	P26-L47 HydrophobicContact CG-CD2 3.64Å; M34-L47 HydrophobicContact CB-CD1 4.4Å; M34-L47 HydrophobicContact CB-CD2 4.04Å; M34-L47 HydrophobicContact CB-CG 4.37Å; M34-L47 HydrophobicContact CE-CD1 3.69Å; M34-L47 HydrophobicContact CE-CD2 3.87Å; M34-L47 HydrophobicContact CE-CG 4.4Å; M34-L47 HydrophobicContact SD-CD2 4.31Å; L47-K63 VanDerWaalsContact O-CA 3.24Å; L47-K63 WeakPolarHBondContact O-CA 3.45Å; L47-I64 HydrophobicContact CB-CG1 4.07Å; L47-I64 HydrophobicContact CD2-CD1 4.3Å; L47-I64 HydrophobicContact CD2-CG1 4.5Å; L47-I64 PolarHBondContact N-O 3.35Å; L47-I64 PolarHBondContact O-N 3.25Å; L47-W72 HydrophobicContact CB-CE3 4.49Å; L47-W72 HydrophobicContact CB-CH2 3.63Å; L47-W72 HydrophobicContact CB-CZ2 4.38Å; L47-W72 HydrophobicContact CB-CZ3 3.69Å; L47-W72 HydrophobicContact CD2-CH2 4.35Å; L47-W72 HydrophobicContact CD2-CZ2 4.28Å
48	A	91.8	Very high	90.9	Very high	52 Å²	52	68.9 Å²	68.9	43%	0.43	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	131.5	175.1	0	0	0	0	0	111.5	S35	S35-A48 PolarHBondContact N-O 3.13Å; S35-A48 VanDerWaalsContact N-O 3.1Å
49	L	92.9	Very high	91.9	Very high	7 Å²	7	66 Å²	66	4%	0.037	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	143.6	175.9	-59.1	-177.6	0	0	0	110.3	L28 I32 E33 R62 I64 L77	L28-L49 HydrophobicContact CD1-CD2 3.8Å; L28-L49 HydrophobicContact CD2-CD2 4.02Å; I32-L49 HydrophobicContact CG2-CB 4.06Å; I32-L49 HydrophobicContact CG2-CD1 4.24Å; I32-L49 HydrophobicContact CG2-CD2 4.24Å; I32-L49 HydrophobicContact CG2-CG 4.43Å; E33-L49 WeakPolarHBondContact O-CA 3.18Å; L49-R62 PolarHBondContact N-O 2.99Å; L49-I64 HydrophobicContact CD1-CG1 4.43Å; L49-I64 HydrophobicContact CD1-CG2 3.79Å; L49-I64 HydrophobicContact CD2-CD1 4.13Å; L49-I64 HydrophobicContact CD2-CG1 4.22Å; L49-I64 HydrophobicContact CG-CG1 4.38Å; L49-L77 HydrophobicContact CB-CD2 3.71Å; L49-L77 HydrophobicContact CD1-CB 4.5Å; L49-L77 HydrophobicContact CD1-CD2 4.37Å
50	A	93.1	Very high	92.5	Very high	33 Å²	33	58.5 Å²	58.5	27%	0.273	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	163.2	172.8	0	0	0	0	0	110	I32 E33	I32-A50 CarbonylContact C-O 3.52Å; I32-A50 WeakPolarHBondContact CA-O 3.44Å; I32-A50 WeakPolarHBondContact CG2-O 3.42Å; E33-A50 HydrophobicContact CG-CB 4.09Å; E33-A50 PolarHBondContact N-O 3.05Å; E33-A50 PolarHBondContact O-N 3.32Å
51	C	94.7	Very high	92.8	Very high	18 Å²	18	54.9 Å²	54.9	12%	0.122	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	145	168.1	-61.5	0	0	0	0	109	N31 P57 C79	N31-C51 WeakPolarHBondContact O-CA 3.01Å; C51-P57 VanDerWaalsContact SG-CA 3.59Å; C51-P57 VanDerWaalsContact SG-N 3.43Å; C51-C79 WeakPolarHBondContact CA-SG 3.41Å; C51-C79 HydrophobicContact CB-CB 3.77Å; C51-C79 WeakPolarHBondContact CB-SG 3.38Å; C51-C79 WeakPolarHBondContact SG-CB 3.26Å; C51-C79 CovalentContact SG-SG 2.04Å; C51-C79 PolarHBondContact SG-SG 3Å
52	K	95.1	Very high	93	Very high	96 Å²	96	62.1 Å²	62.1	42%	0.417	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-56.6	160.8	172.8	-70	-174.9	-177.3	-179	0	111.1	N31 E33 G54 Y55	N31-K52 HydrophobicContact CB-CD 4.48Å; N31-K52 PolarHBondContact O-N 3.43Å; E33-K52 HydrophobicContact CB-CG 4.28Å; E33-K52 HydrophobicContact CG-CG 4.48Å; K52-G54 PolarHBondContact O-N 3.32Å; K52-Y55 HydrophobicContact CB-CD2 4.29Å; K52-Y55 WeakPolarHBondContact O-CB 3.45Å; K52-Y55 PolarHBondContact O-N 3.4Å
53	E	95.3	Very high	93.1	Very high	152 Å²	152	63.8 Å²	63.8	71%	0.71	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	135	174.9	-146.4	-165.4	155.1	0	0	111.7	Y55 A126	E53-Y55 VanDerWaalsContact C-N 3.31Å; E53-Y55 WeakPolarHBondContact O-CD2 3.47Å; E53-Y55 PolarHBondContact O-N 3.01Å; E53-A126 HydrophobicContact CG-CB 3.85Å; E53-A126 WeakPolarHBondContact OE1-CB 3.42Å
54	G	95.8	Very high	93.1	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	-0.6	-175.7	0	0	0	0	0	115.7	K52 K82 Y102	K52-G54 PolarHBondContact O-N 3.32Å; G54-K82 WeakPolarHBondContact O-CG 3.5Å; G54-K82 PolarHBondContact O-N 3.27Å; G54-Y102 WeakPolarHBondContact O-CB 3.4Å
55	Y	96.6	Very high	93.4	Very high	50 Å²	50	60.7 Å²	60.7	20%	0.196	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	153.3	175.6	-66.1	-99.5	0	0	0	112	N31 K52 E53 I80 P81 Y102	N31-Y55 HydrophobicContact CB-CD1 3.7Å; N31-Y55 HydrophobicContact CB-CD2 3.9Å; N31-Y55 HydrophobicContact CB-CE1 3.84Å; N31-Y55 HydrophobicContact CB-CE2 4.02Å; N31-Y55 HydrophobicContact CB-CG 3.76Å; N31-Y55 VanDerWaalsContact CG-CE1 3.5Å; N31-Y55 WeakPolarHBondContact ND2-CE1 3.48Å; N31-Y55 PolarHBondContact ND2-OH 2.79Å; K52-Y55 HydrophobicContact CB-CD2 4.29Å; K52-Y55 WeakPolarHBondContact O-CB 3.45Å; K52-Y55 PolarHBondContact O-N 3.4Å; E53-Y55 VanDerWaalsContact C-N 3.31Å; E53-Y55 WeakPolarHBondContact O-CD2 3.47Å; E53-Y55 PolarHBondContact O-N 3.01Å; Y55-I80 CarbonylContact C-O 3.56Å; Y55-I80 VanDerWaalsContact CA-O 3.26Å; Y55-I80 WeakPolarHBondContact CA-O 3.38Å; Y55-I80 WeakPolarHBondContact CB-O 3.39Å; Y55-I80 VanDerWaalsContact CD1-C 3.45Å; Y55-P81 HydrophobicContact CD1-CB 4.25Å; Y55-P81 HydrophobicContact CE1-CB 4Å; Y55-Y102 HydrophobicContact CD2-CD1 4.45Å; Y55-Y102 AromaticContact CE2-CD1 3.98Å; Y55-Y102 HydrophobicContact CE2-CD1 3.98Å; Y55-Y102 HydrophobicContact CE2-CE1 4.19Å
56	T	94.9	Very high	93.5	Very high	58 Å²	58	57.6 Å²	57.6	36%	0.356	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	144.5	176.3	-170.1	0	0	0	0	110.4	L58 C79 I80 K82	T56-L58 PolarHBondContact O-N 2.99Å; T56-C79 WeakPolarHBondContact O-CA 3.5Å; T56-I80 HydrophobicContact CG2-CD1 4.35Å; T56-I80 HydrophobicContact CG2-CG1 3.79Å; T56-I80 PolarHBondContact N-O 3.03Å; T56-I80 PolarHBondContact O-N 3.4Å; T56-K82 HydrophobicContact CG2-CG 4.48Å
57	P	94.5	Very high	93.6	Very high	39 Å²	39	54.3 Å²	54.3	25%	0.253	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	122.2	-179.4	24.7	-31.4	0	0	0	111.6	C51 L77	C51-P57 VanDerWaalsContact SG-CA 3.59Å; C51-P57 VanDerWaalsContact SG-N 3.43Å; P57-L77 HydrophobicContact CB-CD1 3.96Å
58	L	95.3	Very high	93.7	Very high	105 Å²	105	59.8 Å²	59.8	55%	0.55	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-47.4	177.9	175.9	63	0	0	0	112.2	T56 K78 I80	T56-L58 PolarHBondContact O-N 2.99Å; L58-K78 HydrophobicContact CB-CB 4.46Å; L58-K78 PolarHBondContact N-O 2.93Å; L58-I80 HydrophobicContact CB-CD1 4.22Å; L58-I80 HydrophobicContact CB-CG1 4.08Å; L58-I80 HydrophobicContact CB-CG2 3.97Å; L58-I80 HydrophobicContact CD1-CD1 4.03Å; L58-I80 HydrophobicContact CD2-CG2 3.7Å; L58-I80 HydrophobicContact CG-CG2 4.37Å
59	S	95.4	Very high	93.6	Very high	57 Å²	57	62.9 Å²	62.9	40%	0.399	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	165.4	-177.7	55.7	0	0	0	0	112.3	L77 K78	S59-L77 CarbonylContact O-C 3.59Å; S59-L77 WeakPolarHBondContact O-CA 3.41Å; S59-K78 PolarHBondContact O-N 2.82Å
60	G	91.8	Very high	93.4	Very high	43 Å²	43	63.4 Å²	63.4	44%	0.443	34%	0.344	S	S	.	.	S	Bend	trans	91.2	163.3	177.7	0	0	0	0	0	114.3
61	P	92.1	Very high	93.3	Very high	70 Å²	70	66.2 Å²	66.2	46%	0.455	36%	0.358	S	S	.	.			trans	-72.1	139.7	-179.6	29.9	-33.2	0	0	0	111	K63	P61-K63 HydrophobicContact CB-CG 4.49Å; P61-K63 PolarHBondContact O-N 2.83Å; P61-K63 VanDerWaalsContact O-N 3.11Å
62	R	92.6	Very high	93.2	Very high	157 Å²	157	67.1 Å²	67.1	59%	0.592	36%	0.359	S	S	*	.	S	Bend	trans	-83.1	30.7	176.1	-61.9	-170.3	-169.6	176	7.7	113	L49 L77	L49-R62 PolarHBondContact N-O 2.99Å; R62-L77 HydrophobicContact CG-CD1 4.09Å
63	K	92.4	Very high	93.1	Very high	95 Å²	95	65.2 Å²	65.2	41%	0.413	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	150.6	-179.2	60.1	175.7	-177.8	171.9	0	112	E46 L47 P61	E46-K63 WeakPolarHBondContact OE1-CE 3.32Å; E46-K63 IonicContact OE1-NZ 3.28Å; E46-K63 PolarHBondContact OE1-NZ 3.3Å; E46-K63 WeakPolarHBondContact OE2-CD 3.31Å; E46-K63 IonicContact OE2-NZ 2.73Å; E46-K63 PolarHBondContact OE2-NZ 2.73Å; L47-K63 VanDerWaalsContact O-CA 3.24Å; L47-K63 WeakPolarHBondContact O-CA 3.45Å; P61-K63 HydrophobicContact CB-CG 4.49Å; P61-K63 PolarHBondContact O-N 2.83Å; P61-K63 VanDerWaalsContact O-N 3.11Å
64	I	92.8	Very high	92.9	Very high	5 Å²	5	62.6 Å²	62.6	3%	0.026	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	153.1	170.2	53.9	176.6	0	0	0	109.2	P26 E46 L47 L49 W72 T73	P26-I64 HydrophobicContact CB-CD1 4.24Å; P26-I64 HydrophobicContact CG-CD1 4.12Å; E46-I64 CarbonylContact C-O 3.6Å; E46-I64 WeakPolarHBondContact CA-O 3.48Å; L47-I64 HydrophobicContact CB-CG1 4.07Å; L47-I64 HydrophobicContact CD2-CD1 4.3Å; L47-I64 HydrophobicContact CD2-CG1 4.5Å; L47-I64 PolarHBondContact N-O 3.35Å; L47-I64 PolarHBondContact O-N 3.25Å; L49-I64 HydrophobicContact CD1-CG1 4.43Å; L49-I64 HydrophobicContact CD1-CG2 3.79Å; L49-I64 HydrophobicContact CD2-CD1 4.13Å; L49-I64 HydrophobicContact CD2-CG1 4.22Å; L49-I64 HydrophobicContact CG-CG1 4.38Å; I64-W72 HydrophobicContact CB-CE3 4.25Å; I64-W72 HydrophobicContact CD1-CB 4.11Å; I64-W72 HydrophobicContact CD1-CD2 3.93Å; I64-W72 HydrophobicContact CD1-CE3 3.89Å; I64-W72 HydrophobicContact CD1-CG 4.04Å; I64-W72 HydrophobicContact CG1-CD2 4.3Å; I64-W72 HydrophobicContact CG1-CE3 3.73Å; I64-W72 HydrophobicContact CG1-CZ3 4.23Å; I64-T73 WeakPolarHBondContact CA-OG1 3.47Å; I64-T73 WeakPolarHBondContact CB-OG1 3.43Å; I64-T73 WeakPolarHBondContact CG2-O 3.04Å
65	V	93.7	Very high	92.8	Very high	44 Å²	44	65.2 Å²	65.2	27%	0.267	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	138.5	-175	-171.7	0	0	0	0	109.9	E45 E46 T67 W72 T73	E45-V65 WeakPolarHBondContact O-CA 3.34Å; E46-V65 HydrophobicContact CG-CG2 4.16Å; V65-T67 PolarHBondContact O-N 3.05Å; V65-W72 VanDerWaalsContact C-CE3 3.42Å; V65-T73 HydrophobicContact CB-CG2 4.18Å; V65-T73 PolarHBondContact N-OG1 3.13Å; V65-T73 PolarHBondContact O-N 3.1Å
66	C	93.1	Very high	92.6	Very high	1 Å²	1	70 Å²	70	1%	0.007	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-75.7	118.7	172.2	-178.3	0	0	0	0	109.7	C23 S41 S42 G44 E45 W72	C23-C66 HydrophobicContact CB-CB 3.82Å; C23-C66 WeakPolarHBondContact CB-SG 3.02Å; C23-C66 PolarHBondContact N-SG 3.01Å; C23-C66 VanDerWaalsContact N-SG 3.43Å; C23-C66 WeakPolarHBondContact SG-CA 3.24Å; C23-C66 WeakPolarHBondContact SG-CB 3.3Å; C23-C66 CovalentContact SG-SG 2.03Å; C23-C66 PolarHBondContact SG-SG 2.86Å; S41-C66 PolarHBondContact O-SG 3.11Å; S41-C66 VanDerWaalsContact O-SG 3.36Å; S42-C66 WeakPolarHBondContact O-CB 3.14Å; G44-C66 PolarHBondContact N-O 3.4Å; E45-C66 PolarHBondContact O-N 3.16Å; C66-W72 HydrophobicContact CB-CE3 4.12Å; C66-W72 HydrophobicContact CB-CH2 4.03Å; C66-W72 HydrophobicContact CB-CZ3 3.82Å; C66-W72 VanDerWaalsContact N-CZ3 3.31Å
67	T	92.7	Very high	92.5	Very high	46 Å²	46	67.8 Å²	67.8	28%	0.282	38%	0.377	S	S	.	.			trans	-78.7	163.3	179.9	66.7	0	0	0	0	111.8	V65 N69 G70 V71 T73	V65-T67 PolarHBondContact O-N 3.05Å; T67-N69 PolarHBondContact O-N 3.37Å; T67-G70 PolarHBondContact O-N 3.3Å; T67-V71 VanDerWaalsContact CB-O 3.3Å; T67-V71 WeakPolarHBondContact CB-O 3.04Å; T67-V71 VanDerWaalsContact CG2-O 3.28Å; T67-V71 WeakPolarHBondContact CG2-O 3.46Å; T67-V71 PolarHBondContact N-O 2.85Å; T67-V71 PolarHBondContact OG1-N 2.04Å; T67-V71 PolarHBondContact OG1-O 2.81Å; T67-T73 HydrophobicContact CG2-CG2 4.07Å
68	I	90.5	Very high	92.6	Very high	127 Å²	127	72.2 Å²	72.2	65%	0.651	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-14.3	176.1	62.9	169.3	0	0	0	114.4	N21 P43	N21-I68 VanDerWaalsContact CB-O 3.28Å; N21-I68 WeakPolarHBondContact CB-O 3.27Å; N21-I68 PolarHBondContact ND2-O 2.78Å; P43-I68 HydrophobicContact CB-CG2 4.36Å
69	N	90.1	Very high	92.6	Very high	117 Å²	117	68 Å²	68	63%	0.626	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	6.6	178.1	-62.7	-30.3	0	0	0	112.5	T67 V71	T67-N69 PolarHBondContact O-N 3.37Å; N69-V71 VanDerWaalsContact C-N 3.32Å; N69-V71 PolarHBondContact O-N 3.35Å
70	G	88.3	Confident	92.7	Very high	19 Å²	19	68.5 Å²	68.5	20%	0.196	37%	0.37	C	S	.	.	S	Bend	trans	73.2	21	-178.8	0	0	0	0	0	114.2	T67	T67-G70 PolarHBondContact O-N 3.3Å
71	V	91.4	Very high	92.9	Very high	92 Å²	92	68.4 Å²	68.4	56%	0.558	36%	0.361	S	S	*	.			trans	-119.6	138.5	179.5	-176.4	0	0	0	0	110.3	C23 T67 N69	C23-V71 VanDerWaalsContact SG-C 3.58Å; C23-V71 PolarHBondContact SG-N 3.29Å; T67-V71 VanDerWaalsContact CB-O 3.3Å; T67-V71 WeakPolarHBondContact CB-O 3.04Å; T67-V71 VanDerWaalsContact CG2-O 3.28Å; T67-V71 WeakPolarHBondContact CG2-O 3.46Å; T67-V71 PolarHBondContact N-O 2.85Å; T67-V71 PolarHBondContact OG1-N 2.04Å; T67-V71 PolarHBondContact OG1-O 2.81Å; N69-V71 VanDerWaalsContact C-N 3.32Å; N69-V71 PolarHBondContact O-N 3.35Å
72	W	92.5	Very high	93.2	Very high	37 Å²	37	68.2 Å²	68.2	14%	0.14	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-71.3	144.7	174.7	-69.7	105.9	0	0	0	112.2	C23 S24 P26 L47 I64 V65 C66	C23-W72 HydrophobicContact CB-CD2 4.01Å; C23-W72 VanDerWaalsContact CB-CE2 3.42Å; C23-W72 HydrophobicContact CB-CG 4.29Å; C23-W72 HydrophobicContact CB-CH2 4.47Å; C23-W72 HydrophobicContact CB-CZ2 3.7Å; S24-W72 PolarHBondContact O-NE1 2.85Å; P26-W72 HydrophobicContact CB-CG 4.27Å; L47-W72 HydrophobicContact CB-CE3 4.49Å; L47-W72 HydrophobicContact CB-CH2 3.63Å; L47-W72 HydrophobicContact CB-CZ2 4.38Å; L47-W72 HydrophobicContact CB-CZ3 3.69Å; L47-W72 HydrophobicContact CD2-CH2 4.35Å; L47-W72 HydrophobicContact CD2-CZ2 4.28Å; I64-W72 HydrophobicContact CB-CE3 4.25Å; I64-W72 HydrophobicContact CD1-CB 4.11Å; I64-W72 HydrophobicContact CD1-CD2 3.93Å; I64-W72 HydrophobicContact CD1-CE3 3.89Å; I64-W72 HydrophobicContact CD1-CG 4.04Å; I64-W72 HydrophobicContact CG1-CD2 4.3Å; I64-W72 HydrophobicContact CG1-CE3 3.73Å; I64-W72 HydrophobicContact CG1-CZ3 4.23Å; V65-W72 VanDerWaalsContact C-CE3 3.42Å; C66-W72 HydrophobicContact CB-CE3 4.12Å; C66-W72 HydrophobicContact CB-CH2 4.03Å; C66-W72 HydrophobicContact CB-CZ3 3.82Å; C66-W72 VanDerWaalsContact N-CZ3 3.31Å
73	T	93.6	Very high	93.4	Very high	55 Å²	55	66.4 Å²	66.4	34%	0.337	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-60.7	142.5	167.7	56.6	0	0	0	0	111.2	I64 V65 T67 T75	I64-T73 WeakPolarHBondContact CA-OG1 3.47Å; I64-T73 WeakPolarHBondContact CB-OG1 3.43Å; I64-T73 WeakPolarHBondContact CG2-O 3.04Å; V65-T73 HydrophobicContact CB-CG2 4.18Å; V65-T73 PolarHBondContact N-OG1 3.13Å; V65-T73 PolarHBondContact O-N 3.1Å; T67-T73 HydrophobicContact CG2-CG2 4.07Å; T73-T75 PolarHBondContact O-N 2.8Å
74	S	91.4	Very high	93.6	Very high	98 Å²	98	62.2 Å²	62.2	69%	0.685	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-58	127	176	60.1	0	0	0	0	111.5
75	T	92.3	Very high	93.8	Very high	54 Å²	54	65.6 Å²	65.6	33%	0.331	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-67.7	135.1	173.6	179.1	0	0	0	0	110.8	I32 T73 L77	I32-T75 HydrophobicContact CD1-CG2 4.17Å; T73-T75 PolarHBondContact O-N 2.8Å; T75-L77 WeakPolarHBondContact OG1-CB 3.48Å; T75-L77 PolarHBondContact OG1-N 3.39Å; T75-L77 VanDerWaalsContact OG1-N 3.16Å
76	K	92.3	Very high	93.9	Very high	152 Å²	152	69.9 Å²	69.9	66%	0.661	37%	0.373	S	S	*	.			trans	-110.7	4.4	168.1	-61.9	-178.3	-179.4	179.5	0	111.8	K78	K76-K78 PolarHBondContact O-N 2.78Å
77	L	94	Very high	94	Very high	10 Å²	10	70 Å²	70	5%	0.052	37%	0.374	C	S	.	.			trans	-64.7	126.6	177.2	-179.4	63	0	0	0	108.9	I32 L49 P57 S59 R62 T75	I32-L77 HydrophobicContact CD1-CB 4.17Å; I32-L77 HydrophobicContact CD1-CG 4.44Å; I32-L77 VanDerWaalsContact CD1-O 3.31Å; I32-L77 WeakPolarHBondContact CD1-O 3.46Å; I32-L77 HydrophobicContact CG1-CD2 4.37Å; I32-L77 HydrophobicContact CG2-CD2 4.03Å; L49-L77 HydrophobicContact CB-CD2 3.71Å; L49-L77 HydrophobicContact CD1-CB 4.5Å; L49-L77 HydrophobicContact CD1-CD2 4.37Å; P57-L77 HydrophobicContact CB-CD1 3.96Å; S59-L77 CarbonylContact O-C 3.59Å; S59-L77 WeakPolarHBondContact O-CA 3.41Å; R62-L77 HydrophobicContact CG-CD1 4.09Å; T75-L77 WeakPolarHBondContact OG1-CB 3.48Å; T75-L77 PolarHBondContact OG1-N 3.39Å; T75-L77 VanDerWaalsContact OG1-N 3.16Å
78	K	95.5	Very high	94.1	Very high	132 Å²	132	74.4 Å²	74.4	57%	0.574	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.3	124.8	173.1	-67.7	-174.5	176.9	-176.2	0	109	L58 S59 K76	L58-K78 HydrophobicContact CB-CB 4.46Å; L58-K78 PolarHBondContact N-O 2.93Å; S59-K78 PolarHBondContact O-N 2.82Å; K76-K78 PolarHBondContact O-N 2.78Å
79	C	96.1	Very high	94.3	Very high	18 Å²	18	75.3 Å²	75.3	12%	0.122	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	131.1	176.1	-65.6	0	0	0	0	109.4	N31 C51 T56	N31-C79 HydrophobicContact CB-CB 4.43Å; C51-C79 WeakPolarHBondContact CA-SG 3.41Å; C51-C79 HydrophobicContact CB-CB 3.77Å; C51-C79 WeakPolarHBondContact CB-SG 3.38Å; C51-C79 WeakPolarHBondContact SG-CB 3.26Å; C51-C79 CovalentContact SG-SG 2.04Å; C51-C79 PolarHBondContact SG-SG 3Å; T56-C79 WeakPolarHBondContact O-CA 3.5Å
80	I	96.4	Very high	94.6	Very high	67 Å²	67	70.8 Å²	70.8	34%	0.344	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	151.9	174.3	59.1	170.3	0	0	0	109.6	Y55 T56 L58	Y55-I80 CarbonylContact C-O 3.56Å; Y55-I80 VanDerWaalsContact CA-O 3.26Å; Y55-I80 WeakPolarHBondContact CA-O 3.38Å; Y55-I80 WeakPolarHBondContact CB-O 3.39Å; Y55-I80 VanDerWaalsContact CD1-C 3.45Å; T56-I80 HydrophobicContact CG2-CD1 4.35Å; T56-I80 HydrophobicContact CG2-CG1 3.79Å; T56-I80 PolarHBondContact N-O 3.03Å; T56-I80 PolarHBondContact O-N 3.4Å; L58-I80 HydrophobicContact CB-CD1 4.22Å; L58-I80 HydrophobicContact CB-CG1 4.08Å; L58-I80 HydrophobicContact CB-CG2 3.97Å; L58-I80 HydrophobicContact CD1-CD1 4.03Å; L58-I80 HydrophobicContact CD2-CG2 3.7Å; L58-I80 HydrophobicContact CG-CG2 4.37Å
81	P	97.5	Very high	95	Very high	41 Å²	41	75.3 Å²	75.3	27%	0.266	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	146.2	177.1	28.3	-36	0	0	0	110	Y55 V101	Y55-P81 HydrophobicContact CD1-CB 4.25Å; Y55-P81 HydrophobicContact CE1-CB 4Å; P81-V101 HydrophobicContact CB-CB 3.95Å; P81-V101 HydrophobicContact CB-CG2 4.32Å; P81-V101 HydrophobicContact CG-CB 3.8Å; P81-V101 HydrophobicContact CG-CG1 4.12Å; P81-V101 HydrophobicContact CG-CG2 4Å
82	K	97.4	Very high	95.3	Very high	66 Å²	66	73.6 Å²	73.6	29%	0.287	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-64.9	139.7	174.2	-72.1	179	-173.8	177.1	0	109.4	G54 T56 V101 Y102 A126	G54-K82 WeakPolarHBondContact O-CG 3.5Å; G54-K82 PolarHBondContact O-N 3.27Å; T56-K82 HydrophobicContact CG2-CG 4.48Å; K82-V101 CarbonylContact O-C 3.42Å; K82-V101 WeakPolarHBondContact O-CA 3.38Å; K82-Y102 PolarHBondContact O-N 2.9Å; K82-A126 WeakPolarHBondContact CD-O 3.5Å; K82-A126 WeakPolarHBondContact CE-O 3.47Å; K82-A126 PolarHBondContact NZ-O 2.04Å
83	Q	96.9	Very high	95.5	Very high	119 Å²	119	72.5 Å²	72.5	56%	0.556	38%	0.384	S	S	*	.	B	Isolated β-bridge	trans	-88.3	131.1	174.6	-159.7	90.6	30.3	0	0	109.3	T100	Q83-T100 PolarHBondContact NE2-OG1 2.91Å
84	C	97.4	Very high	95.7	Very high	6 Å²	6	74.5 Å²	74.5	4%	0.041	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-78.6	159.4	165.2	-78.5	0	0	0	0	111.2	T100 C124 T129 W130	C84-T100 PolarHBondContact N-O 2.73Å; C84-C124 HydrophobicContact CB-CB 3.9Å; C84-C124 WeakPolarHBondContact CB-SG 3.05Å; C84-C124 WeakPolarHBondContact SG-CA 3.42Å; C84-C124 WeakPolarHBondContact SG-CB 3.38Å; C84-C124 CovalentContact SG-SG 2.03Å; C84-C124 PolarHBondContact SG-SG 2.83Å; C84-T129 PolarHBondContact SG-O 3.29Å; C84-W130 HydrophobicContact CB-CD2 4.03Å; C84-W130 HydrophobicContact CB-CH2 4.16Å; C84-W130 HydrophobicContact CB-CZ2 3.59Å
85	P	97.1	Very high	95.9	Very high	77 Å²	77	71.2 Å²	71.2	50%	0.5	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-54.4	152	171.1	-23.4	33.3	0	0	0	111.1	G128 W130	P85-G128 WeakPolarHBondContact CD-O 3.27Å; P85-W130 PolarHBondContact O-NE1 3.4Å
86	H	96.1	Very high	96.2	Very high	134 Å²	134	73.8 Å²	73.8	62%	0.62	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-56.6	129.7	172.5	-167.3	77.3	0	0	0	109.6	Y97	H86-Y97 PolarHBondContact CE1-OH 2.82Å
87	P	94.9	Very high	96.4	Very high	3 Å²	3	71 Å²	71	2%	0.019	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-63.6	146.8	-177.9	-15.4	25.6	0	0	0	111.8	L95 Y97 T100 I106 W130	P87-L95 HydrophobicContact CB-CD1 4.12Å; P87-L95 HydrophobicContact CB-CD2 3.79Å; P87-L95 HydrophobicContact CG-CD2 4.43Å; P87-Y97 HydrophobicContact CG-CD1 4.31Å; P87-Y97 HydrophobicContact CG-CE1 4.34Å; P87-T100 HydrophobicContact CG-CG2 3.95Å; P87-I106 HydrophobicContact CB-CD1 3.6Å; P87-I106 HydrophobicContact CG-CD1 3.88Å; P87-I106 HydrophobicContact CG-CG2 4.03Å; P87-W130 HydrophobicContact CG-CZ2 3.82Å
88	E	93.6	Very high	96.5	Very high	139 Å²	139	79.5 Å²	79.5	65%	0.65	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-77.6	138.5	-179.5	-64.7	177.6	-170.1	0	0	110.6	Y108 A134	E88-Y108 WeakPolarHBondContact O-CE1 3.46Å; E88-A134 HydrophobicContact CB-CB 4.02Å
89	L	95	Very high	96.6	Very high	145 Å²	145	77.8 Å²	77.8	76%	0.759	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-77.2	136	170.6	-66.4	173.1	0	0	0	109.5	L95	L89-L95 HydrophobicContact CD2-CB 4.32Å; L89-L95 HydrophobicContact CD2-CD2 3.96Å
90	I	96.7	Very high	96.6	Very high	23 Å²	23	77.7 Å²	77.7	12%	0.118	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-100.1	145.6	178.2	64.2	175	0	0	0	110.6	Y108 A134 P135	I90-Y108 HydrophobicContact CD1-CD1 3.78Å; I90-Y108 HydrophobicContact CD1-CG 4.24Å; I90-Y108 HydrophobicContact CG1-CD1 4.15Å; I90-Y108 HydrophobicContact CG2-CD1 3.98Å; I90-Y108 HydrophobicContact CG2-CE1 3.98Å; I90-A134 HydrophobicContact CG2-CB 4.09Å; I90-P135 HydrophobicContact CD1-CG 4.39Å; I90-P135 VanDerWaalsContact CG2-O 3.26Å; I90-P135 WeakPolarHBondContact CG2-O 3.4Å
91	T	96.8	Very high	96.7	Very high	113 Å²	113	75.9 Å²	75.9	69%	0.693	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	139.2	176.6	-56.8	0	0	0	0	109.9	G93 C137	T91-G93 VanDerWaalsContact C-N 3.26Å; T91-G93 PolarHBondContact O-N 3.48Å; T91-C137 WeakPolarHBondContact O-CB 3.46Å
92	N	96.7	Very high	96.7	Very high	56 Å²	56	76.4 Å²	76.4	30%	0.299	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	35.6	-173.9	-50.7	-55.7	0	0	0	113.7	H111 Y114 C137	N92-H111 WeakPolarHBondContact CA-ND1 3.32Å; N92-H111 PolarHBondContact O-N 2.9Å; N92-Y114 HydrophobicContact CB-CD1 3.6Å; N92-Y114 HydrophobicContact CB-CD2 3.9Å; N92-Y114 HydrophobicContact CB-CE1 3.62Å; N92-Y114 HydrophobicContact CB-CE2 3.92Å; N92-Y114 HydrophobicContact CB-CG 3.76Å; N92-Y114 WeakPolarHBondContact ND2-CE1 3.37Å; N92-C137 HydrophobicContact CB-CB 4.33Å
93	G	97.1	Very high	96.7	Very high	14 Å²	14	79.5 Å²	79.5	14%	0.144	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	178.1	173.4	0	0	0	0	0	112.3	T91 T109 H111	T91-G93 VanDerWaalsContact C-N 3.26Å; T91-G93 PolarHBondContact O-N 3.48Å; G93-T109 CarbonylContact C-O 3.58Å; G93-T109 WeakPolarHBondContact CA-O 3.19Å; G93-H111 PolarHBondContact O-NE2 2.92Å
94	E	97.6	Very high	96.7	Very high	97 Å²	97	75 Å²	75	45%	0.453	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	151.8	-177.7	-57	-177.3	151.5	0	0	109.7	F96 Y108 T109	E94-F96 HydrophobicContact CB-CD2 4.46Å; E94-F96 HydrophobicContact CB-CE2 3.62Å; E94-F96 HydrophobicContact CB-CZ 3.96Å; E94-F96 VanDerWaalsContact OE2-CZ 3.28Å; E94-F96 WeakPolarHBondContact OE2-CZ 3.33Å; E94-Y108 WeakPolarHBondContact O-CA 3.28Å; E94-T109 PolarHBondContact N-O 2.91Å; E94-T109 PolarHBondContact O-N 2.85Å
95	L	97.4	Very high	96.7	Very high	30 Å²	30	77 Å²	77	16%	0.157	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.7	180	163.3	67	0	0	0	108.8	P87 L89 Y97 I106 Y108	P87-L95 HydrophobicContact CB-CD1 4.12Å; P87-L95 HydrophobicContact CB-CD2 3.79Å; P87-L95 HydrophobicContact CG-CD2 4.43Å; L89-L95 HydrophobicContact CD2-CB 4.32Å; L89-L95 HydrophobicContact CD2-CD2 3.96Å; L95-Y97 HydrophobicContact CD1-CD1 3.94Å; L95-Y97 HydrophobicContact CD2-CD1 3.96Å; L95-Y97 HydrophobicContact CD2-CE1 3.7Å; L95-Y97 HydrophobicContact CG-CD1 3.76Å; L95-Y97 HydrophobicContact CG-CE1 3.96Å; L95-I106 HydrophobicContact CD1-CB 4.22Å; L95-I106 HydrophobicContact CD1-CD1 4.44Å; L95-Y108 HydrophobicContact CB-CD1 4.23Å; L95-Y108 HydrophobicContact CB-CE1 4.23Å; L95-Y108 HydrophobicContact CD1-CD1 3.98Å; L95-Y108 HydrophobicContact CD1-CE1 3.56Å; L95-Y108 HydrophobicContact CG-CE1 4.31Å
96	F	97.4	Very high	96.7	Very high	107 Å²	107	73.4 Å²	73.4	47%	0.469	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	126.3	-179.9	-61	-84.7	0	0	0	111.2	E94 N107 T109	E94-F96 HydrophobicContact CB-CD2 4.46Å; E94-F96 HydrophobicContact CB-CE2 3.62Å; E94-F96 HydrophobicContact CB-CZ 3.96Å; E94-F96 VanDerWaalsContact OE2-CZ 3.28Å; E94-F96 WeakPolarHBondContact OE2-CZ 3.33Å; F96-N107 PolarHBondContact N-O 3.02Å; F96-N107 PolarHBondContact O-N 2.82Å; F96-T109 HydrophobicContact CE2-CG2 4.45Å; F96-T109 WeakPolarHBondContact CE2-OG1 3.12Å
97	Y	97.1	Very high	96.8	Very high	95 Å²	95	70.8 Å²	70.8	37%	0.373	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	155.1	173.7	65.2	-84.2	0	0	0	111.6	H86 P87 L95 T100 I106	H86-Y97 PolarHBondContact CE1-OH 2.82Å; P87-Y97 HydrophobicContact CG-CD1 4.31Å; P87-Y97 HydrophobicContact CG-CE1 4.34Å; L95-Y97 HydrophobicContact CD1-CD1 3.94Å; L95-Y97 HydrophobicContact CD2-CD1 3.96Å; L95-Y97 HydrophobicContact CD2-CE1 3.7Å; L95-Y97 HydrophobicContact CG-CD1 3.76Å; L95-Y97 HydrophobicContact CG-CE1 3.96Å; Y97-T100 HydrophobicContact CD2-CG2 3.81Å; Y97-T100 HydrophobicContact CE2-CG2 3.85Å; Y97-I106 VanDerWaalsContact CB-CG2 3.49Å; Y97-I106 HydrophobicContact CG-CG2 4.16Å
98	E	96.1	Very high	97	Very high	187 Å²	187	71.2 Å²	71.2	87%	0.874	36%	0.364	S	S	*	.	S	Bend	trans	-97.8	-43.2	172.4	-64.8	-177.2	170.2	0	0	111.5
99	D	96.3	Very high	97.2	Very high	97 Å²	97	67.4 Å²	67.4	52%	0.519	35%	0.35	S	S	.	.			trans	-143.2	167.9	-175.8	-89.6	-44.6	0	0	0	111.3	V101 S104	D99-V101 HydrophobicContact CB-CG2 4.41Å; D99-S104 WeakPolarHBondContact CB-OG 2.98Å; D99-S104 VanDerWaalsContact O-CB 3.31Å; D99-S104 WeakPolarHBondContact O-CB 3.1Å
100	T	97.3	Very high	97.3	Very high	15 Å²	15	62 Å²	62	9%	0.092	33%	0.325	C	S	.	.			trans	-129.8	31.5	-178.7	52.5	0	0	0	0	112.2	Q83 C84 P87 Y97 W130	Q83-T100 PolarHBondContact NE2-OG1 2.91Å; C84-T100 PolarHBondContact N-O 2.73Å; P87-T100 HydrophobicContact CG-CG2 3.95Å; Y97-T100 HydrophobicContact CD2-CG2 3.81Å; Y97-T100 HydrophobicContact CE2-CG2 3.85Å; T100-W130 HydrophobicContact CG2-CH2 4.22Å; T100-W130 HydrophobicContact CG2-CZ2 3.9Å
101	V	97.6	Very high	97.4	Very high	30 Å²	30	64.7 Å²	64.7	18%	0.182	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-102.6	168.8	180	-61.1	0	0	0	0	111.4	P81 K82 D99 Q103 S104 C124	P81-V101 HydrophobicContact CB-CB 3.95Å; P81-V101 HydrophobicContact CB-CG2 4.32Å; P81-V101 HydrophobicContact CG-CB 3.8Å; P81-V101 HydrophobicContact CG-CG1 4.12Å; P81-V101 HydrophobicContact CG-CG2 4Å; K82-V101 CarbonylContact O-C 3.42Å; K82-V101 WeakPolarHBondContact O-CA 3.38Å; D99-V101 HydrophobicContact CB-CG2 4.41Å; V101-Q103 PolarHBondContact O-N 2.8Å; V101-S104 WeakPolarHBondContact CG2-OG 3.06Å; V101-S104 PolarHBondContact N-OG 2.85Å; V101-S104 WeakPolarHBondContact O-CB 3.31Å; V101-S104 PolarHBondContact O-N 3.13Å; V101-S104 PolarHBondContact O-OG 2.03Å; V101-C124 WeakPolarHBondContact O-CB 3.49Å
102	Y	97.9	Very high	97.4	Very high	51 Å²	51	66.7 Å²	66.7	20%	0.2	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.6	129.6	178.5	175.3	-125.2	0	0	0	112.2	G54 Y55 K82 S104 C124 A126	G54-Y102 WeakPolarHBondContact O-CB 3.4Å; Y55-Y102 HydrophobicContact CD2-CD1 4.45Å; Y55-Y102 AromaticContact CE2-CD1 3.98Å; Y55-Y102 HydrophobicContact CE2-CD1 3.98Å; Y55-Y102 HydrophobicContact CE2-CE1 4.19Å; K82-Y102 PolarHBondContact O-N 2.9Å; Y102-S104 VanDerWaalsContact C-N 3.26Å; Y102-S104 PolarHBondContact O-N 2.85Å; Y102-C124 WeakPolarHBondContact CD2-O 3.44Å; Y102-A126 HydrophobicContact CD2-CB 4.18Å; Y102-A126 HydrophobicContact CE2-CB 3.6Å
103	Q	96.7	Very high	97.4	Very high	132 Å²	132	64.2 Å²	64.2	62%	0.617	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	-4.9	-173.5	-53.7	-179.3	-21.5	0	0	116.7	V101 C124	V101-Q103 PolarHBondContact O-N 2.8Å; Q103-C124 PolarHBondContact N-O 2.91Å
104	S	97.8	Very high	97.4	Very high	23 Å²	23	66.6 Å²	66.6	16%	0.161	33%	0.33	C	S	.	.			trans	-64.4	144.3	167.7	-59.2	0	0	0	0	110.7	D99 V101 Y102 V123 C124	D99-S104 WeakPolarHBondContact CB-OG 2.98Å; D99-S104 VanDerWaalsContact O-CB 3.31Å; D99-S104 WeakPolarHBondContact O-CB 3.1Å; V101-S104 WeakPolarHBondContact CG2-OG 3.06Å; V101-S104 PolarHBondContact N-OG 2.85Å; V101-S104 WeakPolarHBondContact O-CB 3.31Å; V101-S104 PolarHBondContact O-N 3.13Å; V101-S104 PolarHBondContact O-OG 2.03Å; Y102-S104 VanDerWaalsContact C-N 3.26Å; Y102-S104 PolarHBondContact O-N 2.85Å; S104-V123 WeakPolarHBondContact O-CA 3.47Å; S104-C124 PolarHBondContact O-N 2.98Å
105	A	97.5	Very high	97.3	Very high	50 Å²	50	66 Å²	66	41%	0.413	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	144.2	176.6	0	0	0	0	0	110.6	A122 V123	A105-A122 WeakPolarHBondContact CA-O 3.31Å; A105-V123 HydrophobicContact CB-CG2 4.3Å
106	I	97.9	Very high	97.3	Very high	0 Å²	0	67 Å²	67	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	147.8	174.1	67	174.2	0	0	0	109.1	P87 L95 Y97 Y108 S121 A122 W130	P87-I106 HydrophobicContact CB-CD1 3.6Å; P87-I106 HydrophobicContact CG-CD1 3.88Å; P87-I106 HydrophobicContact CG-CG2 4.03Å; L95-I106 HydrophobicContact CD1-CB 4.22Å; L95-I106 HydrophobicContact CD1-CD1 4.44Å; Y97-I106 VanDerWaalsContact CB-CG2 3.49Å; Y97-I106 HydrophobicContact CG-CG2 4.16Å; I106-Y108 HydrophobicContact CD1-CE2 3.82Å; I106-Y108 VanDerWaalsContact CD1-OH 3.29Å; I106-Y108 WeakPolarHBondContact CD1-OH 3.22Å; I106-Y108 HydrophobicContact CG1-CE2 4.12Å; I106-S121 WeakPolarHBondContact O-CA 3.41Å; I106-S121 WeakPolarHBondContact O-CB 3.35Å; I106-A122 HydrophobicContact CD1-CB 4.13Å; I106-A122 HydrophobicContact CG1-CB 3.89Å; I106-A122 WeakPolarHBondContact CG1-O 3.26Å; I106-A122 PolarHBondContact N-O 3.44Å; I106-A122 PolarHBondContact O-N 2.79Å; I106-W130 HydrophobicContact CB-CZ3 4.48Å; I106-W130 HydrophobicContact CD1-CD2 4.01Å; I106-W130 HydrophobicContact CD1-CE3 4.06Å; I106-W130 HydrophobicContact CD1-CH2 4.33Å; I106-W130 HydrophobicContact CD1-CZ2 4.27Å; I106-W130 HydrophobicContact CD1-CZ3 4.21Å; I106-W130 HydrophobicContact CG1-CE3 4.19Å; I106-W130 HydrophobicContact CG1-CH2 4.44Å; I106-W130 HydrophobicContact CG1-CZ3 4.08Å; I106-W130 HydrophobicContact CG2-CH2 3.36Å; I106-W130 HydrophobicContact CG2-CZ2 3.98Å; I106-W130 HydrophobicContact CG2-CZ3 3.67Å
107	N	98.1	Very high	97.3	Very high	79 Å²	79	64.7 Å²	64.7	42%	0.422	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	144	-179.3	-61.9	-67.3	0	0	0	111	F96 S120 S121	F96-N107 PolarHBondContact N-O 3.02Å; F96-N107 PolarHBondContact O-N 2.82Å; N107-S120 WeakPolarHBondContact CA-O 3.36Å; N107-S121 WeakPolarHBondContact OD1-CB 3.33Å
108	Y	98.3	Very high	97.3	Very high	12 Å²	12	63 Å²	63	5%	0.047	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	146.4	177	-62.2	-82.5	0	0	0	110.1	E88 I90 E94 L95 I106 M116 S120 A134 P135	E88-Y108 WeakPolarHBondContact O-CE1 3.46Å; I90-Y108 HydrophobicContact CD1-CD1 3.78Å; I90-Y108 HydrophobicContact CD1-CG 4.24Å; I90-Y108 HydrophobicContact CG1-CD1 4.15Å; I90-Y108 HydrophobicContact CG2-CD1 3.98Å; I90-Y108 HydrophobicContact CG2-CE1 3.98Å; E94-Y108 WeakPolarHBondContact O-CA 3.28Å; L95-Y108 HydrophobicContact CB-CD1 4.23Å; L95-Y108 HydrophobicContact CB-CE1 4.23Å; L95-Y108 HydrophobicContact CD1-CD1 3.98Å; L95-Y108 HydrophobicContact CD1-CE1 3.56Å; L95-Y108 HydrophobicContact CG-CE1 4.31Å; I106-Y108 HydrophobicContact CD1-CE2 3.82Å; I106-Y108 VanDerWaalsContact CD1-OH 3.29Å; I106-Y108 WeakPolarHBondContact CD1-OH 3.22Å; I106-Y108 HydrophobicContact CG1-CE2 4.12Å; Y108-M116 WeakPolarHBondContact O-CE 3.45Å; Y108-S120 PolarHBondContact N-O 2.82Å; Y108-A134 HydrophobicContact CE1-CB 4.48Å; Y108-P135 HydrophobicContact CD1-CG 4.37Å; Y108-P135 VanDerWaalsContact CD2-CD 3.44Å; Y108-P135 HydrophobicContact CD2-CG 3.85Å; Y108-P135 HydrophobicContact CG-CG 3.74Å
109	T	97.9	Very high	97.3	Very high	59 Å²	59	59.7 Å²	59.7	36%	0.362	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	133.5	172.4	53.2	0	0	0	0	110.1	G93 E94 F96	G93-T109 CarbonylContact C-O 3.58Å; G93-T109 WeakPolarHBondContact CA-O 3.19Å; E94-T109 PolarHBondContact N-O 2.91Å; E94-T109 PolarHBondContact O-N 2.85Å; F96-T109 HydrophobicContact CE2-CG2 4.45Å; F96-T109 WeakPolarHBondContact CE2-OG1 3.12Å
110	C	98	Very high	97.3	Very high	33 Å²	33	58 Å²	58	22%	0.223	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	148.4	173.6	-63.2	0	0	0	0	111.2	C137	C110-C137 WeakPolarHBondContact CA-SG 3.48Å; C110-C137 HydrophobicContact CB-CB 3.84Å; C110-C137 WeakPolarHBondContact CB-SG 3.48Å; C110-C137 VanDerWaalsContact SG-CA 3.54Å; C110-C137 WeakPolarHBondContact SG-CB 3.29Å; C110-C137 CovalentContact SG-SG 2.04Å; C110-C137 PolarHBondContact SG-SG 3.05Å
111	H	97.8	Very high	97.3	Very high	78 Å²	78	59.3 Å²	59.3	36%	0.361	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-64.5	162.6	170.9	-63.8	166.9	0	0	0	111.2	N92 G93 G113 Y114	N92-H111 WeakPolarHBondContact CA-ND1 3.32Å; N92-H111 PolarHBondContact O-N 2.9Å; G93-H111 PolarHBondContact O-NE2 2.92Å; H111-G113 PolarHBondContact O-N 2.92Å; H111-Y114 HydrophobicContact CB-CD2 4.38Å; H111-Y114 PolarHBondContact O-N 3.28Å; H111-Y114 VanDerWaalsContact O-N 3.12Å
112	E	96.6	Very high	97.4	Very high	156 Å²	156	58 Å²	58	73%	0.729	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	134	176.2	-173.3	177.7	-175.7	0	0	111.9	Y114 A190	E112-Y114 VanDerWaalsContact C-N 3.32Å; E112-A190 HydrophobicContact CG-CB 3.99Å
113	G	96.9	Very high	97.4	Very high	3 Å²	3	58.6 Å²	58.6	3%	0.031	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	4.4	-178.3	0	0	0	0	0	115	H111 I140 Y166	H111-G113 PolarHBondContact O-N 2.92Å; G113-I140 WeakPolarHBondContact O-CG1 3.45Å; G113-I140 PolarHBondContact O-N 2.98Å; G113-Y166 VanDerWaalsContact CA-CD1 3.49Å; G113-Y166 VanDerWaalsContact O-CB 3.29Å; G113-Y166 WeakPolarHBondContact O-CB 3.12Å; G113-Y166 WeakPolarHBondContact O-CD1 3.43Å
114	Y	97.6	Very high	97.4	Very high	65 Å²	65	52.3 Å²	52.3	26%	0.255	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	142.9	172.3	-65.7	-100.8	0	0	0	110.4	N92 H111 E112 I138 P139 Y166	N92-Y114 HydrophobicContact CB-CD1 3.6Å; N92-Y114 HydrophobicContact CB-CD2 3.9Å; N92-Y114 HydrophobicContact CB-CE1 3.62Å; N92-Y114 HydrophobicContact CB-CE2 3.92Å; N92-Y114 HydrophobicContact CB-CG 3.76Å; N92-Y114 WeakPolarHBondContact ND2-CE1 3.37Å; H111-Y114 HydrophobicContact CB-CD2 4.38Å; H111-Y114 PolarHBondContact O-N 3.28Å; H111-Y114 VanDerWaalsContact O-N 3.12Å; E112-Y114 VanDerWaalsContact C-N 3.32Å; Y114-I138 CarbonylContact C-O 3.55Å; Y114-I138 VanDerWaalsContact CA-O 3.27Å; Y114-I138 WeakPolarHBondContact CA-O 3.27Å; Y114-P139 HydrophobicContact CD1-CB 4.11Å; Y114-P139 HydrophobicContact CE1-CB 3.86Å; Y114-P139 HydrophobicContact CE1-CG 4.47Å; Y114-Y166 HydrophobicContact CE2-CD1 4.32Å
115	M	95.6	Very high	97.5	Very high	84 Å²	84	55 Å²	55	41%	0.414	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	146.2	173.7	62.6	179.5	-69.3	0	0	110.4	I138 I140	M115-I138 HydrophobicContact CG-CD1 4.13Å; M115-I138 HydrophobicContact CG-CG1 3.59Å; M115-I138 PolarHBondContact N-O 3.2Å; M115-I138 PolarHBondContact O-N 3.36Å; M115-I138 HydrophobicContact SD-CD1 4.34Å; M115-I138 HydrophobicContact SD-CG1 4.41Å; M115-I140 HydrophobicContact CB-CG1 4.07Å; M115-I140 HydrophobicContact CG-CG1 4.3Å
116	M	96.8	Very high	97.4	Very high	52 Å²	52	53.3 Å²	53.3	26%	0.256	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	134.2	-178.7	-172.3	172.5	-75.9	0	0	111.6	Y108 S120 P135 E136	Y108-M116 WeakPolarHBondContact O-CE 3.45Å; M116-S120 WeakPolarHBondContact SD-CA 3.4Å; M116-S120 VanDerWaalsContact SD-CB 3.51Å; M116-P135 HydrophobicContact CE-CB 4.45Å; M116-P135 HydrophobicContact CE-CG 3.94Å; M116-P135 HydrophobicContact CG-CB 3.69Å; M116-P135 HydrophobicContact CG-CG 4.21Å; M116-P135 HydrophobicContact SD-CB 3.94Å; M116-P135 HydrophobicContact SD-CG 3.93Å; M116-E136 WeakPolarHBondContact CA-O 3.02Å
117	T	97.4	Very high	97.4	Very high	57 Å²	57	57.9 Å²	57.9	35%	0.35	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	111.1	167.2	52.9	0	0	0	0	109.5	E136 I138	T117-E136 PolarHBondContact N-O 2.93Å; T117-E136 PolarHBondContact O-N 2.94Å; T117-E136 WeakPolarHBondContact OG1-CB 3.14Å; T117-E136 PolarHBondContact OG1-O 2.83Å; T117-I138 HydrophobicContact CG2-CD1 3.57Å; T117-I138 HydrophobicContact CG2-CG1 3.96Å
118	G	96.3	Very high	97.3	Very high	61 Å²	61	54.8 Å²	54.8	63%	0.629	31%	0.308	S	S	*	.	S	Bend	trans	126.1	-170.3	-174.1	0	0	0	0	0	111.8
119	E	97.4	Very high	97.2	Very high	117 Å²	117	57.1 Å²	57.1	55%	0.547	32%	0.324	S	S	.	.			trans	-82.4	135	175.8	-72.8	-63.2	159.4	0	0	110.9	S121	E119-S121 PolarHBondContact O-N 2.89Å
120	S	96.9	Very high	97.2	Very high	60 Å²	60	56.2 Å²	56.2	42%	0.42	31%	0.314	S	S	.	.	S	Bend	trans	-76.2	-9.7	179	58.9	0	0	0	0	113.9	N107 Y108 M116	N107-S120 WeakPolarHBondContact CA-O 3.36Å; Y108-S120 PolarHBondContact N-O 2.82Å; M116-S120 WeakPolarHBondContact SD-CA 3.4Å; M116-S120 VanDerWaalsContact SD-CB 3.51Å
121	S	97.4	Very high	97.2	Very high	44 Å²	44	57 Å²	57	31%	0.308	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	154.3	179.7	65.7	0	0	0	0	111.5	I106 N107 E119	I106-S121 WeakPolarHBondContact O-CA 3.41Å; I106-S121 WeakPolarHBondContact O-CB 3.35Å; N107-S121 WeakPolarHBondContact OD1-CB 3.33Å; E119-S121 PolarHBondContact O-N 2.89Å
122	A	98.1	Very high	97.2	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.008	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	147.2	171.7	0	0	0	0	0	110.6	A105 I106 W130 S131	A105-A122 WeakPolarHBondContact CA-O 3.31Å; I106-A122 HydrophobicContact CD1-CB 4.13Å; I106-A122 HydrophobicContact CG1-CB 3.89Å; I106-A122 WeakPolarHBondContact CG1-O 3.26Å; I106-A122 PolarHBondContact N-O 3.44Å; I106-A122 PolarHBondContact O-N 2.79Å; A122-W130 HydrophobicContact CB-CB 4.18Å; A122-W130 HydrophobicContact CB-CE3 4.11Å; A122-S131 WeakPolarHBondContact CA-OG 3.39Å
123	V	98.1	Very high	97.2	Very high	64 Å²	64	52.6 Å²	52.6	39%	0.388	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	137.5	179.9	-178.1	0	0	0	0	109.4	S104 A105 Q125 S131	S104-V123 WeakPolarHBondContact O-CA 3.47Å; A105-V123 HydrophobicContact CB-CG2 4.3Å; V123-Q125 PolarHBondContact O-N 2.97Å; V123-S131 PolarHBondContact N-OG 3.46Å; V123-S131 PolarHBondContact O-N 2.76Å
124	C	98.1	Very high	97.2	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.007	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-73.4	115	177.6	-176.2	0	0	0	0	110.4	C84 V101 Y102 Q103 S104 W130	C84-C124 HydrophobicContact CB-CB 3.9Å; C84-C124 WeakPolarHBondContact CB-SG 3.05Å; C84-C124 WeakPolarHBondContact SG-CA 3.42Å; C84-C124 WeakPolarHBondContact SG-CB 3.38Å; C84-C124 CovalentContact SG-SG 2.03Å; C84-C124 PolarHBondContact SG-SG 2.83Å; V101-C124 WeakPolarHBondContact O-CB 3.49Å; Y102-C124 WeakPolarHBondContact CD2-O 3.44Å; Q103-C124 PolarHBondContact N-O 2.91Å; S104-C124 PolarHBondContact O-N 2.98Å; C124-W130 HydrophobicContact CB-CE3 4.08Å; C124-W130 HydrophobicContact CB-CH2 4.02Å; C124-W130 HydrophobicContact CB-CZ3 3.65Å
125	Q	98.1	Very high	97.2	Very high	80 Å²	80	51 Å²	51	37%	0.374	31%	0.312	S	S	.	.			trans	-85.4	168.1	-172.9	-62.8	-179.9	-48	0	0	112.5	V123 N127 G128 T129	V123-Q125 PolarHBondContact O-N 2.97Å; Q125-N127 VanDerWaalsContact CB-OD1 3.27Å; Q125-N127 WeakPolarHBondContact CB-OD1 3.05Å; Q125-N127 PolarHBondContact O-N 3.44Å; Q125-N127 VanDerWaalsContact O-N 3.13Å; Q125-G128 PolarHBondContact O-N 2.84Å; Q125-T129 VanDerWaalsContact CB-O 3.32Å; Q125-T129 WeakPolarHBondContact CB-O 3.49Å; Q125-T129 PolarHBondContact N-O 3.37Å; Q125-T129 PolarHBondContact OE1-OG1 2.99Å
126	A	97.1	Very high	97.3	Very high	14 Å²	14	53.4 Å²	53.4	12%	0.116	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-13.6	-175.2	0	0	0	0	0	114.1	E53 K82 Y102	E53-A126 HydrophobicContact CG-CB 3.85Å; E53-A126 WeakPolarHBondContact OE1-CB 3.42Å; K82-A126 WeakPolarHBondContact CD-O 3.5Å; K82-A126 WeakPolarHBondContact CE-O 3.47Å; K82-A126 PolarHBondContact NZ-O 2.04Å; Y102-A126 HydrophobicContact CD2-CB 4.18Å; Y102-A126 HydrophobicContact CE2-CB 3.6Å
127	N	96.3	Very high	97.3	Very high	96 Å²	96	51.7 Å²	51.7	51%	0.513	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-6.9	171.6	64.6	-6.3	0	0	0	112.9	Q125 T129	Q125-N127 VanDerWaalsContact CB-OD1 3.27Å; Q125-N127 WeakPolarHBondContact CB-OD1 3.05Å; Q125-N127 PolarHBondContact O-N 3.44Å; Q125-N127 VanDerWaalsContact O-N 3.13Å; N127-T129 VanDerWaalsContact CG-OG1 3.24Å; N127-T129 PolarHBondContact ND2-OG1 3.39Å; N127-T129 PolarHBondContact OD1-N 3.44Å; N127-T129 PolarHBondContact OD1-OG1 3.12Å
128	G	95.8	Very high	97.3	Very high	13 Å²	13	51.9 Å²	51.9	13%	0.134	31%	0.313	C	S	.	.	S	Bend	trans	81.6	23.7	-175.3	0	0	0	0	0	113.9	P85 Q125	P85-G128 WeakPolarHBondContact CD-O 3.27Å; Q125-G128 PolarHBondContact O-N 2.84Å
129	T	97.4	Very high	97.3	Very high	61 Å²	61	50.9 Å²	50.9	37%	0.374	30%	0.296	S	S	.	.	S	Bend	trans	-118.8	156.3	172.6	66.9	0	0	0	0	111.5	C84 Q125 N127	C84-T129 PolarHBondContact SG-O 3.29Å; Q125-T129 VanDerWaalsContact CB-O 3.32Å; Q125-T129 WeakPolarHBondContact CB-O 3.49Å; Q125-T129 PolarHBondContact N-O 3.37Å; Q125-T129 PolarHBondContact OE1-OG1 2.99Å; N127-T129 VanDerWaalsContact CG-OG1 3.24Å; N127-T129 PolarHBondContact ND2-OG1 3.39Å; N127-T129 PolarHBondContact OD1-N 3.44Å; N127-T129 PolarHBondContact OD1-OG1 3.12Å
130	W	97.9	Very high	97.3	Very high	40 Å²	40	46.8 Å²	46.8	15%	0.152	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-68.8	143.9	171.4	-66.1	114.3	0	0	0	111	C84 P85 P87 T100 I106 A122 C124 S132	C84-W130 HydrophobicContact CB-CD2 4.03Å; C84-W130 HydrophobicContact CB-CH2 4.16Å; C84-W130 HydrophobicContact CB-CZ2 3.59Å; P85-W130 PolarHBondContact O-NE1 3.4Å; P87-W130 HydrophobicContact CG-CZ2 3.82Å; T100-W130 HydrophobicContact CG2-CH2 4.22Å; T100-W130 HydrophobicContact CG2-CZ2 3.9Å; I106-W130 HydrophobicContact CB-CZ3 4.48Å; I106-W130 HydrophobicContact CD1-CD2 4.01Å; I106-W130 HydrophobicContact CD1-CE3 4.06Å; I106-W130 HydrophobicContact CD1-CH2 4.33Å; I106-W130 HydrophobicContact CD1-CZ2 4.27Å; I106-W130 HydrophobicContact CD1-CZ3 4.21Å; I106-W130 HydrophobicContact CG1-CE3 4.19Å; I106-W130 HydrophobicContact CG1-CH2 4.44Å; I106-W130 HydrophobicContact CG1-CZ3 4.08Å; I106-W130 HydrophobicContact CG2-CH2 3.36Å; I106-W130 HydrophobicContact CG2-CZ2 3.98Å; I106-W130 HydrophobicContact CG2-CZ3 3.67Å; A122-W130 HydrophobicContact CB-CB 4.18Å; A122-W130 HydrophobicContact CB-CE3 4.11Å; C124-W130 HydrophobicContact CB-CE3 4.08Å; C124-W130 HydrophobicContact CB-CH2 4.02Å; C124-W130 HydrophobicContact CB-CZ3 3.65Å; W130-S132 PolarHBondContact O-N 2.8Å
131	S	98	Very high	97.2	Very high	50 Å²	50	46.9 Å²	46.9	35%	0.35	28%	0.277	S	S	.	.	S	Bend	trans	-65.4	-25.9	179.4	62.1	0	0	0	0	114.2	A122 V123	A122-S131 WeakPolarHBondContact CA-OG 3.39Å; V123-S131 PolarHBondContact N-OG 3.46Å; V123-S131 PolarHBondContact O-N 2.76Å
132	S	97	Very high	97.1	Very high	29 Å²	29	45 Å²	45	20%	0.203	26%	0.263	C	S	.	.	S	Bend	trans	-141.7	146.8	-177.7	-52.9	0	0	0	0	108.9	W130	W130-S132 PolarHBondContact O-N 2.8Å
133	P	96.6	Very high	96.9	Very high	112 Å²	112	46.9 Å²	46.9	73%	0.727	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-67.7	166.1	170.8	31.1	-35.3	0	0	0	111.1
134	A	96.8	Very high	96.8	Very high	30 Å²	30	47.6 Å²	47.6	25%	0.248	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-62.2	137.9	174	0	0	0	0	0	110.8	E88 I90 Y108	E88-A134 HydrophobicContact CB-CB 4.02Å; I90-A134 HydrophobicContact CG2-CB 4.09Å; Y108-A134 HydrophobicContact CE1-CB 4.48Å
135	P	97.9	Very high	96.7	Very high	6 Å²	6	47.8 Å²	47.8	4%	0.039	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-76.8	165.6	178.3	32.8	-35.6	0	0	0	111.7	I90 Y108 M116	I90-P135 HydrophobicContact CD1-CG 4.39Å; I90-P135 VanDerWaalsContact CG2-O 3.26Å; I90-P135 WeakPolarHBondContact CG2-O 3.4Å; Y108-P135 HydrophobicContact CD1-CG 4.37Å; Y108-P135 VanDerWaalsContact CD2-CD 3.44Å; Y108-P135 HydrophobicContact CD2-CG 3.85Å; Y108-P135 HydrophobicContact CG-CG 3.74Å; M116-P135 HydrophobicContact CE-CB 4.45Å; M116-P135 HydrophobicContact CE-CG 3.94Å; M116-P135 HydrophobicContact CG-CB 3.69Å; M116-P135 HydrophobicContact CG-CG 4.21Å; M116-P135 HydrophobicContact SD-CB 3.94Å; M116-P135 HydrophobicContact SD-CG 3.93Å
136	E	97.8	Very high	96.6	Very high	134 Å²	134	47 Å²	47	63%	0.626	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	140.5	170.2	-63.5	-178.8	179.9	0	0	110.6	M116 T117	M116-E136 WeakPolarHBondContact CA-O 3.02Å; T117-E136 PolarHBondContact N-O 2.93Å; T117-E136 PolarHBondContact O-N 2.94Å; T117-E136 WeakPolarHBondContact OG1-CB 3.14Å; T117-E136 PolarHBondContact OG1-O 2.83Å
137	C	97.9	Very high	96.5	Very high	15 Å²	15	51 Å²	51	10%	0.101	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	104.9	170.8	-68.1	0	0	0	0	109.3	T91 N92 C110	T91-C137 WeakPolarHBondContact O-CB 3.46Å; N92-C137 HydrophobicContact CB-CB 4.33Å; C110-C137 WeakPolarHBondContact CA-SG 3.48Å; C110-C137 HydrophobicContact CB-CB 3.84Å; C110-C137 WeakPolarHBondContact CB-SG 3.48Å; C110-C137 VanDerWaalsContact SG-CA 3.54Å; C110-C137 WeakPolarHBondContact SG-CB 3.29Å; C110-C137 CovalentContact SG-SG 2.04Å; C110-C137 PolarHBondContact SG-SG 3.05Å
138	I	96.4	Very high	96.5	Very high	61 Å²	61	46.7 Å²	46.7	31%	0.313	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	143.6	179.8	63.3	171.1	0	0	0	110.1	Y114 M115 T117	Y114-I138 CarbonylContact C-O 3.55Å; Y114-I138 VanDerWaalsContact CA-O 3.27Å; Y114-I138 WeakPolarHBondContact CA-O 3.27Å; M115-I138 HydrophobicContact CG-CD1 4.13Å; M115-I138 HydrophobicContact CG-CG1 3.59Å; M115-I138 PolarHBondContact N-O 3.2Å; M115-I138 PolarHBondContact O-N 3.36Å; M115-I138 HydrophobicContact SD-CD1 4.34Å; M115-I138 HydrophobicContact SD-CG1 4.41Å; T117-I138 HydrophobicContact CG2-CD1 3.57Å; T117-I138 HydrophobicContact CG2-CG1 3.96Å
139	P	96.5	Very high	96.6	Very high	40 Å²	40	52.1 Å²	52.1	26%	0.26	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	142.7	180	28.8	-35.8	0	0	0	110.4	Y114 N165	Y114-P139 HydrophobicContact CD1-CB 4.11Å; Y114-P139 HydrophobicContact CE1-CB 3.86Å; Y114-P139 HydrophobicContact CE1-CG 4.47Å; P139-N165 HydrophobicContact CB-CB 3.97Å; P139-N165 HydrophobicContact CG-CB 3.92Å
140	I	96.9	Very high	96.5	Very high	31 Å²	31	54.9 Å²	54.9	16%	0.159	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-64.6	127.2	-178.5	-68.2	172.5	0	0	0	109.5	G113 M115 N165 Y166 A190	G113-I140 WeakPolarHBondContact O-CG1 3.45Å; G113-I140 PolarHBondContact O-N 2.98Å; M115-I140 HydrophobicContact CB-CG1 4.07Å; M115-I140 HydrophobicContact CG-CG1 4.3Å; I140-N165 CarbonylContact O-C 3.5Å; I140-Y166 PolarHBondContact O-N 2.74Å; I140-A190 WeakPolarHBondContact CD1-O 3.41Å
141	P	95	Very high	96.5	Very high	63 Å²	63	53.5 Å²	53.5	41%	0.409	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	135.8	179	30.2	-33.1	0	0	0	111.2	T163 V164	P141-T163 HydrophobicContact CB-CG2 3.63Å; P141-V164 CarbonylContact C-O 3.44Å; P141-V164 WeakPolarHBondContact CA-O 3.42Å
142	C	95	Very high	96.4	Very high	4 Å²	4	55 Å²	55	3%	0.027	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	160.5	162.2	-66.2	0	0	0	0	110	T163 V164 C188 G192	C142-T163 WeakPolarHBondContact O-CA 3.29Å; C142-T163 WeakPolarHBondContact O-CG2 3.4Å; C142-V164 HydrophobicContact CB-CG2 3.89Å; C142-V164 PolarHBondContact N-O 3.21Å; C142-V164 PolarHBondContact O-N 3.34Å; C142-V164 VanDerWaalsContact O-O 3.11Å; C142-C188 HydrophobicContact CB-CB 3.86Å; C142-C188 WeakPolarHBondContact CB-SG 3.09Å; C142-C188 WeakPolarHBondContact SG-CB 3.04Å; C142-C188 CovalentContact SG-SG 2.02Å; C142-C188 PolarHBondContact SG-SG 3.42Å; C142-G192 PolarHBondContact SG-O 2.92Å; C142-G192 VanDerWaalsContact SG-O 3.38Å
143	G	94.4	Very high	96.4	Very high	40 Å²	40	54.8 Å²	54.8	41%	0.412	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	-173.6	161.1	0	0	0	0	0	111.9	V164 W194	G143-V164 VanDerWaalsContact O-CG2 3.22Å; G143-V164 WeakPolarHBondContact O-CG2 3.41Å; G143-W194 PolarHBondContact O-NE1 3.37Å
144	L	95.1	Very high	96.3	Very high	79 Å²	79	52.9 Å²	52.9	41%	0.414	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-64.6	148.5	167.8	-60.4	179.2	0	0	0	111	I159 N162 V164 W194	L144-I159 HydrophobicContact CD2-CG2 3.84Å; L144-N162 PolarHBondContact N-O 2.9Å; L144-V164 HydrophobicContact CD2-CG1 4.28Å; L144-W194 VanDerWaalsContact C-NE1 3.35Å
145	A	95.9	Very high	96.2	Very high	5 Å²	5	53.9 Å²	53.9	4%	0.041	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-58.9	136.8	177.1	0	0	0	0	0	110.9	V147 V153 Y155 A186 W194	A145-V147 PolarHBondContact O-N 3.38Å; A145-V153 HydrophobicContact CB-CG1 4.06Å; A145-V153 HydrophobicContact CB-CG2 4.45Å; A145-Y155 WeakPolarHBondContact CB-OH 3.39Å; A145-Y155 PolarHBondContact N-OH 3.4Å; A145-A186 HydrophobicContact CB-CB 4.19Å; A145-W194 VanDerWaalsContact CA-CE2 3.44Å; A145-W194 HydrophobicContact CB-CD2 3.57Å; A145-W194 HydrophobicContact CB-CE3 3.8Å; A145-W194 HydrophobicContact CB-CG 4.07Å; A145-W194 HydrophobicContact CB-CH2 4.06Å; A145-W194 HydrophobicContact CB-CZ2 3.8Å; A145-W194 HydrophobicContact CB-CZ3 4.06Å
146	P	96	Very high	95.7	Very high	64 Å²	64	60 Å²	60	42%	0.416	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-61.8	131.7	176.5	-19.5	30.2	0	0	0	110.7	Y172	P146-Y172 WeakPolarHBondContact O-CE1 3.33Å; P146-Y172 PolarHBondContact O-OH 2.02Å; P146-Y172 VanDerWaalsContact O-OH 3.1Å
147	V	96	Very high	95.2	Very high	98 Å²	98	61 Å²	61	59%	0.594	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-79.8	125.4	179.2	-173.8	0	0	0	0	109.6	A145 G151 V153	A145-V147 PolarHBondContact O-N 3.38Å; V147-G151 WeakPolarHBondContact CG1-O 3.36Å; V147-V153 HydrophobicContact CB-CG2 4.41Å; V147-V153 HydrophobicContact CG2-CG2 4.07Å
148	P	96.8	Very high	94.7	Very high	6 Å²	6	66.5 Å²	66.5	4%	0.039	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-65	145.9	175.4	25.5	-32.8	0	0	0	110.2	Y150 G151 Y172 T197	P148-Y150 PolarHBondContact O-N 2.72Å; P148-G151 PolarHBondContact O-N 3.02Å; P148-Y172 VanDerWaalsContact CD-CD1 3.47Å; P148-Y172 HydrophobicContact CG-CD1 3.81Å; P148-Y172 HydrophobicContact CG-CE1 4.36Å; P148-Y172 HydrophobicContact CG-CG 4.47Å; P148-T197 HydrophobicContact CB-CG2 3.81Å; P148-T197 HydrophobicContact CG-CG2 4.47Å
149	L	96.6	Very high	94.3	Very high	127 Å²	127	66 Å²	66	67%	0.665	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	132.7	172.5	-173.9	67.9	0	0	0	109.5	G151 C200	L149-G151 PolarHBondContact O-N 3.06Å; L149-C200 VanDerWaalsContact O-CB 3.29Å; L149-C200 WeakPolarHBondContact O-CB 3.38Å
150	Y	96.7	Very high	93.8	Very high	119 Å²	119	75.1 Å²	75.1	47%	0.467	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	22.8	-174.3	-45	-61.5	0	0	0	115.4	P148 N175 Y178	P148-Y150 PolarHBondContact O-N 2.72Å; Y150-N175 VanDerWaalsContact O-CB 3.29Å; Y150-N175 WeakPolarHBondContact O-CB 3.39Å; Y150-N175 PolarHBondContact O-N 2.77Å; Y150-N175 PolarHBondContact O-ND2 3.44Å; Y150-Y178 HydrophobicContact CD1-CE1 4.38Å; Y150-Y178 HydrophobicContact CD1-CE2 4.12Å; Y150-Y178 AromaticContact CD1-CZ 3.8Å; Y150-Y178 AromaticContact CD2-CD1 3.93Å; Y150-Y178 HydrophobicContact CD2-CD1 3.93Å; Y150-Y178 AromaticContact CD2-CE1 3.34Å; Y150-Y178 HydrophobicContact CD2-CE1 3.34Å; Y150-Y178 HydrophobicContact CD2-CE2 4.39Å; Y150-Y178 AromaticContact CD2-CZ 3.63Å; Y150-Y178 AromaticContact CE2-CE1 3.91Å; Y150-Y178 HydrophobicContact CE2-CE1 3.91Å; Y150-Y178 HydrophobicContact CG-CD1 4.17Å; Y150-Y178 HydrophobicContact CG-CD2 4.31Å; Y150-Y178 AromaticContact CG-CE1 3.62Å; Y150-Y178 HydrophobicContact CG-CE1 3.62Å; Y150-Y178 AromaticContact CG-CE2 3.81Å; Y150-Y178 HydrophobicContact CG-CE2 3.81Å; Y150-Y178 HydrophobicContact CG-CG 4.5Å; Y150-Y178 AromaticContact CG-CZ 3.44Å; Y150-Y178 VanDerWaalsContact CG-CZ 3.44Å
151	G	96.7	Very high	93.5	Very high	11 Å²	11	76.2 Å²	76.2	11%	0.113	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	-168.4	171.8	0	0	0	0	0	113.2	V147 P148 L149 I173	V147-G151 WeakPolarHBondContact CG1-O 3.36Å; P148-G151 PolarHBondContact O-N 3.02Å; L149-G151 PolarHBondContact O-N 3.06Å; G151-I173 CarbonylContact C-O 3.6Å; G151-I173 WeakPolarHBondContact CA-O 3.15Å
152	M	96.5	Very high	93.2	Very high	81 Å²	81	79.2 Å²	79.2	40%	0.399	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	165.1	178.1	61	176.6	177	0	0	110.1	I154 I173	M152-I154 HydrophobicContact CE-CD1 4.05Å; M152-I173 HydrophobicContact CE-CB 3.96Å; M152-I173 HydrophobicContact CE-CD1 4.25Å; M152-I173 HydrophobicContact CE-CG2 3.78Å; M152-I173 HydrophobicContact CG-CB 4.09Å; M152-I173 PolarHBondContact N-O 3.45Å; M152-I173 PolarHBondContact O-N 3.05Å
153	V	96.5	Very high	93	Very high	25 Å²	25	83.1 Å²	83.1	15%	0.152	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	129.6	175.2	-172.2	0	0	0	0	108.5	A145 V147 Y155 A170 Y172	A145-V153 HydrophobicContact CB-CG1 4.06Å; A145-V153 HydrophobicContact CB-CG2 4.45Å; V147-V153 HydrophobicContact CB-CG2 4.41Å; V147-V153 HydrophobicContact CG2-CG2 4.07Å; V153-Y155 HydrophobicContact CB-CE2 4.25Å; V153-Y155 HydrophobicContact CG1-CD2 4.33Å; V153-Y155 HydrophobicContact CG1-CE1 4.36Å; V153-Y155 HydrophobicContact CG1-CE2 3.78Å; V153-A170 HydrophobicContact CG1-CB 3.55Å; V153-Y172 HydrophobicContact CG2-CD1 3.73Å; V153-Y172 HydrophobicContact CG2-CE1 3.51Å
154	I	95.3	Very high	93	Very high	72 Å²	72	81.6 Å²	81.6	37%	0.369	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	127.7	173.2	-57.3	-164.5	0	0	0	109	M152 A170 T171 I173	M152-I154 HydrophobicContact CE-CD1 4.05Å; I154-A170 CarbonylContact O-C 3.43Å; I154-A170 WeakPolarHBondContact O-CA 3.27Å; I154-T171 PolarHBondContact N-O 3.38Å; I154-T171 PolarHBondContact O-N 2.95Å; I154-I173 HydrophobicContact CD1-CD1 3.4Å; I154-I173 HydrophobicContact CD1-CG1 4.35Å; I154-I173 HydrophobicContact CG1-CD1 4Å; I154-I173 HydrophobicContact CG1-CG1 4.48Å
155	Y	94.1	Very high	93	Very high	51 Å²	51	81.7 Å²	81.7	20%	0.2	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	137.5	172.9	-59.7	-91.6	0	0	0	109.3	A145 V153 K157 I159 L168 A170 W194	A145-Y155 WeakPolarHBondContact CB-OH 3.39Å; A145-Y155 PolarHBondContact N-OH 3.4Å; V153-Y155 HydrophobicContact CB-CE2 4.25Å; V153-Y155 HydrophobicContact CG1-CD2 4.33Å; V153-Y155 HydrophobicContact CG1-CE1 4.36Å; V153-Y155 HydrophobicContact CG1-CE2 3.78Å; Y155-K157 WeakPolarHBondContact CB-O 3.46Å; Y155-K157 PolarHBondContact O-N 3Å; Y155-I159 HydrophobicContact CD1-CD1 4.31Å; Y155-I159 HydrophobicContact CD1-CG1 3.97Å; Y155-I159 HydrophobicContact CD2-CG1 4.24Å; Y155-I159 HydrophobicContact CE1-CG1 4.48Å; Y155-I159 HydrophobicContact CG-CD1 4.46Å; Y155-I159 HydrophobicContact CG-CG1 3.82Å; Y155-L168 HydrophobicContact CD1-CD2 4.09Å; Y155-L168 HydrophobicContact CE1-CD2 4.3Å; Y155-A170 HydrophobicContact CD1-CB 3.54Å; Y155-A170 HydrophobicContact CE1-CB 3.59Å; Y155-A170 HydrophobicContact CG-CB 4.2Å; Y155-W194 AromaticContact CE1-CH2 3.93Å; Y155-W194 HydrophobicContact CE1-CH2 3.93Å; Y155-W194 HydrophobicContact CE1-CZ2 4.16Å
156	D	87.6	Confident	93	Very high	134 Å²	134	84.9 Å²	84.9	72%	0.717	44%	0.44	S	S	*	.	S	Bend	trans	-70.9	-12.4	177.8	-63.4	-24.8	0	0	0	113
157	K	86.9	Confident	92.9	Very high	154 Å²	154	83.4 Å²	83.4	67%	0.67	44%	0.437	S	S	*	.	S	Bend	trans	-127.2	148.3	-179.4	-61.6	-179.4	-177.6	177.1	0	109.6	Y155 I159	Y155-K157 WeakPolarHBondContact CB-O 3.46Å; Y155-K157 PolarHBondContact O-N 3Å; K157-I159 PolarHBondContact O-N 2.84Å; K157-I159 VanDerWaalsContact O-N 3.16Å
158	V	86.8	Confident	92.8	Very high	131 Å²	131	80.6 Å²	80.6	79%	0.794	42%	0.418	S	S	*	.			trans	-67.5	113.6	173.9	-179.4	0	0	0	0	108.9
159	I	89.6	Confident	92.8	Very high	50 Å²	50	85.3 Å²	85.3	26%	0.256	44%	0.438	S	S	.	.			trans	-85.3	126.8	174.5	-51	-53.4	0	0	0	108.6	L144 Y155 K157 V164 L168	L144-I159 HydrophobicContact CD2-CG2 3.84Å; Y155-I159 HydrophobicContact CD1-CD1 4.31Å; Y155-I159 HydrophobicContact CD1-CG1 3.97Å; Y155-I159 HydrophobicContact CD2-CG1 4.24Å; Y155-I159 HydrophobicContact CE1-CG1 4.48Å; Y155-I159 HydrophobicContact CG-CD1 4.46Å; Y155-I159 HydrophobicContact CG-CG1 3.82Å; K157-I159 PolarHBondContact O-N 2.84Å; K157-I159 VanDerWaalsContact O-N 3.16Å; I159-V164 HydrophobicContact CD1-CG1 4.03Å; I159-V164 HydrophobicContact CG1-CG1 4.32Å; I159-V164 HydrophobicContact CG2-CG1 3.75Å; I159-L168 HydrophobicContact CD1-CD2 3.84Å
160	R	86.4	Confident	92.7	Very high	233 Å²	233	79.3 Å²	79.3	88%	0.879	41%	0.407	S	S	*	.			trans	-108	119.4	173.7	-64.3	-175	-177.4	-170.4	1.2	108.4
161	G	89.6	Confident	92.8	Very high	54 Å²	54	76.1 Å²	76.1	56%	0.557	40%	0.4	S	S	*	.	S	Bend	trans	86.7	-162.7	-173.9	0	0	0	0	0	112.9
162	N	88.7	Confident	92.8	Very high	125 Å²	125	75.8 Å²	75.8	67%	0.668	40%	0.395	S	S	*	.	S	Bend	trans	-113.5	6.6	-169.4	-63.7	-4	0	0	0	113.7	L144	L144-N162 PolarHBondContact N-O 2.9Å
163	T	91.4	Very high	92.9	Very high	86 Å²	86	74.8 Å²	74.8	53%	0.528	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	137.1	-174.3	-50.6	0	0	0	0	109.7	P141 C142	P141-T163 HydrophobicContact CB-CG2 3.63Å; C142-T163 WeakPolarHBondContact O-CA 3.29Å; C142-T163 WeakPolarHBondContact O-CG2 3.4Å
164	V	94.3	Very high	92.9	Very high	8 Å²	8	74.3 Å²	74.3	5%	0.048	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	171.3	174	-63.7	0	0	0	0	109.4	P141 C142 G143 L144 I159 L168 W194	P141-V164 CarbonylContact C-O 3.44Å; P141-V164 WeakPolarHBondContact CA-O 3.42Å; C142-V164 HydrophobicContact CB-CG2 3.89Å; C142-V164 PolarHBondContact N-O 3.21Å; C142-V164 PolarHBondContact O-N 3.34Å; C142-V164 VanDerWaalsContact O-O 3.11Å; G143-V164 VanDerWaalsContact O-CG2 3.22Å; G143-V164 WeakPolarHBondContact O-CG2 3.41Å; L144-V164 HydrophobicContact CD2-CG1 4.28Å; I159-V164 HydrophobicContact CD1-CG1 4.03Å; I159-V164 HydrophobicContact CG1-CG1 4.32Å; I159-V164 HydrophobicContact CG2-CG1 3.75Å; V164-L168 HydrophobicContact CB-CB 4.49Å; V164-L168 HydrophobicContact CB-CD2 3.44Å; V164-L168 VanDerWaalsContact CB-CD2 3.44Å; V164-L168 HydrophobicContact CG1-CD2 3.36Å; V164-L168 HydrophobicContact CG2-CD2 3.99Å; V164-W194 HydrophobicContact CG2-CH2 4.26Å; V164-W194 HydrophobicContact CG2-CZ2 3.44Å; V164-W194 VanDerWaalsContact CG2-CZ2 3.44Å
165	N	94.8	Very high	92.9	Very high	81 Å²	81	73.9 Å²	73.9	43%	0.433	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	158.1	-173.4	-65.5	-18.2	0	0	0	111.4	P139 I140 L168 C188	P139-N165 HydrophobicContact CB-CB 3.97Å; P139-N165 HydrophobicContact CG-CB 3.92Å; I140-N165 CarbonylContact O-C 3.5Å; N165-L168 VanDerWaalsContact O-CB 3.27Å; N165-L168 WeakPolarHBondContact O-CB 3.36Å; N165-L168 PolarHBondContact O-N 2.91Å; N165-L168 VanDerWaalsContact O-N 3.1Å; N165-C188 VanDerWaalsContact C-SG 3.56Å
166	Y	96.1	Very high	92.8	Very high	73 Å²	73	77 Å²	77	29%	0.286	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.2	136.7	171.9	170.8	-109.9	0	0	0	113	G113 Y114 I140 L168 C188 A190	G113-Y166 VanDerWaalsContact CA-CD1 3.49Å; G113-Y166 VanDerWaalsContact O-CB 3.29Å; G113-Y166 WeakPolarHBondContact O-CB 3.12Å; G113-Y166 WeakPolarHBondContact O-CD1 3.43Å; Y114-Y166 HydrophobicContact CE2-CD1 4.32Å; I140-Y166 PolarHBondContact O-N 2.74Å; Y166-L168 PolarHBondContact O-N 3.01Å; Y166-C188 VanDerWaalsContact CA-SG 3.51Å; Y166-C188 WeakPolarHBondContact CD2-O 3.32Å; Y166-C188 PolarHBondContact N-SG 3.08Å; Y166-A190 HydrophobicContact CD2-CB 4.45Å; Y166-A190 HydrophobicContact CE2-CB 4.15Å
167	G	93.5	Very high	93	Very high	33 Å²	33	72.6 Å²	72.6	34%	0.34	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	-3.3	179.9	0	0	0	0	0	114.7	K169 C188	G167-K169 PolarHBondContact O-N 2.97Å; G167-C188 PolarHBondContact N-O 3.33Å
168	L	94.8	Very high	93.5	Very high	38 Å²	38	67.7 Å²	67.7	20%	0.199	37%	0.37	C	S	.	.			trans	-64.9	134.1	170.4	-172.2	73.6	0	0	0	110.1	Y155 I159 V164 N165 Y166 C188 W194	Y155-L168 HydrophobicContact CD1-CD2 4.09Å; Y155-L168 HydrophobicContact CE1-CD2 4.3Å; I159-L168 HydrophobicContact CD1-CD2 3.84Å; V164-L168 HydrophobicContact CB-CB 4.49Å; V164-L168 HydrophobicContact CB-CD2 3.44Å; V164-L168 VanDerWaalsContact CB-CD2 3.44Å; V164-L168 HydrophobicContact CG1-CD2 3.36Å; V164-L168 HydrophobicContact CG2-CD2 3.99Å; N165-L168 VanDerWaalsContact O-CB 3.27Å; N165-L168 WeakPolarHBondContact O-CB 3.36Å; N165-L168 PolarHBondContact O-N 2.91Å; N165-L168 VanDerWaalsContact O-N 3.1Å; Y166-L168 PolarHBondContact O-N 3.01Å; L168-C188 PolarHBondContact O-N 3.48Å; L168-W194 HydrophobicContact CB-CH2 4.49Å; L168-W194 HydrophobicContact CD2-CH2 4.21Å; L168-W194 HydrophobicContact CG-CH2 4.43Å; L168-W194 WeakPolarHBondContact O-CZ3 3Å
169	K	95.6	Very high	93.9	Very high	105 Å²	105	61.4 Å²	61.4	46%	0.457	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	147.9	176.4	-61.2	-174.1	-179.1	-162.1	0	111.5	G167 V185 A186 E187	G167-K169 PolarHBondContact O-N 2.97Å; K169-V185 HydrophobicContact CB-CG1 4.36Å; K169-V185 HydrophobicContact CD-CG1 4.37Å; K169-A186 CarbonylContact C-O 3.5Å; K169-A186 VanDerWaalsContact CA-O 3.26Å; K169-A186 WeakPolarHBondContact CA-O 3.37Å; K169-E187 WeakPolarHBondContact CE-OE1 3.41Å; K169-E187 WeakPolarHBondContact CE-OE2 3.43Å; K169-E187 HydrophobicContact CG-CB 4.44Å; K169-E187 HydrophobicContact CG-CG 4.31Å; K169-E187 IonicContact NZ-OE1 3.4Å; K169-E187 IonicContact NZ-OE2 2.78Å; K169-E187 PolarHBondContact NZ-OE2 3.45Å
170	A	96	Very high	94.3	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.008	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	158.7	173	0	0	0	0	0	109.9	V153 I154 Y155 V185 A186 W194	V153-A170 HydrophobicContact CG1-CB 3.55Å; I154-A170 CarbonylContact O-C 3.43Å; I154-A170 WeakPolarHBondContact O-CA 3.27Å; Y155-A170 HydrophobicContact CD1-CB 3.54Å; Y155-A170 HydrophobicContact CE1-CB 3.59Å; Y155-A170 HydrophobicContact CG-CB 4.2Å; A170-V185 WeakPolarHBondContact O-CA 3.46Å; A170-A186 HydrophobicContact CB-CB 4.21Å; A170-A186 PolarHBondContact N-O 2.8Å; A170-A186 PolarHBondContact O-N 3.49Å; A170-W194 HydrophobicContact CB-CH2 4.35Å; A170-W194 HydrophobicContact CB-CZ3 4.28Å
171	T	97.8	Very high	94.7	Very high	53 Å²	53	53.6 Å²	53.6	33%	0.325	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.7	-179.3	-57.1	0	0	0	0	110.5	I154 I173 P184	I154-T171 PolarHBondContact N-O 3.38Å; I154-T171 PolarHBondContact O-N 2.95Å; T171-I173 HydrophobicContact CG2-CG1 4.28Å; T171-P184 CarbonylContact C-O 3.38Å; T171-P184 WeakPolarHBondContact CA-O 3.26Å
172	Y	97.8	Very high	95.1	Very high	4 Å²	4	54 Å²	54	2%	0.016	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	132.9	170.2	-69.1	-57.2	0	0	0	110.8	P146 P148 V153 L180 P184 A186 T197 P198	P146-Y172 WeakPolarHBondContact O-CE1 3.33Å; P146-Y172 PolarHBondContact O-OH 2.02Å; P146-Y172 VanDerWaalsContact O-OH 3.1Å; P148-Y172 VanDerWaalsContact CD-CD1 3.47Å; P148-Y172 HydrophobicContact CG-CD1 3.81Å; P148-Y172 HydrophobicContact CG-CE1 4.36Å; P148-Y172 HydrophobicContact CG-CG 4.47Å; V153-Y172 HydrophobicContact CG2-CD1 3.73Å; V153-Y172 HydrophobicContact CG2-CE1 3.51Å; Y172-L180 WeakPolarHBondContact O-CD1 3.16Å; Y172-P184 PolarHBondContact N-O 3.37Å; Y172-A186 HydrophobicContact CD2-CB 4.08Å; Y172-A186 HydrophobicContact CE1-CB 4.33Å; Y172-A186 HydrophobicContact CE2-CB 3.39Å; Y172-T197 HydrophobicContact CE1-CG2 4.27Å; Y172-T197 PolarHBondContact OH-OG1 3.39Å; Y172-P198 HydrophobicContact CD1-CG 4.49Å; Y172-P198 HydrophobicContact CD2-CG 3.49Å; Y172-P198 VanDerWaalsContact CD2-CG 3.49Å; Y172-P198 HydrophobicContact CE2-CG 4.16Å; Y172-P198 HydrophobicContact CG-CG 3.66Å
173	I	96.6	Very high	95.4	Very high	59 Å²	59	52.3 Å²	52.3	30%	0.303	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	125.9	174.8	-58.2	-170.4	0	0	0	108.4	G151 M152 I154 T171	G151-I173 CarbonylContact C-O 3.6Å; G151-I173 WeakPolarHBondContact CA-O 3.15Å; M152-I173 HydrophobicContact CE-CB 3.96Å; M152-I173 HydrophobicContact CE-CD1 4.25Å; M152-I173 HydrophobicContact CE-CG2 3.78Å; M152-I173 HydrophobicContact CG-CB 4.09Å; M152-I173 PolarHBondContact N-O 3.45Å; M152-I173 PolarHBondContact O-N 3.05Å; I154-I173 HydrophobicContact CD1-CD1 3.4Å; I154-I173 HydrophobicContact CD1-CG1 4.35Å; I154-I173 HydrophobicContact CG1-CD1 4Å; I154-I173 HydrophobicContact CG1-CG1 4.48Å; T171-I173 HydrophobicContact CG2-CG1 4.28Å
174	C	97	Very high	95.7	Very high	15 Å²	15	51 Å²	51	10%	0.101	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	137.8	171.6	-63.8	0	0	0	0	110.2	Y178 L180 C200	C174-Y178 VanDerWaalsContact CB-O 3.31Å; C174-Y178 WeakPolarHBondContact CB-O 3.05Å; C174-L180 VanDerWaalsContact SG-CA 3.52Å; C174-L180 VanDerWaalsContact SG-CB 3.57Å; C174-C200 WeakPolarHBondContact CA-SG 3.49Å; C174-C200 HydrophobicContact CB-CB 3.75Å; C174-C200 WeakPolarHBondContact CB-SG 3.4Å; C174-C200 WeakPolarHBondContact SG-CA 3.18Å; C174-C200 WeakPolarHBondContact SG-CB 3.33Å; C174-C200 CovalentContact SG-SG 2.04Å; C174-C200 PolarHBondContact SG-SG 3.1Å
175	N	95.4	Very high	95.8	Very high	64 Å²	64	53 Å²	53	34%	0.342	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-68.9	146.5	173.5	-63.3	-40.6	0	0	0	108.7	Y150 Y178	Y150-N175 VanDerWaalsContact O-CB 3.29Å; Y150-N175 WeakPolarHBondContact O-CB 3.39Å; Y150-N175 PolarHBondContact O-N 2.77Å; Y150-N175 PolarHBondContact O-ND2 3.44Å; N175-Y178 WeakPolarHBondContact O-CB 3.37Å; N175-Y178 VanDerWaalsContact O-CD2 3.25Å; N175-Y178 WeakPolarHBondContact O-CD2 3.1Å; N175-Y178 PolarHBondContact O-N 3.18Å
176	P	92.2	Very high	95.9	Very high	117 Å²	117	49.2 Å²	49.2	76%	0.76	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	141	168.6	-23.7	34.3	0	0	0	110.7
177	P	92.9	Very high	95.9	Very high	40 Å²	40	48.8 Å²	48.8	26%	0.26	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	cis	-91.9	19.4	3.8	36.3	-36.7	0	0	0	115.5	F225	P177-F225 HydrophobicContact CB-CB 3.56Å; P177-F225 HydrophobicContact CB-CD1 3.76Å; P177-F225 HydrophobicContact CB-CD2 4.42Å; P177-F225 HydrophobicContact CB-CG 3.65Å; P177-F225 HydrophobicContact CG-CD1 4.12Å; P177-F225 HydrophobicContact CG-CG 4.34Å
178	Y	95.8	Very high	96	Very high	51 Å²	51	47.2 Å²	47.2	20%	0.2	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	138	-169.7	-57.3	-98.6	0	0	0	112.3	Y150 C174 N175 C200 Q201 V202	Y150-Y178 HydrophobicContact CD1-CE1 4.38Å; Y150-Y178 HydrophobicContact CD1-CE2 4.12Å; Y150-Y178 AromaticContact CD1-CZ 3.8Å; Y150-Y178 AromaticContact CD2-CD1 3.93Å; Y150-Y178 HydrophobicContact CD2-CD1 3.93Å; Y150-Y178 AromaticContact CD2-CE1 3.34Å; Y150-Y178 HydrophobicContact CD2-CE1 3.34Å; Y150-Y178 HydrophobicContact CD2-CE2 4.39Å; Y150-Y178 AromaticContact CD2-CZ 3.63Å; Y150-Y178 AromaticContact CE2-CE1 3.91Å; Y150-Y178 HydrophobicContact CE2-CE1 3.91Å; Y150-Y178 HydrophobicContact CG-CD1 4.17Å; Y150-Y178 HydrophobicContact CG-CD2 4.31Å; Y150-Y178 AromaticContact CG-CE1 3.62Å; Y150-Y178 HydrophobicContact CG-CE1 3.62Å; Y150-Y178 AromaticContact CG-CE2 3.81Å; Y150-Y178 HydrophobicContact CG-CE2 3.81Å; Y150-Y178 HydrophobicContact CG-CG 4.5Å; Y150-Y178 AromaticContact CG-CZ 3.44Å; Y150-Y178 VanDerWaalsContact CG-CZ 3.44Å; C174-Y178 VanDerWaalsContact CB-O 3.31Å; C174-Y178 WeakPolarHBondContact CB-O 3.05Å; N175-Y178 WeakPolarHBondContact O-CB 3.37Å; N175-Y178 VanDerWaalsContact O-CD2 3.25Å; N175-Y178 WeakPolarHBondContact O-CD2 3.1Å; N175-Y178 PolarHBondContact O-N 3.18Å; Y178-C200 HydrophobicContact CD1-CB 4.48Å; Y178-C200 HydrophobicContact CG-CB 4.37Å; Y178-Q201 CarbonylContact C-O 3.52Å; Y178-Q201 WeakPolarHBondContact CA-O 3.32Å; Y178-V202 HydrophobicContact CD1-CG2 3.66Å; Y178-V202 HydrophobicContact CE1-CG2 3.36Å
179	A	96.4	Very high	96.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	147.6	170.6	0	0	0	0	0	110.6	F181 C200 Q201 V203 Y226 E250	A179-F181 HydrophobicContact CB-CE2 3.94Å; A179-C200 WeakPolarHBondContact O-CA 3.28Å; A179-Q201 PolarHBondContact N-O 2.05Å; A179-Q201 PolarHBondContact O-N 3.44Å; A179-V203 HydrophobicContact CB-CB 4.22Å; A179-V203 HydrophobicContact CB-CG2 3.72Å; A179-Y226 HydrophobicContact CB-CD1 3.72Å; A179-Y226 HydrophobicContact CB-CD2 4.14Å; A179-Y226 HydrophobicContact CB-CE1 3.97Å; A179-Y226 HydrophobicContact CB-CE2 4.37Å; A179-Y226 HydrophobicContact CB-CG 3.84Å; A179-E250 HydrophobicContact CB-CB 4.45Å
180	L	96.8	Very high	96.1	Very high	38 Å²	38	43.8 Å²	43.8	20%	0.199	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	124.7	-177.7	-172.4	149.4	0	0	0	110.8	Y172 C174 P184 P198	Y172-L180 WeakPolarHBondContact O-CD1 3.16Å; C174-L180 VanDerWaalsContact SG-CA 3.52Å; C174-L180 VanDerWaalsContact SG-CB 3.57Å; L180-P184 HydrophobicContact CD1-CB 4.05Å; L180-P184 HydrophobicContact CD2-CB 4.1Å; L180-P198 HydrophobicContact CD1-CB 4.48Å; L180-P198 HydrophobicContact CD1-CG 4.12Å; L180-P198 HydrophobicContact CD2-CB 4Å; L180-P198 HydrophobicContact CD2-CG 4.45Å; L180-P198 HydrophobicContact CG-CB 4.05Å; L180-P198 HydrophobicContact CG-CG 4.22Å
181	F	96.4	Very high	96.1	Very high	81 Å²	81	47.8 Å²	47.8	36%	0.355	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	115	174.2	-70.8	-94.2	0	0	0	110.2	A179 P198 E199 Q201 V203	A179-F181 HydrophobicContact CB-CE2 3.94Å; F181-P198 WeakPolarHBondContact O-CA 3.48Å; F181-P198 WeakPolarHBondContact O-CB 3.4Å; F181-E199 PolarHBondContact N-O 3.5Å; F181-E199 PolarHBondContact O-N 3.24Å; F181-Q201 HydrophobicContact CD2-CB 3.82Å; F181-Q201 HydrophobicContact CD2-CG 3.87Å; F181-Q201 HydrophobicContact CE2-CB 3.83Å; F181-Q201 HydrophobicContact CE2-CG 4.34Å; F181-V203 HydrophobicContact CE2-CG2 3.84Å; F181-V203 HydrophobicContact CZ-CG2 3.92Å
182	G	96	Very high	96	Very high	63 Å²	63	46.3 Å²	46.3	65%	0.649	28%	0.284	S	S	*	.	S	Bend	trans	125.8	-154.8	-176.9	0	0	0	0	0	112.1
183	N	96.4	Very high	95.9	Very high	89 Å²	89	50.1 Å²	50.1	48%	0.476	31%	0.308	S	S	.	.			trans	-87.1	122.7	177.6	-170.5	-11.5	0	0	0	109.9	V185	N183-V185 PolarHBondContact O-N 3.19Å; N183-V185 PolarHBondContact OD1-N 2.85Å
184	P	96.8	Very high	95.9	Very high	59 Å²	59	48.6 Å²	48.6	38%	0.383	30%	0.299	S	S	.	.	S	Bend	trans	-71.7	-8.5	175.7	30.5	-36.1	0	0	0	113.1	T171 Y172 L180	T171-P184 CarbonylContact C-O 3.38Å; T171-P184 WeakPolarHBondContact CA-O 3.26Å; Y172-P184 PolarHBondContact N-O 3.37Å; L180-P184 HydrophobicContact CD1-CB 4.05Å; L180-P184 HydrophobicContact CD2-CB 4.1Å
185	V	97.2	Very high	95.9	Very high	50 Å²	50	50 Å²	50	30%	0.303	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	121.9	-179.1	-175.2	0	0	0	0	110.7	K169 A170 N183 T195	K169-V185 HydrophobicContact CB-CG1 4.36Å; K169-V185 HydrophobicContact CD-CG1 4.37Å; A170-V185 WeakPolarHBondContact O-CA 3.46Å; N183-V185 PolarHBondContact O-N 3.19Å; N183-V185 PolarHBondContact OD1-N 2.85Å; V185-T195 PolarHBondContact O-OG1 3.1Å
186	A	96.3	Very high	95.9	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	135.3	167.3	0	0	0	0	0	109.3	A145 K169 A170 Y172 W194 T195	A145-A186 HydrophobicContact CB-CB 4.19Å; K169-A186 CarbonylContact C-O 3.5Å; K169-A186 VanDerWaalsContact CA-O 3.26Å; K169-A186 WeakPolarHBondContact CA-O 3.37Å; A170-A186 HydrophobicContact CB-CB 4.21Å; A170-A186 PolarHBondContact N-O 2.8Å; A170-A186 PolarHBondContact O-N 3.49Å; Y172-A186 HydrophobicContact CD2-CB 4.08Å; Y172-A186 HydrophobicContact CE1-CB 4.33Å; Y172-A186 HydrophobicContact CE2-CB 3.39Å; A186-W194 HydrophobicContact CB-CE3 3.54Å; A186-W194 HydrophobicContact CB-CZ3 3.77Å; A186-T195 WeakPolarHBondContact CA-OG1 3.48Å
187	E	96.2	Very high	96.2	Very high	64 Å²	64	51.9 Å²	51.9	30%	0.299	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	133.1	174.6	-178.5	162	-163	0	0	111.2	K169 T189 W194 T195	K169-E187 WeakPolarHBondContact CE-OE1 3.41Å; K169-E187 WeakPolarHBondContact CE-OE2 3.43Å; K169-E187 HydrophobicContact CG-CB 4.44Å; K169-E187 HydrophobicContact CG-CG 4.31Å; K169-E187 IonicContact NZ-OE1 3.4Å; K169-E187 IonicContact NZ-OE2 2.78Å; K169-E187 PolarHBondContact NZ-OE2 3.45Å; E187-T189 PolarHBondContact O-N 2.02Å; E187-W194 CarbonylContact O-C 3.51Å; E187-W194 WeakPolarHBondContact O-CA 3.22Å; E187-T195 HydrophobicContact CB-CG2 3.97Å; E187-T195 PolarHBondContact N-OG1 3.5Å; E187-T195 PolarHBondContact O-N 3.23Å
188	C	96.6	Very high	96.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-76.3	116	173.3	168.4	0	0	0	0	109.6	C142 N165 Y166 G167 L168 W194	C142-C188 HydrophobicContact CB-CB 3.86Å; C142-C188 WeakPolarHBondContact CB-SG 3.09Å; C142-C188 WeakPolarHBondContact SG-CB 3.04Å; C142-C188 CovalentContact SG-SG 2.02Å; C142-C188 PolarHBondContact SG-SG 3.42Å; N165-C188 VanDerWaalsContact C-SG 3.56Å; Y166-C188 VanDerWaalsContact CA-SG 3.51Å; Y166-C188 WeakPolarHBondContact CD2-O 3.32Å; Y166-C188 PolarHBondContact N-SG 3.08Å; G167-C188 PolarHBondContact N-O 3.33Å; L168-C188 PolarHBondContact O-N 3.48Å; C188-W194 HydrophobicContact CB-CD2 4.4Å; C188-W194 HydrophobicContact CB-CE3 4.44Å; C188-W194 HydrophobicContact CB-CH2 4.38Å; C188-W194 HydrophobicContact CB-CZ2 4.36Å; C188-W194 HydrophobicContact CB-CZ3 4.41Å
189	T	96.6	Very high	96.5	Very high	39 Å²	39	53.3 Å²	53.3	24%	0.239	31%	0.309	C	S	.	.			trans	-91.3	168.6	-172	70.9	0	0	0	0	112.6	E187 S191 G192 T193 T195	E187-T189 PolarHBondContact O-N 2.02Å; T189-S191 PolarHBondContact O-N 3.1Å; T189-S191 PolarHBondContact OG1-N 2.73Å; T189-S191 PolarHBondContact OG1-OG 2.77Å; T189-G192 PolarHBondContact O-N 3.22Å; T189-T193 WeakPolarHBondContact CB-O 3.11Å; T189-T193 WeakPolarHBondContact CG2-O 3.06Å; T189-T193 PolarHBondContact N-O 2.89Å; T189-T193 PolarHBondContact OG1-O 3.28Å; T189-T195 HydrophobicContact CG2-CG2 4.04Å
190	A	96.1	Very high	96.5	Very high	33 Å²	33	54 Å²	54	27%	0.273	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-10.4	175.3	0	0	0	0	0	113.8	E112 I140 Y166 G192	E112-A190 HydrophobicContact CG-CB 3.99Å; I140-A190 WeakPolarHBondContact CD1-O 3.41Å; Y166-A190 HydrophobicContact CD2-CB 4.45Å; Y166-A190 HydrophobicContact CE2-CB 4.15Å; A190-G192 VanDerWaalsContact C-N 3.31Å
191	S	95.3	Very high	96.5	Very high	85 Å²	85	56 Å²	56	59%	0.594	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-2.2	173.8	68.5	0	0	0	0	113.8	T189 T193	T189-S191 PolarHBondContact O-N 3.1Å; T189-S191 PolarHBondContact OG1-N 2.73Å; T189-S191 PolarHBondContact OG1-OG 2.77Å; S191-T193 PolarHBondContact O-N 2.8Å; S191-T193 PolarHBondContact OG-OG1 2.81Å
192	G	94.8	Very high	96.5	Very high	21 Å²	21	55.9 Å²	55.9	22%	0.216	33%	0.328	C	S	.	.	S	Bend	trans	76	8.2	-174	0	0	0	0	0	113.7	C142 T189 A190	C142-G192 PolarHBondContact SG-O 2.92Å; C142-G192 VanDerWaalsContact SG-O 3.38Å; T189-G192 PolarHBondContact O-N 3.22Å; A190-G192 VanDerWaalsContact C-N 3.31Å
193	T	96	Very high	96.5	Very high	85 Å²	85	53.7 Å²	53.7	52%	0.521	30%	0.302	S	S	.	.	S	Bend	trans	-114.4	157.3	173.2	69.7	0	0	0	0	111.8	T189 S191	T189-T193 WeakPolarHBondContact CB-O 3.11Å; T189-T193 WeakPolarHBondContact CG2-O 3.06Å; T189-T193 PolarHBondContact N-O 2.89Å; T189-T193 PolarHBondContact OG1-O 3.28Å; S191-T193 PolarHBondContact O-N 2.8Å; S191-T193 PolarHBondContact OG-OG1 2.81Å
194	W	96.7	Very high	96.5	Very high	27 Å²	27	51.8 Å²	51.8	10%	0.102	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-76.8	156	173	-70	86.2	0	0	0	111.9	G143 L144 A145 Y155 V164 L168 A170 A186 E187 C188	G143-W194 PolarHBondContact O-NE1 3.37Å; L144-W194 VanDerWaalsContact C-NE1 3.35Å; A145-W194 VanDerWaalsContact CA-CE2 3.44Å; A145-W194 HydrophobicContact CB-CD2 3.57Å; A145-W194 HydrophobicContact CB-CE3 3.8Å; A145-W194 HydrophobicContact CB-CG 4.07Å; A145-W194 HydrophobicContact CB-CH2 4.06Å; A145-W194 HydrophobicContact CB-CZ2 3.8Å; A145-W194 HydrophobicContact CB-CZ3 4.06Å; Y155-W194 AromaticContact CE1-CH2 3.93Å; Y155-W194 HydrophobicContact CE1-CH2 3.93Å; Y155-W194 HydrophobicContact CE1-CZ2 4.16Å; V164-W194 HydrophobicContact CG2-CH2 4.26Å; V164-W194 HydrophobicContact CG2-CZ2 3.44Å; V164-W194 VanDerWaalsContact CG2-CZ2 3.44Å; L168-W194 HydrophobicContact CB-CH2 4.49Å; L168-W194 HydrophobicContact CD2-CH2 4.21Å; L168-W194 HydrophobicContact CG-CH2 4.43Å; L168-W194 WeakPolarHBondContact O-CZ3 3Å; A170-W194 HydrophobicContact CB-CH2 4.35Å; A170-W194 HydrophobicContact CB-CZ3 4.28Å; A186-W194 HydrophobicContact CB-CE3 3.54Å; A186-W194 HydrophobicContact CB-CZ3 3.77Å; E187-W194 CarbonylContact O-C 3.51Å; E187-W194 WeakPolarHBondContact O-CA 3.22Å; C188-W194 HydrophobicContact CB-CD2 4.4Å; C188-W194 HydrophobicContact CB-CE3 4.44Å; C188-W194 HydrophobicContact CB-CH2 4.38Å; C188-W194 HydrophobicContact CB-CZ2 4.36Å; C188-W194 HydrophobicContact CB-CZ3 4.41Å
195	T	96.9	Very high	96.5	Very high	43 Å²	43	49.1 Å²	49.1	26%	0.264	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-55.4	159.7	166.4	52.2	0	0	0	0	111.8	V185 A186 E187 T189 T197	V185-T195 PolarHBondContact O-OG1 3.1Å; A186-T195 WeakPolarHBondContact CA-OG1 3.48Å; E187-T195 HydrophobicContact CB-CG2 3.97Å; E187-T195 PolarHBondContact N-OG1 3.5Å; E187-T195 PolarHBondContact O-N 3.23Å; T189-T195 HydrophobicContact CG2-CG2 4.04Å; T195-T197 PolarHBondContact O-N 2.98Å
196	K	96.6	Very high	96.4	Very high	179 Å²	179	50.3 Å²	50.3	78%	0.778	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-54.6	124.9	-178.4	-175.1	-179.3	177.3	-174.6	0	111.1
197	T	97.1	Very high	96.3	Very high	43 Å²	43	53 Å²	53	26%	0.264	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-65.4	135.3	175.7	-50.5	0	0	0	0	110.8	P148 Y172 T195	P148-T197 HydrophobicContact CB-CG2 3.81Å; P148-T197 HydrophobicContact CG-CG2 4.47Å; Y172-T197 HydrophobicContact CE1-CG2 4.27Å; Y172-T197 PolarHBondContact OH-OG1 3.39Å; T195-T197 PolarHBondContact O-N 2.98Å
198	P	97.6	Very high	96.1	Very high	10 Å²	10	50.6 Å²	50.6	7%	0.065	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-75.8	168.4	176.8	33.1	-36.7	0	0	0	111.7	Y172 L180 F181	Y172-P198 HydrophobicContact CD1-CG 4.49Å; Y172-P198 HydrophobicContact CD2-CG 3.49Å; Y172-P198 VanDerWaalsContact CD2-CG 3.49Å; Y172-P198 HydrophobicContact CE2-CG 4.16Å; Y172-P198 HydrophobicContact CG-CG 3.66Å; L180-P198 HydrophobicContact CD1-CB 4.48Å; L180-P198 HydrophobicContact CD1-CG 4.12Å; L180-P198 HydrophobicContact CD2-CB 4Å; L180-P198 HydrophobicContact CD2-CG 4.45Å; L180-P198 HydrophobicContact CG-CB 4.05Å; L180-P198 HydrophobicContact CG-CG 4.22Å; F181-P198 WeakPolarHBondContact O-CA 3.48Å; F181-P198 WeakPolarHBondContact O-CB 3.4Å
199	E	97.4	Very high	95.9	Very high	110 Å²	110	56.5 Å²	56.5	51%	0.514	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	134.6	176	-66.8	176.1	-158.7	0	0	110.5	F181 Q201	F181-E199 PolarHBondContact N-O 3.5Å; F181-E199 PolarHBondContact O-N 3.24Å; E199-Q201 HydrophobicContact CB-CG 4.24Å; E199-Q201 PolarHBondContact OE2-NE2 2.88Å
200	C	97.7	Very high	95.7	Very high	15 Å²	15	59.3 Å²	59.3	10%	0.101	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	111.9	170.5	-64.8	0	0	0	0	108.8	L149 C174 Y178 A179	L149-C200 VanDerWaalsContact O-CB 3.29Å; L149-C200 WeakPolarHBondContact O-CB 3.38Å; C174-C200 WeakPolarHBondContact CA-SG 3.49Å; C174-C200 HydrophobicContact CB-CB 3.75Å; C174-C200 WeakPolarHBondContact CB-SG 3.4Å; C174-C200 WeakPolarHBondContact SG-CA 3.18Å; C174-C200 WeakPolarHBondContact SG-CB 3.33Å; C174-C200 CovalentContact SG-SG 2.04Å; C174-C200 PolarHBondContact SG-SG 3.1Å; Y178-C200 HydrophobicContact CD1-CB 4.48Å; Y178-C200 HydrophobicContact CG-CB 4.37Å; A179-C200 WeakPolarHBondContact O-CA 3.28Å
201	Q	96.5	Very high	95.7	Very high	81 Å²	81	58.5 Å²	58.5	38%	0.379	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	145.8	-175.3	-56.6	-176.8	10.4	0	0	110.7	Y178 A179 F181 E199 V203	Y178-Q201 CarbonylContact C-O 3.52Å; Y178-Q201 WeakPolarHBondContact CA-O 3.32Å; A179-Q201 PolarHBondContact N-O 2.05Å; A179-Q201 PolarHBondContact O-N 3.44Å; F181-Q201 HydrophobicContact CD2-CB 3.82Å; F181-Q201 HydrophobicContact CD2-CG 3.87Å; F181-Q201 HydrophobicContact CE2-CB 3.83Å; F181-Q201 HydrophobicContact CE2-CG 4.34Å; E199-Q201 HydrophobicContact CB-CG 4.24Å; E199-Q201 PolarHBondContact OE2-NE2 2.88Å; Q201-V203 PolarHBondContact O-N 2.78Å
202	V	95.9	Very high	95.7	Very high	78 Å²	78	62.2 Å²	62.2	47%	0.473	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	128.1	174.1	-179.3	0	0	0	0	108.5	Y178 T204 F225	Y178-V202 HydrophobicContact CD1-CG2 3.66Å; Y178-V202 HydrophobicContact CE1-CG2 3.36Å; V202-T204 HydrophobicContact CG1-CG2 4.31Å; V202-F225 HydrophobicContact CG1-CD1 4.09Å; V202-F225 HydrophobicContact CG1-CE1 4.04Å
203	V	96	Very high	95.7	Very high	16 Å²	16	67.2 Å²	67.2	10%	0.097	35%	0.352	C	S	.	.			trans	-120.8	131.4	173.2	170.6	0	0	0	0	108.6	A179 F181 Q201 Y226 Q249	A179-V203 HydrophobicContact CB-CB 4.22Å; A179-V203 HydrophobicContact CB-CG2 3.72Å; F181-V203 HydrophobicContact CE2-CG2 3.84Å; F181-V203 HydrophobicContact CZ-CG2 3.92Å; Q201-V203 PolarHBondContact O-N 2.78Å; V203-Y226 PolarHBondContact O-N 2.98Å; V203-Q249 WeakPolarHBondContact CG1-O 3.46Å
204	T	96.5	Very high	95.7	Very high	50 Å²	50	63.9 Å²	63.9	31%	0.307	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	147.8	176.1	57.1	0	0	0	0	111.5	V202 E223 F224 F225 G252	V202-T204 HydrophobicContact CG1-CG2 4.31Å; T204-E223 HydrophobicContact CG2-CB 4.36Å; T204-E223 PolarHBondContact OG1-OE2 3.09Å; T204-F224 CarbonylContact C-O 3.56Å; T204-F224 WeakPolarHBondContact CA-O 3.39Å; T204-F225 HydrophobicContact CG2-CD1 3.73Å; T204-F225 HydrophobicContact CG2-CE1 3.74Å; T204-G252 WeakPolarHBondContact O-CA 3.17Å
205	C	95.7	Very high	95.6	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.014	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	148.1	171.1	-66.4	0	0	0	0	109.7	F224 C248 W254	C205-F224 PolarHBondContact N-O 3.37Å; C205-F224 PolarHBondContact O-N 2.85Å; C205-C248 HydrophobicContact CB-CB 3.8Å; C205-C248 WeakPolarHBondContact CB-SG 3.13Å; C205-C248 WeakPolarHBondContact SG-CA 3.44Å; C205-C248 WeakPolarHBondContact SG-CB 3.41Å; C205-C248 CovalentContact SG-SG 2.03Å; C205-C248 PolarHBondContact SG-SG 3.42Å; C205-W254 HydrophobicContact CB-CD2 4.36Å; C205-W254 HydrophobicContact CB-CZ2 4.14Å
206	P	95	Very high	95.4	Very high	76 Å²	76	69 Å²	69	49%	0.494	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-63.2	164.9	173.9	29	-35.8	0	0	0	110.9	W254	P206-W254 PolarHBondContact O-NE1 2.82Å
207	P	94.4	Very high	95.2	Very high	57 Å²	57	64.4 Å²	64.4	37%	0.37	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-49.8	135.5	168.6	-24.7	31.9	0	0	0	111.4	R222	P207-R222 WeakPolarHBondContact CG-O 3.22Å
208	P	93.1	Very high	94.6	Very high	12 Å²	12	64.2 Å²	64.2	8%	0.078	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-63.8	144.2	-178.2	-2.8	9.2	0	0	0	111.7	M216 F224 V230 Y232 W254	P208-M216 HydrophobicContact CB-CE 3.68Å; P208-M216 HydrophobicContact CG-CE 3.53Å; P208-F224 VanDerWaalsContact CD-CE2 3.44Å; P208-F224 HydrophobicContact CG-CE2 4.27Å; P208-F224 HydrophobicContact CG-CZ 4.46Å; P208-V230 HydrophobicContact CG-CB 4.08Å; P208-V230 HydrophobicContact CG-CG1 4.1Å; P208-V230 HydrophobicContact CG-CG2 3.7Å; P208-Y232 VanDerWaalsContact CB-OH 3.25Å; P208-Y232 WeakPolarHBondContact CB-OH 3.44Å; P208-W254 HydrophobicContact CB-CZ2 4.35Å; P208-W254 HydrophobicContact CG-CH2 4.3Å; P208-W254 HydrophobicContact CG-CZ2 3.7Å
209	E	92.8	Very high	93.6	Very high	125 Å²	125	69.5 Å²	69.5	58%	0.584	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-73.8	139.3	176.3	-66.9	178	-172.7	0	0	111.4	Y232 K257	E209-Y232 PolarHBondContact O-OH 2.91Å; E209-K257 IonicContact OE2-NZ 3.56Å; E209-K257 PolarHBondContact OE2-NZ 3.46Å
210	S	92.4	Very high	93	Very high	97 Å²	97	68.8 Å²	68.8	68%	0.678	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-68.3	146.1	170.6	59.3	0	0	0	0	111.3
211	I	94.9	Very high	92.4	Very high	16 Å²	16	77.3 Å²	77.3	8%	0.082	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-99.4	145.5	172.5	66.5	178	0	0	0	110	G214 Y232 L240 P258 C260	I211-G214 PolarHBondContact O-N 2.95Å; I211-Y232 HydrophobicContact CD1-CD1 3.66Å; I211-Y232 HydrophobicContact CD1-CG 4.05Å; I211-Y232 HydrophobicContact CG1-CD1 3.81Å; I211-Y232 HydrophobicContact CG1-CE1 4.33Å; I211-Y232 HydrophobicContact CG2-CD1 4.02Å; I211-Y232 HydrophobicContact CG2-CE1 3.89Å; I211-L240 HydrophobicContact CD1-CD1 3.88Å; I211-P258 HydrophobicContact CD1-CG 4.36Å; I211-P258 WeakPolarHBondContact CG2-O 3.49Å; I211-C260 VanDerWaalsContact CD1-SG 3.59Å
212	E	95.3	Very high	92.1	Very high	164 Å²	164	77.5 Å²	77.5	77%	0.766	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	136.5	178.3	-177.1	173.8	-175.2	0	0	110.6	G214 C260	E212-G214 PolarHBondContact O-N 2.84Å; E212-G214 VanDerWaalsContact O-N 3.12Å; E212-C260 WeakPolarHBondContact O-CB 3.41Å
213	R	95.9	Very high	91.9	Very high	125 Å²	125	79.5 Å²	79.5	47%	0.472	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	25.3	-176.9	-60	-70.5	-175.9	-175.1	-0.6	114.1	E235 Y238 C260	R213-E235 IonicContact NH1-OE2 3.52Å; R213-E235 PolarHBondContact O-N 2.88Å; R213-Y238 HydrophobicContact CB-CD1 3.89Å; R213-Y238 HydrophobicContact CB-CD2 4.08Å; R213-Y238 HydrophobicContact CB-CE1 3.91Å; R213-Y238 HydrophobicContact CB-CE2 4.11Å; R213-Y238 HydrophobicContact CB-CG 4Å; R213-Y238 HydrophobicContact CG-CD1 4.2Å; R213-Y238 HydrophobicContact CG-CD2 4.45Å; R213-Y238 HydrophobicContact CG-CE1 3.67Å; R213-Y238 HydrophobicContact CG-CE2 3.97Å; R213-Y238 PolarHBondContact NE-OH 3.39Å; R213-C260 HydrophobicContact CB-CB 4.28Å
214	G	95	Very high	91.8	Very high	16 Å²	16	78.8 Å²	78.8	17%	0.165	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	174.6	176	0	0	0	0	0	113.6	I211 E212 G233	I211-G214 PolarHBondContact O-N 2.95Å; E212-G214 PolarHBondContact O-N 2.84Å; E212-G214 VanDerWaalsContact O-N 3.12Å; G214-G233 CarbonylContact C-O 3.56Å; G214-G233 WeakPolarHBondContact CA-O 3.17Å
215	Y	94.8	Very high	91.8	Very high	147 Å²	147	80.3 Å²	80.3	58%	0.576	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.5	163.5	-179.9	59.9	-93.4	0	0	0	109.8	Y232 G233 C234	Y215-Y232 CarbonylContact O-C 3.6Å; Y215-Y232 WeakPolarHBondContact O-CA 3.42Å; Y215-G233 PolarHBondContact N-O 2.83Å; Y215-G233 PolarHBondContact O-N 3.28Å; Y215-C234 WeakPolarHBondContact CE1-O 3.38Å
216	M	93.7	Very high	91.8	Very high	29 Å²	29	82.3 Å²	82.3	14%	0.143	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	151.2	-178.4	61.9	-155.6	-83.3	0	0	111.3	P208 N218 N219 V230 K231 Y232	P208-M216 HydrophobicContact CB-CE 3.68Å; P208-M216 HydrophobicContact CG-CE 3.53Å; M216-N218 VanDerWaalsContact C-N 3.32Å; M216-N218 WeakPolarHBondContact CE-O 3.24Å; M216-N218 WeakPolarHBondContact CG-O 3.49Å; M216-N218 PolarHBondContact O-N 3.39Å; M216-N219 HydrophobicContact CG-CB 4.33Å; M216-V230 HydrophobicContact CB-CG1 4Å; M216-V230 HydrophobicContact CE-CG1 4.18Å; M216-K231 CarbonylContact C-O 3.47Å; M216-K231 VanDerWaalsContact CA-O 3.24Å; M216-K231 WeakPolarHBondContact CA-O 3.42Å; M216-Y232 HydrophobicContact CB-CD1 4.03Å; M216-Y232 HydrophobicContact CB-CE1 3.91Å
217	S	91	Very high	91.8	Very high	83 Å²	83	86.3 Å²	86.3	58%	0.58	41%	0.413	S	S	*	.	S	Bend	trans	-70.1	-26.7	-177	61.7	0	0	0	0	113.8	K231	S217-K231 PolarHBondContact N-O 3.26Å; S217-K231 PolarHBondContact OG-N 2.86Å
218	N	84.4	Confident	91.8	Very high	39 Å²	39	86.3 Å²	86.3	21%	0.209	41%	0.408	C	S	.	.			trans	-136.2	121	178	-177.2	-13.2	0	0	0	108.2	M216 E220	M216-N218 VanDerWaalsContact C-N 3.32Å; M216-N218 WeakPolarHBondContact CE-O 3.24Å; M216-N218 WeakPolarHBondContact CG-O 3.49Å; M216-N218 PolarHBondContact O-N 3.39Å; N218-E220 PolarHBondContact ND2-OE2 2.96Å; N218-E220 WeakPolarHBondContact OD1-CB 3.42Å; N218-E220 WeakPolarHBondContact OD1-CG 3.43Å; N218-E220 PolarHBondContact OD1-N 3.16Å
219	N	78.1	Confident	92	Very high	122 Å²	122	92.3 Å²	92.3	65%	0.652	43%	0.429	S	S	*	.			trans	-110.5	23.5	178.6	-165.2	22.7	0	0	0	112.2	M216 K221	M216-N219 HydrophobicContact CG-CB 4.33Å; N219-K221 PolarHBondContact O-N 2.81Å
220	E	83.9	Confident	92.1	Very high	95 Å²	95	86.4 Å²	86.4	44%	0.444	40%	0.401	S	S	.	.			trans	-63.7	130.6	175.5	-73.9	167	179.3	0	0	110.3	N218 R222 F224	N218-E220 PolarHBondContact ND2-OE2 2.96Å; N218-E220 WeakPolarHBondContact OD1-CB 3.42Å; N218-E220 WeakPolarHBondContact OD1-CG 3.43Å; N218-E220 PolarHBondContact OD1-N 3.16Å; E220-R222 HydrophobicContact CB-CG 3.98Å; E220-R222 PolarHBondContact O-N 2.93Å; E220-R222 VanDerWaalsContact O-N 3.1Å; E220-R222 WeakPolarHBondContact OE2-CD 3.3Å; E220-R222 IonicContact OE2-CZ 3.8Å; E220-R222 IonicContact OE2-NE 3.85Å; E220-R222 PolarHBondContact OE2-NE 2.93Å; E220-R222 IonicContact OE2-NH2 2.76Å; E220-F224 HydrophobicContact CB-CZ 4.36Å
221	K	84.3	Confident	92.3	Very high	193 Å²	193	87.4 Å²	87.4	84%	0.839	39%	0.393	S	S	*	.			trans	-85.8	41.4	175.1	-62.1	-174.2	178.6	-177.1	0	111.8	N219	N219-K221 PolarHBondContact O-N 2.81Å
222	R	91.8	Very high	92.3	Very high	86 Å²	86	87.3 Å²	87.3	33%	0.325	39%	0.392	S	S	.	.	S	Bend	trans	-103.4	165.5	175.6	69.8	170.1	177.8	88.8	-8.3	110.6	P207 E220 F224 E228	P207-R222 WeakPolarHBondContact CG-O 3.22Å; E220-R222 HydrophobicContact CB-CG 3.98Å; E220-R222 PolarHBondContact O-N 2.93Å; E220-R222 VanDerWaalsContact O-N 3.1Å; E220-R222 WeakPolarHBondContact OE2-CD 3.3Å; E220-R222 IonicContact OE2-CZ 3.8Å; E220-R222 IonicContact OE2-NE 3.85Å; E220-R222 PolarHBondContact OE2-NE 2.93Å; E220-R222 IonicContact OE2-NH2 2.76Å; R222-F224 HydrophobicContact CG-CE2 4.17Å; R222-F224 HydrophobicContact CG-CZ 4.4Å; R222-F224 WeakPolarHBondContact O-CD2 3.38Å; R222-F224 VanDerWaalsContact O-CE2 3.27Å; R222-F224 WeakPolarHBondContact O-CE2 3.37Å; R222-E228 IonicContact CZ-OE1 2.88Å; R222-E228 IonicContact CZ-OE2 3.33Å; R222-E228 IonicContact NH1-OE1 3.67Å; R222-E228 PolarHBondContact NH1-OE1 2.84Å; R222-E228 IonicContact NH1-OE2 3.66Å; R222-E228 PolarHBondContact NH1-OE2 3.13Å; R222-E228 IonicContact NH2-OE1 3.48Å; R222-E228 PolarHBondContact NH2-OE1 2.88Å; R222-E228 IonicContact NH2-OE2 2.84Å; R222-E228 PolarHBondContact NH2-OE2 3.18Å
223	E	90.9	Very high	92.4	Very high	119 Å²	119	79.9 Å²	79.9	56%	0.556	36%	0.36	S	S	*	.			trans	-69.1	141.7	164.6	-64.7	-173.1	170.9	0	0	110.3	T204	T204-E223 HydrophobicContact CG2-CB 4.36Å; T204-E223 PolarHBondContact OG1-OE2 3.09Å
224	F	94.6	Very high	92.5	Very high	2 Å²	2	74.8 Å²	74.8	1%	0.009	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	142.1	178.1	-73	-100.3	0	0	0	110	T204 C205 P208 E220 R222 E228 V230 W254	T204-F224 CarbonylContact C-O 3.56Å; T204-F224 WeakPolarHBondContact CA-O 3.39Å; C205-F224 PolarHBondContact N-O 3.37Å; C205-F224 PolarHBondContact O-N 2.85Å; P208-F224 VanDerWaalsContact CD-CE2 3.44Å; P208-F224 HydrophobicContact CG-CE2 4.27Å; P208-F224 HydrophobicContact CG-CZ 4.46Å; E220-F224 HydrophobicContact CB-CZ 4.36Å; R222-F224 HydrophobicContact CG-CE2 4.17Å; R222-F224 HydrophobicContact CG-CZ 4.4Å; R222-F224 WeakPolarHBondContact O-CD2 3.38Å; R222-F224 VanDerWaalsContact O-CE2 3.27Å; R222-F224 WeakPolarHBondContact O-CE2 3.37Å; F224-E228 WeakPolarHBondContact CA-OE2 3.49Å; F224-E228 HydrophobicContact CB-CB 4.43Å; F224-E228 WeakPolarHBondContact CB-OE2 3.42Å; F224-E228 HydrophobicContact CD1-CB 4.26Å; F224-E228 WeakPolarHBondContact CD1-OE2 3.31Å; F224-V230 HydrophobicContact CD1-CG2 4.27Å; F224-V230 HydrophobicContact CE1-CG2 3.88Å; F224-V230 HydrophobicContact CZ-CG2 4.37Å; F224-W254 HydrophobicContact CB-CH2 3.68Å; F224-W254 HydrophobicContact CB-CZ2 3.49Å; F224-W254 VanDerWaalsContact CB-CZ2 3.49Å; F224-W254 AromaticContact CD1-CH2 3.9Å; F224-W254 HydrophobicContact CD1-CH2 3.9Å; F224-W254 HydrophobicContact CD1-CZ2 4.12Å; F224-W254 HydrophobicContact CD2-CH2 4.45Å; F224-W254 AromaticContact CD2-CZ2 3.84Å; F224-W254 HydrophobicContact CD2-CZ2 3.84Å; F224-W254 AromaticContact CG-CH2 3.75Å; F224-W254 HydrophobicContact CG-CH2 3.75Å; F224-W254 AromaticContact CG-CZ2 3.54Å; F224-W254 HydrophobicContact CG-CZ2 3.54Å
225	F	96.1	Very high	92.5	Very high	81 Å²	81	78.2 Å²	78.2	36%	0.355	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	159.1	-178	-67.6	-67.9	0	0	0	112.3	P177 V202 T204 R227 E228 C248	P177-F225 HydrophobicContact CB-CB 3.56Å; P177-F225 HydrophobicContact CB-CD1 3.76Å; P177-F225 HydrophobicContact CB-CD2 4.42Å; P177-F225 HydrophobicContact CB-CG 3.65Å; P177-F225 HydrophobicContact CG-CD1 4.12Å; P177-F225 HydrophobicContact CG-CG 4.34Å; V202-F225 HydrophobicContact CG1-CD1 4.09Å; V202-F225 HydrophobicContact CG1-CE1 4.04Å; T204-F225 HydrophobicContact CG2-CD1 3.73Å; T204-F225 HydrophobicContact CG2-CE1 3.74Å; F225-R227 PolarHBondContact O-N 2.84Å; F225-E228 HydrophobicContact CB-CG 4.24Å; F225-E228 PolarHBondContact N-OE2 3.17Å; F225-E228 VanDerWaalsContact O-CB 3.26Å; F225-E228 WeakPolarHBondContact O-CB 3.47Å; F225-E228 WeakPolarHBondContact O-CG 3.32Å; F225-E228 PolarHBondContact O-N 3.04Å; F225-C248 WeakPolarHBondContact O-CB 3.47Å
226	Y	96.2	Very high	92.5	Very high	44 Å²	44	76.6 Å²	76.6	17%	0.173	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.2	132.6	173	175.1	-118.8	0	0	0	112.3	A179 V203 E228 C248 E250	A179-Y226 HydrophobicContact CB-CD1 3.72Å; A179-Y226 HydrophobicContact CB-CD2 4.14Å; A179-Y226 HydrophobicContact CB-CE1 3.97Å; A179-Y226 HydrophobicContact CB-CE2 4.37Å; A179-Y226 HydrophobicContact CB-CG 3.84Å; V203-Y226 PolarHBondContact O-N 2.98Å; Y226-E228 PolarHBondContact O-N 2.82Å; Y226-C248 WeakPolarHBondContact CD2-O 3.13Å; Y226-E250 HydrophobicContact CE2-CB 4.08Å
227	R	94.9	Very high	92.5	Very high	161 Å²	161	76.5 Å²	76.5	61%	0.608	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	0.7	-175.4	-58.8	177.6	173.1	-161.3	-1.5	116.7	F225 C248	F225-R227 PolarHBondContact O-N 2.84Å; R227-C248 PolarHBondContact N-O 3.3Å
228	E	94.9	Very high	92.7	Very high	57 Å²	57	75.6 Å²	75.6	27%	0.266	35%	0.351	S	S	.	.			trans	-61.7	149	164.6	-71.7	-165.1	133.3	0	0	110.2	R222 F224 F225 Y226 V247 C248 W254	R222-E228 IonicContact CZ-OE1 2.88Å; R222-E228 IonicContact CZ-OE2 3.33Å; R222-E228 IonicContact NH1-OE1 3.67Å; R222-E228 PolarHBondContact NH1-OE1 2.84Å; R222-E228 IonicContact NH1-OE2 3.66Å; R222-E228 PolarHBondContact NH1-OE2 3.13Å; R222-E228 IonicContact NH2-OE1 3.48Å; R222-E228 PolarHBondContact NH2-OE1 2.88Å; R222-E228 IonicContact NH2-OE2 2.84Å; R222-E228 PolarHBondContact NH2-OE2 3.18Å; F224-E228 WeakPolarHBondContact CA-OE2 3.49Å; F224-E228 HydrophobicContact CB-CB 4.43Å; F224-E228 WeakPolarHBondContact CB-OE2 3.42Å; F224-E228 HydrophobicContact CD1-CB 4.26Å; F224-E228 WeakPolarHBondContact CD1-OE2 3.31Å; F225-E228 HydrophobicContact CB-CG 4.24Å; F225-E228 PolarHBondContact N-OE2 3.17Å; F225-E228 VanDerWaalsContact O-CB 3.26Å; F225-E228 WeakPolarHBondContact O-CB 3.47Å; F225-E228 WeakPolarHBondContact O-CG 3.32Å; F225-E228 PolarHBondContact O-N 3.04Å; Y226-E228 PolarHBondContact O-N 2.82Å; E228-V247 WeakPolarHBondContact O-CA 3.05Å; E228-C248 PolarHBondContact O-N 2.88Å; E228-W254 WeakPolarHBondContact O-CZ3 3.46Å
229	R	95.2	Very high	93.3	Very high	138 Å²	138	75.9 Å²	75.9	52%	0.521	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	140.9	-173.9	-52.5	-169.2	178.7	-116.2	-9.4	110.8	E245 V246 V247	R229-E245 WeakPolarHBondContact CD-OE1 3.47Å; R229-E245 IonicContact CZ-OE1 2.67Å; R229-E245 IonicContact NE-OE1 2.99Å; R229-E245 IonicContact NH1-OE1 3.77Å; R229-E245 PolarHBondContact NH1-OE1 2.94Å; R229-V246 VanDerWaalsContact CA-O 3.26Å; R229-V246 WeakPolarHBondContact CA-O 3.31Å; R229-V247 HydrophobicContact CG-CG1 4.33Å; R229-V247 HydrophobicContact CG-CG2 4.05Å; R229-V247 VanDerWaalsContact NH1-CG2 3.32Å
230	V	95.5	Very high	94.2	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	126.7	172.9	177.6	0	0	0	0	108.8	P208 M216 F224 E245 V246 W254	P208-V230 HydrophobicContact CG-CB 4.08Å; P208-V230 HydrophobicContact CG-CG1 4.1Å; P208-V230 HydrophobicContact CG-CG2 3.7Å; M216-V230 HydrophobicContact CB-CG1 4Å; M216-V230 HydrophobicContact CE-CG1 4.18Å; F224-V230 HydrophobicContact CD1-CG2 4.27Å; F224-V230 HydrophobicContact CE1-CG2 3.88Å; F224-V230 HydrophobicContact CZ-CG2 4.37Å; V230-E245 VanDerWaalsContact O-CA 3.28Å; V230-E245 WeakPolarHBondContact O-CA 3.35Å; V230-V246 HydrophobicContact CB-CG2 4.05Å; V230-V246 PolarHBondContact N-O 3.27Å; V230-V246 PolarHBondContact O-N 3.28Å; V230-W254 HydrophobicContact CG2-CH2 3.82Å; V230-W254 HydrophobicContact CG2-CZ2 4.46Å; V230-W254 HydrophobicContact CG2-CZ3 4.3Å
231	K	96.3	Very high	94.8	Very high	118 Å²	118	71.4 Å²	71.4	51%	0.513	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	140.9	-179.7	-59.5	-173.4	175.3	-177.1	0	110.1	M216 S217 V244 E245	M216-K231 CarbonylContact C-O 3.47Å; M216-K231 VanDerWaalsContact CA-O 3.24Å; M216-K231 WeakPolarHBondContact CA-O 3.42Å; S217-K231 PolarHBondContact N-O 3.26Å; S217-K231 PolarHBondContact OG-N 2.86Å; K231-V244 CarbonylContact C-O 3.57Å; K231-V244 WeakPolarHBondContact CA-O 3.26Å; K231-E245 HydrophobicContact CG-CB 4.11Å
232	Y	96.7	Very high	95.3	Very high	14 Å²	14	65.2 Å²	65.2	6%	0.055	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	154.4	172.2	-71.3	-87.9	0	0	0	111.3	P208 E209 I211 Y215 M216 V244 V246 P258	P208-Y232 VanDerWaalsContact CB-OH 3.25Å; P208-Y232 WeakPolarHBondContact CB-OH 3.44Å; E209-Y232 PolarHBondContact O-OH 2.91Å; I211-Y232 HydrophobicContact CD1-CD1 3.66Å; I211-Y232 HydrophobicContact CD1-CG 4.05Å; I211-Y232 HydrophobicContact CG1-CD1 3.81Å; I211-Y232 HydrophobicContact CG1-CE1 4.33Å; I211-Y232 HydrophobicContact CG2-CD1 4.02Å; I211-Y232 HydrophobicContact CG2-CE1 3.89Å; Y215-Y232 CarbonylContact O-C 3.6Å; Y215-Y232 WeakPolarHBondContact O-CA 3.42Å; M216-Y232 HydrophobicContact CB-CD1 4.03Å; M216-Y232 HydrophobicContact CB-CE1 3.91Å; Y232-V244 PolarHBondContact N-O 2.79Å; Y232-V246 HydrophobicContact CD2-CG1 4.18Å; Y232-V246 HydrophobicContact CD2-CG2 4.44Å; Y232-V246 HydrophobicContact CE2-CB 4.26Å; Y232-V246 HydrophobicContact CE2-CG1 3.69Å; Y232-V246 HydrophobicContact CE2-CG2 3.59Å; Y232-P258 HydrophobicContact CD2-CG 3.8Å; Y232-P258 HydrophobicContact CG-CG 3.86Å
233	G	96.1	Very high	95.5	Very high	9 Å²	9	65.7 Å²	65.7	9%	0.093	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	166.7	168.6	0	0	0	0	0	110	G214 Y215	G214-G233 CarbonylContact C-O 3.56Å; G214-G233 WeakPolarHBondContact CA-O 3.17Å; Y215-G233 PolarHBondContact N-O 2.83Å; Y215-G233 PolarHBondContact O-N 3.28Å
234	C	97.4	Very high	95.7	Very high	17 Å²	17	63.6 Å²	63.6	12%	0.115	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	144	178.2	-62.9	0	0	0	0	110.7	Y215 S236 Y238 L240 C260	Y215-C234 WeakPolarHBondContact CE1-O 3.38Å; C234-S236 PolarHBondContact O-N 2.98Å; C234-Y238 WeakPolarHBondContact CB-O 3.32Å; C234-L240 WeakPolarHBondContact SG-CA 3.03Å; C234-L240 WeakPolarHBondContact SG-CD1 3.39Å; C234-L240 PolarHBondContact SG-N 3.24Å; C234-C260 WeakPolarHBondContact CA-SG 3.32Å; C234-C260 HydrophobicContact CB-CB 3.85Å; C234-C260 WeakPolarHBondContact CB-SG 3.33Å; C234-C260 WeakPolarHBondContact SG-CA 3.03Å; C234-C260 WeakPolarHBondContact SG-CB 3Å; C234-C260 CovalentContact SG-SG 2.03Å; C234-C260 PolarHBondContact SG-SG 2.83Å
235	E	96.7	Very high	95.8	Very high	89 Å²	89	65.4 Å²	65.4	42%	0.416	33%	0.333	S	S	.	.			trans	-58.3	134.5	169.3	-66.4	173.6	-177.6	0	0	109	R213 Y238	R213-E235 IonicContact NH1-OE2 3.52Å; R213-E235 PolarHBondContact O-N 2.88Å; E235-Y238 WeakPolarHBondContact O-CB 3.46Å; E235-Y238 WeakPolarHBondContact O-CD2 3.29Å; E235-Y238 PolarHBondContact O-N 3.41Å
236	S	93	Very high	95.8	Very high	112 Å²	112	61.6 Å²	61.6	78%	0.783	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	129.9	171.9	-179.5	0	0	0	0	108.8	C234	C234-S236 PolarHBondContact O-N 2.98Å
237	P	94.1	Very high	95.8	Very high	27 Å²	27	60.8 Å²	60.8	18%	0.175	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	cis	-104.2	19.1	14.1	38.8	-40.1	0	0	0	118.1	P263 R289	P237-P263 HydrophobicContact CB-CG 3.95Å; P237-P263 HydrophobicContact CG-CG 3.54Å; P237-R289 VanDerWaalsContact CB-CZ 3.42Å
238	Y	96.7	Very high	95.9	Very high	65 Å²	65	53.1 Å²	53.1	26%	0.255	29%	0.287	S	S	.	.			trans	-69.9	151.1	-179.2	-66.8	-106.5	0	0	0	111.2	R213 C234 E235 C260 K261 A262	R213-Y238 HydrophobicContact CB-CD1 3.89Å; R213-Y238 HydrophobicContact CB-CD2 4.08Å; R213-Y238 HydrophobicContact CB-CE1 3.91Å; R213-Y238 HydrophobicContact CB-CE2 4.11Å; R213-Y238 HydrophobicContact CB-CG 4Å; R213-Y238 HydrophobicContact CG-CD1 4.2Å; R213-Y238 HydrophobicContact CG-CD2 4.45Å; R213-Y238 HydrophobicContact CG-CE1 3.67Å; R213-Y238 HydrophobicContact CG-CE2 3.97Å; R213-Y238 PolarHBondContact NE-OH 3.39Å; C234-Y238 WeakPolarHBondContact CB-O 3.32Å; E235-Y238 WeakPolarHBondContact O-CB 3.46Å; E235-Y238 WeakPolarHBondContact O-CD2 3.29Å; E235-Y238 PolarHBondContact O-N 3.41Å; Y238-C260 HydrophobicContact CD1-CB 4.39Å; Y238-K261 WeakPolarHBondContact CA-O 3.3Å; Y238-A262 HydrophobicContact CD1-CB 4.15Å; Y238-A262 HydrophobicContact CE1-CB 3.73Å
239	V	96.3	Very high	95.9	Very high	45 Å²	45	54.1 Å²	54.1	27%	0.273	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	135.8	178.9	-177.4	0	0	0	0	109.2	K261 L291 H292	V239-K261 PolarHBondContact N-O 2.94Å; V239-K261 PolarHBondContact O-N 3.25Å; V239-L291 HydrophobicContact CG2-CB 3.87Å; V239-L291 HydrophobicContact CG2-CD1 4.48Å; V239-L291 HydrophobicContact CG2-CD2 4.31Å; V239-L291 HydrophobicContact CG2-CG 4.45Å; V239-H292 HydrophobicContact CB-CB 4.06Å; V239-H292 HydrophobicContact CG2-CB 4.23Å
240	L	96.6	Very high	95.9	Very high	46 Å²	46	53.1 Å²	53.1	24%	0.241	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	124.9	177.3	-165	79.5	0	0	0	110.1	I211 C234 V244 P258	I211-L240 HydrophobicContact CD1-CD1 3.88Å; C234-L240 WeakPolarHBondContact SG-CA 3.03Å; C234-L240 WeakPolarHBondContact SG-CD1 3.39Å; C234-L240 PolarHBondContact SG-N 3.24Å; L240-V244 HydrophobicContact CD2-CB 4.18Å; L240-V244 HydrophobicContact CD2-CG2 4.09Å; L240-P258 HydrophobicContact CD1-CB 3.7Å; L240-P258 HydrophobicContact CD1-CG 3.92Å; L240-P258 HydrophobicContact CD2-CB 4.19Å; L240-P258 HydrophobicContact CD2-CG 4.44Å; L240-P258 HydrophobicContact CG-CB 3.9Å; L240-P258 HydrophobicContact CG-CG 4.45Å
241	E	96.3	Very high	95.8	Very high	76 Å²	76	57.6 Å²	57.6	36%	0.355	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127	170.5	-173.3	175.4	-124.3	0	0	109.5	P258 S259 K261 H292	E241-P258 CarbonylContact O-C 3.59Å; E241-P258 WeakPolarHBondContact O-CA 3.43Å; E241-P258 WeakPolarHBondContact O-CB 3.45Å; E241-S259 PolarHBondContact N-O 3.45Å; E241-S259 PolarHBondContact O-N 2.89Å; E241-K261 HydrophobicContact CB-CG 3.79Å; E241-K261 WeakPolarHBondContact OE2-CE 3.28Å; E241-H292 IonicContact OE1-NE2 2.82Å; E241-H292 PolarHBondContact OE1-NE2 3.12Å; E241-H292 IonicContact OE2-NE2 3.95Å
242	G	95.1	Very high	95.7	Very high	63 Å²	63	52.9 Å²	52.9	65%	0.649	30%	0.302	S	S	*	.	S	Bend	trans	109.8	-163.7	-175	0	0	0	0	0	113.2
243	N	95.9	Very high	95.7	Very high	96 Å²	96	59 Å²	59	51%	0.513	33%	0.329	S	S	.	.			trans	-76.9	133.4	-178.5	-156.8	-24.1	0	0	0	111	E245 P258	N243-E245 PolarHBondContact O-N 3.44Å; N243-E245 PolarHBondContact OD1-N 3.19Å; N243-P258 WeakPolarHBondContact O-CB 3.11Å; N243-P258 VanDerWaalsContact O-CG 3.32Å; N243-P258 WeakPolarHBondContact O-CG 3.21Å
244	V	95.9	Very high	95.7	Very high	75 Å²	75	60.6 Å²	60.6	46%	0.455	33%	0.332	S	S	.	.	S	Bend	trans	-64.3	-22.6	-179.6	70.8	0	0	0	0	112.7	K231 Y232 L240	K231-V244 CarbonylContact C-O 3.57Å; K231-V244 WeakPolarHBondContact CA-O 3.26Å; Y232-V244 PolarHBondContact N-O 2.79Å; L240-V244 HydrophobicContact CD2-CB 4.18Å; L240-V244 HydrophobicContact CD2-CG2 4.09Å
245	E	95.9	Very high	95.7	Very high	40 Å²	40	60.8 Å²	60.8	19%	0.187	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	141.7	178.5	60.4	-175.9	-155.8	0	0	111.8	R229 V230 K231 N243	R229-E245 WeakPolarHBondContact CD-OE1 3.47Å; R229-E245 IonicContact CZ-OE1 2.67Å; R229-E245 IonicContact NE-OE1 2.99Å; R229-E245 IonicContact NH1-OE1 3.77Å; R229-E245 PolarHBondContact NH1-OE1 2.94Å; V230-E245 VanDerWaalsContact O-CA 3.28Å; V230-E245 WeakPolarHBondContact O-CA 3.35Å; K231-E245 HydrophobicContact CG-CB 4.11Å; N243-E245 PolarHBondContact O-N 3.44Å; N243-E245 PolarHBondContact OD1-N 3.19Å
246	V	96.3	Very high	95.7	Very high	2 Å²	2	64.9 Å²	64.9	1%	0.012	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	146.3	167.3	-61	0	0	0	0	109.6	R229 V230 Y232 W254 S255	R229-V246 VanDerWaalsContact CA-O 3.26Å; R229-V246 WeakPolarHBondContact CA-O 3.31Å; V230-V246 HydrophobicContact CB-CG2 4.05Å; V230-V246 PolarHBondContact N-O 3.27Å; V230-V246 PolarHBondContact O-N 3.28Å; Y232-V246 HydrophobicContact CD2-CG1 4.18Å; Y232-V246 HydrophobicContact CD2-CG2 4.44Å; Y232-V246 HydrophobicContact CE2-CB 4.26Å; Y232-V246 HydrophobicContact CE2-CG1 3.69Å; Y232-V246 HydrophobicContact CE2-CG2 3.59Å; V246-W254 HydrophobicContact CB-CB 4.45Å; V246-W254 HydrophobicContact CB-CE3 3.95Å; V246-W254 HydrophobicContact CG2-CD2 4Å; V246-W254 HydrophobicContact CG2-CE3 3.46Å; V246-W254 VanDerWaalsContact CG2-CE3 3.46Å; V246-W254 HydrophobicContact CG2-CZ3 3.92Å; V246-S255 VanDerWaalsContact CA-OG 3.26Å; V246-S255 WeakPolarHBondContact CA-OG 3.49Å
247	V	96.6	Very high	95.7	Very high	26 Å²	26	65.1 Å²	65.1	16%	0.158	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	135.4	-178.1	-170.7	0	0	0	0	109.6	E228 R229 Q249 S255	E228-V247 WeakPolarHBondContact O-CA 3.05Å; R229-V247 HydrophobicContact CG-CG1 4.33Å; R229-V247 HydrophobicContact CG-CG2 4.05Å; R229-V247 VanDerWaalsContact NH1-CG2 3.32Å; V247-Q249 PolarHBondContact O-N 2.97Å; V247-S255 PolarHBondContact N-OG 3.39Å; V247-S255 PolarHBondContact O-N 2.91Å
248	C	96.4	Very high	95.9	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-70.1	116.8	173.2	178.7	0	0	0	0	110.1	C205 F225 Y226 R227 E228 W254	C205-C248 HydrophobicContact CB-CB 3.8Å; C205-C248 WeakPolarHBondContact CB-SG 3.13Å; C205-C248 WeakPolarHBondContact SG-CA 3.44Å; C205-C248 WeakPolarHBondContact SG-CB 3.41Å; C205-C248 CovalentContact SG-SG 2.03Å; C205-C248 PolarHBondContact SG-SG 3.42Å; F225-C248 WeakPolarHBondContact O-CB 3.47Å; Y226-C248 WeakPolarHBondContact CD2-O 3.13Å; R227-C248 PolarHBondContact N-O 3.3Å; E228-C248 PolarHBondContact O-N 2.88Å; C248-W254 HydrophobicContact CB-CE3 4.22Å; C248-W254 HydrophobicContact CB-CH2 4.2Å; C248-W254 HydrophobicContact CB-CZ3 3.98Å; C248-W254 VanDerWaalsContact N-CE3 3.34Å; C248-W254 VanDerWaalsContact N-CZ3 3.33Å
249	Q	95.6	Very high	95.9	Very high	78 Å²	78	63.1 Å²	63.1	36%	0.364	34%	0.336	S	S	.	.			trans	-89.6	168.9	-173.9	-58	-177.1	-34.4	0	0	112.1	V203 V247 N251 G252 K253	V203-Q249 WeakPolarHBondContact CG1-O 3.46Å; V247-Q249 PolarHBondContact O-N 2.97Å; Q249-N251 WeakPolarHBondContact CB-OD1 3.39Å; Q249-N251 PolarHBondContact O-N 2.95Å; Q249-N251 PolarHBondContact OE1-ND2 2.04Å; Q249-G252 PolarHBondContact O-N 3.02Å; Q249-G252 VanDerWaalsContact O-N 3.12Å; Q249-K253 VanDerWaalsContact CB-O 3.26Å; Q249-K253 WeakPolarHBondContact CB-O 3.26Å; Q249-K253 WeakPolarHBondContact CG-O 3.32Å; Q249-K253 PolarHBondContact N-O 3.14Å
250	E	94.6	Very high	96	Very high	117 Å²	117	61.8 Å²	61.8	55%	0.547	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.9	-179.9	65.7	-175.6	-165.9	0	0	113.9	A179 Y226 G252	A179-E250 HydrophobicContact CB-CB 4.45Å; Y226-E250 HydrophobicContact CE2-CB 4.08Å; E250-G252 VanDerWaalsContact C-N 3.26Å; E250-G252 PolarHBondContact O-N 2.82Å
251	N	94.3	Very high	96	Very high	94 Å²	94	61.7 Å²	61.7	50%	0.503	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	5.9	178.5	64.3	11	0	0	0	113.3	Q249 K253	Q249-N251 WeakPolarHBondContact CB-OD1 3.39Å; Q249-N251 PolarHBondContact O-N 2.95Å; Q249-N251 PolarHBondContact OE1-ND2 2.04Å; N251-K253 VanDerWaalsContact C-N 3.27Å; N251-K253 PolarHBondContact O-N 2.95Å; N251-K253 WeakPolarHBondContact OD1-CA 3.27Å; N251-K253 VanDerWaalsContact OD1-CB 3.32Å; N251-K253 WeakPolarHBondContact OD1-CB 3.35Å; N251-K253 PolarHBondContact OD1-N 2.78Å
252	G	94.3	Very high	96	Very high	19 Å²	19	59 Å²	59	20%	0.196	32%	0.318	C	S	.	.	S	Bend	trans	72.8	15.2	-177.1	0	0	0	0	0	114.5	T204 Q249 E250	T204-G252 WeakPolarHBondContact O-CA 3.17Å; Q249-G252 PolarHBondContact O-N 3.02Å; Q249-G252 VanDerWaalsContact O-N 3.12Å; E250-G252 VanDerWaalsContact C-N 3.26Å; E250-G252 PolarHBondContact O-N 2.82Å
253	K	96	Very high	96.1	Very high	143 Å²	143	57.2 Å²	57.2	62%	0.622	29%	0.294	S	S	*	.	S	Bend	trans	-114.7	152.7	175.8	-58.2	-176.7	-179.1	-179.8	0	110.9	Q249 N251	Q249-K253 VanDerWaalsContact CB-O 3.26Å; Q249-K253 WeakPolarHBondContact CB-O 3.26Å; Q249-K253 WeakPolarHBondContact CG-O 3.32Å; Q249-K253 PolarHBondContact N-O 3.14Å; N251-K253 VanDerWaalsContact C-N 3.27Å; N251-K253 PolarHBondContact O-N 2.95Å; N251-K253 WeakPolarHBondContact OD1-CA 3.27Å; N251-K253 VanDerWaalsContact OD1-CB 3.32Å; N251-K253 WeakPolarHBondContact OD1-CB 3.35Å; N251-K253 PolarHBondContact OD1-N 2.78Å
254	W	96.3	Very high	96.1	Very high	42 Å²	42	52.7 Å²	52.7	16%	0.159	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-69.7	148.2	168.8	-67.7	102.9	0	0	0	110.6	C205 P206 P208 F224 E228 V230 V246 C248	C205-W254 HydrophobicContact CB-CD2 4.36Å; C205-W254 HydrophobicContact CB-CZ2 4.14Å; P206-W254 PolarHBondContact O-NE1 2.82Å; P208-W254 HydrophobicContact CB-CZ2 4.35Å; P208-W254 HydrophobicContact CG-CH2 4.3Å; P208-W254 HydrophobicContact CG-CZ2 3.7Å; F224-W254 HydrophobicContact CB-CH2 3.68Å; F224-W254 HydrophobicContact CB-CZ2 3.49Å; F224-W254 VanDerWaalsContact CB-CZ2 3.49Å; F224-W254 AromaticContact CD1-CH2 3.9Å; F224-W254 HydrophobicContact CD1-CH2 3.9Å; F224-W254 HydrophobicContact CD1-CZ2 4.12Å; F224-W254 HydrophobicContact CD2-CH2 4.45Å; F224-W254 AromaticContact CD2-CZ2 3.84Å; F224-W254 HydrophobicContact CD2-CZ2 3.84Å; F224-W254 AromaticContact CG-CH2 3.75Å; F224-W254 HydrophobicContact CG-CH2 3.75Å; F224-W254 AromaticContact CG-CZ2 3.54Å; F224-W254 HydrophobicContact CG-CZ2 3.54Å; E228-W254 WeakPolarHBondContact O-CZ3 3.46Å; V230-W254 HydrophobicContact CG2-CH2 3.82Å; V230-W254 HydrophobicContact CG2-CZ2 4.46Å; V230-W254 HydrophobicContact CG2-CZ3 4.3Å; V246-W254 HydrophobicContact CB-CB 4.45Å; V246-W254 HydrophobicContact CB-CE3 3.95Å; V246-W254 HydrophobicContact CG2-CD2 4Å; V246-W254 HydrophobicContact CG2-CE3 3.46Å; V246-W254 VanDerWaalsContact CG2-CE3 3.46Å; V246-W254 HydrophobicContact CG2-CZ3 3.92Å; C248-W254 HydrophobicContact CB-CE3 4.22Å; C248-W254 HydrophobicContact CB-CH2 4.2Å; C248-W254 HydrophobicContact CB-CZ3 3.98Å; C248-W254 VanDerWaalsContact N-CE3 3.34Å; C248-W254 VanDerWaalsContact N-CZ3 3.33Å
255	S	97.2	Very high	96	Very high	22 Å²	22	52 Å²	52	15%	0.154	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-58.4	169	164.6	63.6	0	0	0	0	111.6	V246 V247 K257	V246-S255 VanDerWaalsContact CA-OG 3.26Å; V246-S255 WeakPolarHBondContact CA-OG 3.49Å; V247-S255 PolarHBondContact N-OG 3.39Å; V247-S255 PolarHBondContact O-N 2.91Å; S255-K257 PolarHBondContact O-N 3.37Å
256	E	96.3	Very high	95.6	Very high	175 Å²	175	50 Å²	50	82%	0.818	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-50	127.7	-179.6	-171.1	174.8	-172.6	0	0	112.2
257	K	94.1	Very high	95.1	Very high	117 Å²	117	56.6 Å²	56.6	51%	0.509	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-78.3	139	-179	64.5	-180	175.4	-175.9	0	110.8	E209 S255	E209-K257 IonicContact OE2-NZ 3.56Å; E209-K257 PolarHBondContact OE2-NZ 3.46Å; S255-K257 PolarHBondContact O-N 3.37Å
258	P	96.7	Very high	94.7	Very high	4 Å²	4	56.3 Å²	56.3	3%	0.026	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-73	170.7	173.2	32	-35.2	0	0	0	111.5	I211 Y232 L240 E241 N243	I211-P258 HydrophobicContact CD1-CG 4.36Å; I211-P258 WeakPolarHBondContact CG2-O 3.49Å; Y232-P258 HydrophobicContact CD2-CG 3.8Å; Y232-P258 HydrophobicContact CG-CG 3.86Å; L240-P258 HydrophobicContact CD1-CB 3.7Å; L240-P258 HydrophobicContact CD1-CG 3.92Å; L240-P258 HydrophobicContact CD2-CB 4.19Å; L240-P258 HydrophobicContact CD2-CG 4.44Å; L240-P258 HydrophobicContact CG-CB 3.9Å; L240-P258 HydrophobicContact CG-CG 4.45Å; E241-P258 CarbonylContact O-C 3.59Å; E241-P258 WeakPolarHBondContact O-CA 3.43Å; E241-P258 WeakPolarHBondContact O-CB 3.45Å; N243-P258 WeakPolarHBondContact O-CB 3.11Å; N243-P258 VanDerWaalsContact O-CG 3.32Å; N243-P258 WeakPolarHBondContact O-CG 3.21Å
259	S	97.1	Very high	94.1	Very high	46 Å²	46	63.4 Å²	63.4	32%	0.322	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.5	175.8	63.1	0	0	0	0	111.5	E241 K261	E241-S259 PolarHBondContact N-O 3.45Å; E241-S259 PolarHBondContact O-N 2.89Å; S259-K261 VanDerWaalsContact OG-CE 3.27Å; S259-K261 WeakPolarHBondContact OG-CE 3.41Å
260	C	97.8	Very high	93.7	Very high	17 Å²	17	64.5 Å²	64.5	12%	0.115	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	121.6	176.1	-68.2	0	0	0	0	109.7	I211 E212 R213 C234 Y238	I211-C260 VanDerWaalsContact CD1-SG 3.59Å; E212-C260 WeakPolarHBondContact O-CB 3.41Å; R213-C260 HydrophobicContact CB-CB 4.28Å; C234-C260 WeakPolarHBondContact CA-SG 3.32Å; C234-C260 HydrophobicContact CB-CB 3.85Å; C234-C260 WeakPolarHBondContact CB-SG 3.33Å; C234-C260 WeakPolarHBondContact SG-CA 3.03Å; C234-C260 WeakPolarHBondContact SG-CB 3Å; C234-C260 CovalentContact SG-SG 2.03Å; C234-C260 PolarHBondContact SG-SG 2.83Å; Y238-C260 HydrophobicContact CD1-CB 4.39Å
261	K	97.8	Very high	93.3	Very high	43 Å²	43	59 Å²	59	19%	0.187	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	132.8	-174.6	-62.6	-67.3	-179.3	-176.9	0	110.9	Y238 V239 E241 S259 H292 D317	Y238-K261 WeakPolarHBondContact CA-O 3.3Å; V239-K261 PolarHBondContact N-O 2.94Å; V239-K261 PolarHBondContact O-N 3.25Å; E241-K261 HydrophobicContact CB-CG 3.79Å; E241-K261 WeakPolarHBondContact OE2-CE 3.28Å; S259-K261 VanDerWaalsContact OG-CE 3.27Å; S259-K261 WeakPolarHBondContact OG-CE 3.41Å; K261-H292 HydrophobicContact CB-CB 3.8Å; K261-H292 WeakPolarHBondContact CB-CD2 3.28Å; K261-H292 VanDerWaalsContact CG-CD2 3.49Å; K261-H292 WeakPolarHBondContact CG-CD2 3.27Å; K261-D317 WeakPolarHBondContact CA-OD1 3.39Å; K261-D317 HydrophobicContact CD-CB 3.83Å; K261-D317 WeakPolarHBondContact CD-OD1 3.48Å; K261-D317 WeakPolarHBondContact CD-OD2 3.39Å; K261-D317 IonicContact NZ-OD2 3.94Å; K261-D317 PolarHBondContact NZ-OD2 2.83Å
262	A	96.8	Very high	93.1	Very high	21 Å²	21	57.3 Å²	57.3	17%	0.174	29%	0.287	C	S	.	.			trans	-69.1	142.1	-175.3	0	0	0	0	0	110.8	Y238 D317 G318	Y238-A262 HydrophobicContact CD1-CB 4.15Å; Y238-A262 HydrophobicContact CE1-CB 3.73Å; A262-D317 PolarHBondContact N-OD1 2.81Å; A262-G318 PolarHBondContact O-N 2.79Å
263	P	96.5	Very high	93	Very high	25 Å²	25	56.4 Å²	56.4	16%	0.162	28%	0.278	C	S	.	.			trans	-73.3	161.2	167.4	36.6	-39	0	0	0	110.2	P237 R289 V290 L291 G318	P237-P263 HydrophobicContact CB-CG 3.95Å; P237-P263 HydrophobicContact CG-CG 3.54Å; P263-R289 HydrophobicContact CB-CG 3.84Å; P263-R289 HydrophobicContact CG-CG 4.27Å; P263-V290 CarbonylContact C-O 3.56Å; P263-V290 WeakPolarHBondContact CA-O 3.46Å; P263-V290 WeakPolarHBondContact CB-O 3.45Å; P263-L291 HydrophobicContact CB-CD2 4.28Å; P263-G318 WeakPolarHBondContact O-CA 3.36Å
264	C	95.6	Very high	92.8	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.007	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-105.1	151.8	-179.9	-52.9	0	0	0	0	111.1	R289 V290 C315 T319 L320	C264-R289 CarbonylContact O-C 3.45Å; C264-R289 WeakPolarHBondContact O-CA 3.34Å; C264-V290 PolarHBondContact N-O 2.81Å; C264-V290 PolarHBondContact O-N 3.15Å; C264-C315 HydrophobicContact CB-CB 3.74Å; C264-C315 WeakPolarHBondContact CB-SG 3.23Å; C264-C315 PolarHBondContact N-SG 2.81Å; C264-C315 WeakPolarHBondContact SG-CA 3.38Å; C264-C315 WeakPolarHBondContact SG-CB 3.39Å; C264-C315 CovalentContact SG-SG 2.03Å; C264-C315 PolarHBondContact SG-SG 2.67Å; C264-T319 PolarHBondContact SG-N 2.93Å; C264-T319 VanDerWaalsContact SG-N 3.37Å; C264-T319 PolarHBondContact SG-O 2.99Å; C264-L320 HydrophobicContact CB-CB 3.73Å
265	S	93.4	Very high	92.6	Very high	59 Å²	59	50.6 Å²	50.6	41%	0.413	26%	0.256	S	S	.	.			trans	-103.3	138.8	165.8	-68.9	0	0	0	0	109.8	N267 N288	S265-N267 PolarHBondContact O-N 3.5Å; S265-N267 VanDerWaalsContact O-N 3.09Å; S265-N288 WeakPolarHBondContact CB-O 3.38Å; S265-N288 PolarHBondContact OG-O 2.9Å
266	V	88.6	Confident	92.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.279	C	S	.	.			trans	-80.9	90.3	173.3	-174.5	0	0	0	0	106.1	L268 I273 I282 F285 N288 V290 V296 L320	V266-L268 HydrophobicContact CG1-CB 4.35Å; V266-L268 HydrophobicContact CG1-CD1 3.85Å; V266-L268 HydrophobicContact CG1-CG 3.99Å; V266-L268 PolarHBondContact O-N 2.03Å; V266-I273 HydrophobicContact CG1-CG2 4.32Å; V266-I273 HydrophobicContact CG2-CD1 4.49Å; V266-I282 HydrophobicContact CB-CD1 3.7Å; V266-I282 HydrophobicContact CG1-CD1 3.73Å; V266-F285 HydrophobicContact CG2-CE1 4.12Å; V266-N288 WeakPolarHBondContact CB-OD1 3.01Å; V266-N288 PolarHBondContact N-OD1 3.08Å; V266-N288 PolarHBondContact O-ND2 2.85Å; V266-N288 PolarHBondContact O-OD1 3.32Å; V266-V290 HydrophobicContact CG2-CG2 3.64Å; V266-V296 HydrophobicContact CG2-CG1 4.33Å; V266-L320 HydrophobicContact CB-CD2 4.3Å; V266-L320 HydrophobicContact CG1-CD2 4.49Å; V266-L320 HydrophobicContact CG2-CD2 3.73Å
267	N	85.7	Confident	91.9	Very high	139 Å²	139	50.2 Å²	50.2	74%	0.743	27%	0.274	S	S	*	.			trans	-74.4	53	-173.8	-68	-30.8	0	0	0	112.8	S265	S265-N267 PolarHBondContact O-N 3.5Å; S265-N267 VanDerWaalsContact O-N 3.09Å
268	L	87.3	Confident	91.7	Very high	20 Å²	20	51.8 Å²	51.8	11%	0.105	28%	0.281	C	S	.	.			trans	-115.1	141.1	177.9	-60.4	178.5	0	0	0	109.1	V266 A271 I282 V298 I322 F326	V266-L268 HydrophobicContact CG1-CB 4.35Å; V266-L268 HydrophobicContact CG1-CD1 3.85Å; V266-L268 HydrophobicContact CG1-CG 3.99Å; V266-L268 PolarHBondContact O-N 2.03Å; L268-A271 HydrophobicContact CB-CB 4.16Å; L268-A271 HydrophobicContact CD1-CB 3.74Å; L268-I282 HydrophobicContact CB-CG1 4.41Å; L268-I282 WeakPolarHBondContact O-CG1 3.23Å; L268-V298 HydrophobicContact CD1-CG1 4.11Å; L268-I322 HydrophobicContact CD1-CD1 4.27Å; L268-I322 HydrophobicContact CD2-CG1 4.34Å; L268-F326 HydrophobicContact CD1-CD1 4.45Å; L268-F326 HydrophobicContact CD1-CE1 3.85Å; L268-F326 HydrophobicContact CD1-CE2 4.49Å; L268-F326 HydrophobicContact CD1-CZ 3.87Å; L268-F326 HydrophobicContact CD2-CD1 4.21Å; L268-F326 HydrophobicContact CD2-CE1 3.61Å; L268-F326 HydrophobicContact CD2-CZ 4.35Å; L268-F326 HydrophobicContact CG-CE1 4.33Å
269	Q	85.3	Confident	91.4	Very high	149 Å²	149	55.4 Å²	55.4	70%	0.696	30%	0.296	S	S	*	.	S	Bend	trans	-89.4	-35.9	176.5	-59.4	-63	-36.2	0	0	111.1	I282 E328	Q269-I282 WeakPolarHBondContact O-CG2 3.48Å; Q269-E328 VanDerWaalsContact CA-OE1 3.3Å; Q269-E328 WeakPolarHBondContact CA-OE1 3.35Å; Q269-E328 VanDerWaalsContact CB-OE1 3.28Å; Q269-E328 WeakPolarHBondContact CB-OE1 3.14Å; Q269-E328 PolarHBondContact N-OE1 2.88Å
270	R	86.3	Confident	91.1	Very high	101 Å²	101	55.2 Å²	55.2	38%	0.381	29%	0.291	S	S	.	.	S	Bend	trans	-138.5	98.3	-174.5	-65.7	-175.5	-169.2	91.5	5.5	110.9	E328 P329 Y334	R270-E328 HydrophobicContact CB-CG 4.27Å; R270-E328 PolarHBondContact N-OE1 3.33Å; R270-P329 HydrophobicContact CB-CG 4.14Å; R270-P329 VanDerWaalsContact O-CD 3.28Å; R270-P329 WeakPolarHBondContact O-CD 3.06Å; R270-Y334 HydrophobicContact CB-CD2 3.69Å; R270-Y334 HydrophobicContact CB-CE2 3.66Å; R270-Y334 HydrophobicContact CB-CG 4.14Å; R270-Y334 HydrophobicContact CG-CD1 4.21Å; R270-Y334 HydrophobicContact CG-CD2 4.2Å; R270-Y334 HydrophobicContact CG-CE1 4.28Å; R270-Y334 HydrophobicContact CG-CE2 4.24Å; R270-Y334 HydrophobicContact CG-CG 4.16Å
271	A	87.2	Confident	90.6	Very high	3 Å²	3	57.1 Å²	57.1	3%	0.025	30%	0.296	C	S	.	.			trans	-157.9	152.7	178	0	0	0	0	0	111.5	L268 I273 I282 F326	L268-A271 HydrophobicContact CB-CB 4.16Å; L268-A271 HydrophobicContact CD1-CB 3.74Å; A271-I273 HydrophobicContact CB-CG2 4.36Å; A271-I282 HydrophobicContact CB-CG2 4.48Å; A271-I282 PolarHBondContact O-N 3Å; A271-F326 HydrophobicContact CB-CE2 4.08Å; A271-F326 HydrophobicContact CB-CZ 3.77Å
272	R	88.7	Confident	90.1	Very high	57 Å²	57	55.6 Å²	55.6	22%	0.215	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124	159.5	-155.3	172.6	-171	163.3	-3.4	108.4	K279 I280 W281 Y299 S343 E344	R272-K279 HydrophobicContact CG-CB 4.36Å; R272-I280 WeakPolarHBondContact CA-O 3.45Å; R272-I280 WeakPolarHBondContact CG-O 3.45Å; R272-W281 HydrophobicContact CB-CD2 4.48Å; R272-W281 HydrophobicContact CB-CE3 4.09Å; R272-W281 HydrophobicContact CB-CZ3 4.19Å; R272-W281 HydrophobicContact CG-CD2 4.21Å; R272-W281 HydrophobicContact CG-CE3 4.32Å; R272-Y299 VanDerWaalsContact O-CD2 3.3Å; R272-Y299 WeakPolarHBondContact O-CD2 3.33Å; R272-S343 WeakPolarHBondContact CB-OG 3.45Å; R272-E344 WeakPolarHBondContact CD-OE1 3.28Å; R272-E344 IonicContact CZ-OE1 2.7Å; R272-E344 IonicContact CZ-OE2 2.85Å; R272-E344 IonicContact NE-OE1 2.79Å; R272-E344 IonicContact NH1-OE1 3.55Å; R272-E344 PolarHBondContact NH1-OE1 3.15Å; R272-E344 IonicContact NH1-OE2 3.46Å; R272-E344 PolarHBondContact NH1-OE2 3.1Å
273	I	91.6	Very high	89.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	155.8	-177.8	63.4	175	0	0	0	110	V266 A271 K279 I280 I282 F285 V296 S297 V298	V266-I273 HydrophobicContact CG1-CG2 4.32Å; V266-I273 HydrophobicContact CG2-CD1 4.49Å; A271-I273 HydrophobicContact CB-CG2 4.36Å; I273-K279 CarbonylContact O-C 3.56Å; I273-K279 WeakPolarHBondContact O-CA 3.34Å; I273-I280 HydrophobicContact CG1-CB 4.32Å; I273-I280 WeakPolarHBondContact CG1-O 3.19Å; I273-I280 PolarHBondContact N-O 3.15Å; I273-I280 PolarHBondContact O-N 2.87Å; I273-I282 HydrophobicContact CD1-CD1 4.29Å; I273-F285 HydrophobicContact CD1-CB 4.37Å; I273-F285 HydrophobicContact CD1-CD1 3.91Å; I273-F285 HydrophobicContact CD1-CD2 4.31Å; I273-F285 HydrophobicContact CD1-CE1 4.26Å; I273-F285 HydrophobicContact CD1-CG 3.94Å; I273-V296 HydrophobicContact CB-CG2 3.77Å; I273-V296 HydrophobicContact CD1-CG2 3.83Å; I273-V296 HydrophobicContact CG1-CG2 4.21Å; I273-V296 HydrophobicContact CG2-CG2 4.32Å; I273-S297 CarbonylContact C-O 3.58Å; I273-S297 WeakPolarHBondContact CA-O 3.26Å; I273-V298 HydrophobicContact CG2-CG1 4.39Å
274	L	92.3	Very high	89.4	Confident	44 Å²	44	63.6 Å²	63.6	23%	0.23	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	113	168.7	-176.1	66	0	0	0	108.4	K278 K279 V296 S297 Y299 A310	L274-K278 WeakPolarHBondContact CA-O 3.26Å; L274-K279 HydrophobicContact CD1-CG 4.35Å; L274-V296 WeakPolarHBondContact O-CA 3.47Å; L274-S297 PolarHBondContact N-O 2.79Å; L274-S297 PolarHBondContact O-N 3.43Å; L274-Y299 HydrophobicContact CB-CE2 4.06Å; L274-A310 HydrophobicContact CD2-CB 4.32Å
275	H	93.1	Very high	89.2	Confident	19 Å²	19	64.5 Å²	64.5	9%	0.088	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	130	175.7	-178.5	-133.2	0	0	0	108.5	G277 K278 I280 F285 E294 I295 V296	H275-G277 PolarHBondContact O-N 2.74Å; H275-G277 VanDerWaalsContact O-N 3.15Å; H275-K278 PolarHBondContact N-O 2.85Å; H275-K278 VanDerWaalsContact N-O 3.08Å; H275-K278 PolarHBondContact O-N 3.02Å; H275-I280 HydrophobicContact CB-CD1 4.42Å; H275-F285 AromaticContact CE1-CE2 3.93Å; H275-F285 AromaticContact CE1-CZ 3.95Å; H275-F285 AromaticContact ND1-CE2 3.39Å; H275-F285 WeakPolarHBondContact ND1-CE2 3.17Å; H275-F285 AromaticContact ND1-CZ 3.74Å; H275-E294 IonicContact CE1-OE2 3.54Å; H275-E294 IonicContact NE2-OE2 3.56Å; H275-E294 PolarHBondContact NE2-OE2 3.01Å; H275-I295 PolarHBondContact CD2-O 2.7Å; H275-V296 HydrophobicContact CB-CG2 4.33Å
276	N	89.1	Confident	88.9	Confident	120 Å²	120	69.6 Å²	69.6	64%	0.642	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	40.7	-176.9	-64.5	-24.1	0	0	0	113.9	K278	N276-K278 PolarHBondContact O-N 3.41Å
277	G	88.1	Confident	89	Confident	70 Å²	70	73.6 Å²	73.6	72%	0.722	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	2.2	178.8	0	0	0	0	0	115.4	H275	H275-G277 PolarHBondContact O-N 2.74Å; H275-G277 VanDerWaalsContact O-N 3.15Å
278	K	90.9	Very high	89.3	Confident	150 Å²	150	69.6 Å²	69.6	65%	0.652	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	134.6	179.5	-64.6	-178.4	-178	178.3	0	111	L274 H275 N276 I280	L274-K278 WeakPolarHBondContact CA-O 3.26Å; H275-K278 PolarHBondContact N-O 2.85Å; H275-K278 VanDerWaalsContact N-O 3.08Å; H275-K278 PolarHBondContact O-N 3.02Å; N276-K278 PolarHBondContact O-N 3.41Å; K278-I280 HydrophobicContact CB-CD1 4.3Å; K278-I280 HydrophobicContact CB-CG1 4.06Å; K278-I280 PolarHBondContact O-N 3.03Å
279	K	89.9	Confident	89.5	Confident	80 Å²	80	73.3 Å²	73.3	35%	0.348	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	108	170.7	-65.9	-170.2	-179	-175.1	0	109.4	R272 I273 L274 Y299 S343	R272-K279 HydrophobicContact CG-CB 4.36Å; I273-K279 CarbonylContact O-C 3.56Å; I273-K279 WeakPolarHBondContact O-CA 3.34Å; L274-K279 HydrophobicContact CD1-CG 4.35Å; K279-Y299 VanDerWaalsContact CE-OH 3.31Å; K279-Y299 WeakPolarHBondContact CE-OH 3.32Å; K279-Y299 WeakPolarHBondContact CG-OH 3.29Å; K279-S343 PolarHBondContact NZ-O 3.11Å
280	I	90.7	Very high	90	Very high	42 Å²	42	66.2 Å²	66.2	22%	0.215	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	136	-174.7	-52.3	173.3	0	0	0	108.8	R272 I273 H275 K278 F285	R272-I280 WeakPolarHBondContact CA-O 3.45Å; R272-I280 WeakPolarHBondContact CG-O 3.45Å; I273-I280 HydrophobicContact CG1-CB 4.32Å; I273-I280 WeakPolarHBondContact CG1-O 3.19Å; I273-I280 PolarHBondContact N-O 3.15Å; I273-I280 PolarHBondContact O-N 2.87Å; H275-I280 HydrophobicContact CB-CD1 4.42Å; K278-I280 HydrophobicContact CB-CD1 4.3Å; K278-I280 HydrophobicContact CB-CG1 4.06Å; K278-I280 PolarHBondContact O-N 3.03Å; I280-F285 HydrophobicContact CD1-CD2 4.29Å; I280-F285 HydrophobicContact CG2-CB 4.05Å; I280-F285 HydrophobicContact CG2-CD2 4.38Å
281	W	87.4	Confident	90.4	Very high	57 Å²	57	64.3 Å²	64.3	22%	0.216	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	136.2	169.6	-68.4	105.2	0	0	0	109.9	R272 E283 N284 F285 Y334 L341	R272-W281 HydrophobicContact CB-CD2 4.48Å; R272-W281 HydrophobicContact CB-CE3 4.09Å; R272-W281 HydrophobicContact CB-CZ3 4.19Å; R272-W281 HydrophobicContact CG-CD2 4.21Å; R272-W281 HydrophobicContact CG-CE3 4.32Å; W281-E283 HydrophobicContact CB-CG 3.98Å; W281-E283 PolarHBondContact O-N 3.22Å; W281-N284 HydrophobicContact CB-CB 4.43Å; W281-N284 CarbonylContact O-C 3.59Å; W281-N284 WeakPolarHBondContact O-CA 2.91Å; W281-N284 WeakPolarHBondContact O-CB 3.02Å; W281-N284 PolarHBondContact O-N 3.14Å; W281-F285 PolarHBondContact O-N 3.49Å; W281-F285 VanDerWaalsContact O-N 3.15Å; W281-Y334 HydrophobicContact CE3-CE2 4.06Å; W281-Y334 AromaticContact CE3-CZ 3.93Å; W281-Y334 VanDerWaalsContact CE3-OH 3.26Å; W281-Y334 HydrophobicContact CZ3-CD2 4.46Å; W281-Y334 AromaticContact CZ3-CE2 3.57Å; W281-Y334 HydrophobicContact CZ3-CE2 3.57Å; W281-Y334 AromaticContact CZ3-CZ 3.79Å; W281-L341 HydrophobicContact CH2-CD1 3.72Å; W281-L341 HydrophobicContact CZ3-CD1 3.96Å
282	I	88.3	Confident	90.9	Very high	10 Å²	10	64.7 Å²	64.7	5%	0.051	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-58.1	-34	-174.8	-168.4	59.8	0	0	0	113.1	V266 L268 Q269 A271 I273 N284 F285	V266-I282 HydrophobicContact CB-CD1 3.7Å; V266-I282 HydrophobicContact CG1-CD1 3.73Å; L268-I282 HydrophobicContact CB-CG1 4.41Å; L268-I282 WeakPolarHBondContact O-CG1 3.23Å; Q269-I282 WeakPolarHBondContact O-CG2 3.48Å; A271-I282 HydrophobicContact CB-CG2 4.48Å; A271-I282 PolarHBondContact O-N 3Å; I273-I282 HydrophobicContact CD1-CD1 4.29Å; I282-N284 PolarHBondContact O-N 3.47Å; I282-F285 HydrophobicContact CD1-CB 4.37Å; I282-F285 HydrophobicContact CD1-CD1 4.23Å; I282-F285 PolarHBondContact O-N 3.31Å; I282-F285 VanDerWaalsContact O-N 3.17Å
283	E	87.3	Confident	91.1	Very high	109 Å²	109	66 Å²	66	51%	0.509	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-61.6	-29.6	174	65.8	-168.6	-168.4	0	0	113.8	W281 Q286	W281-E283 HydrophobicContact CB-CG 3.98Å; W281-E283 PolarHBondContact O-N 3.22Å; E283-Q286 PolarHBondContact O-NE2 2.89Å
284	N	89.9	Confident	91.3	Very high	106 Å²	106	68.5 Å²	68.5	57%	0.567	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-95.3	-5	180	-66	-48	0	0	0	112.4	W281 I282 Q286	W281-N284 HydrophobicContact CB-CB 4.43Å; W281-N284 CarbonylContact O-C 3.59Å; W281-N284 WeakPolarHBondContact O-CA 2.91Å; W281-N284 WeakPolarHBondContact O-CB 3.02Å; W281-N284 PolarHBondContact O-N 3.14Å; I282-N284 PolarHBondContact O-N 3.47Å; N284-Q286 PolarHBondContact O-N 3.09Å; N284-Q286 VanDerWaalsContact O-N 3.11Å
285	F	91.7	Very high	91.4	Very high	20 Å²	20	70.6 Å²	70.6	9%	0.088	36%	0.362	C	S	.	.			trans	-84.7	80	178	-173	-121.2	0	0	0	110	V266 I273 H275 I280 W281 I282 P287 N288 R289 V290	V266-F285 HydrophobicContact CG2-CE1 4.12Å; I273-F285 HydrophobicContact CD1-CB 4.37Å; I273-F285 HydrophobicContact CD1-CD1 3.91Å; I273-F285 HydrophobicContact CD1-CD2 4.31Å; I273-F285 HydrophobicContact CD1-CE1 4.26Å; I273-F285 HydrophobicContact CD1-CG 3.94Å; H275-F285 AromaticContact CE1-CE2 3.93Å; H275-F285 AromaticContact CE1-CZ 3.95Å; H275-F285 AromaticContact ND1-CE2 3.39Å; H275-F285 WeakPolarHBondContact ND1-CE2 3.17Å; H275-F285 AromaticContact ND1-CZ 3.74Å; I280-F285 HydrophobicContact CD1-CD2 4.29Å; I280-F285 HydrophobicContact CG2-CB 4.05Å; I280-F285 HydrophobicContact CG2-CD2 4.38Å; W281-F285 PolarHBondContact O-N 3.49Å; W281-F285 VanDerWaalsContact O-N 3.15Å; I282-F285 HydrophobicContact CD1-CB 4.37Å; I282-F285 HydrophobicContact CD1-CD1 4.23Å; I282-F285 PolarHBondContact O-N 3.31Å; I282-F285 VanDerWaalsContact O-N 3.17Å; F285-P287 CarbonylContact O-C 3.3Å; F285-P287 VanDerWaalsContact O-C 3.3Å; F285-N288 VanDerWaalsContact O-CA 3.28Å; F285-N288 WeakPolarHBondContact O-CA 3.49Å; F285-N288 PolarHBondContact O-N 2.86Å; F285-N288 VanDerWaalsContact O-N 3.15Å; F285-R289 VanDerWaalsContact CZ-O 3.23Å; F285-R289 WeakPolarHBondContact CZ-O 3.35Å; F285-V290 HydrophobicContact CE1-CG2 3.89Å; F285-V290 HydrophobicContact CZ-CG2 3.92Å
286	Q	88.8	Confident	91.5	Very high	165 Å²	165	69.7 Å²	69.7	77%	0.771	36%	0.357	S	S	*	.	S	Bend	trans	-118.7	129	-177.4	-63.2	-166.8	24.4	0	0	112.5	E283 N284	E283-Q286 PolarHBondContact O-NE2 2.89Å; N284-Q286 PolarHBondContact O-N 3.09Å; N284-Q286 VanDerWaalsContact O-N 3.11Å
287	P	90.4	Very high	91.7	Very high	85 Å²	85	64.7 Å²	64.7	55%	0.552	33%	0.332	S	S	*	.	S	Bend	cis	-66.5	148.9	-6.9	29.8	-34.5	0	0	0	111.4	F285 R289	F285-P287 CarbonylContact O-C 3.3Å; F285-P287 VanDerWaalsContact O-C 3.3Å; P287-R289 HydrophobicContact CB-CB 4.27Å; P287-R289 HydrophobicContact CG-CB 4.16Å; P287-R289 PolarHBondContact O-N 3.42Å
288	N	90.6	Very high	92	Very high	54 Å²	54	61.4 Å²	61.4	29%	0.289	30%	0.297	S	S	.	.			trans	-70.5	77.4	175.7	-178.9	9.3	0	0	0	110.1	S265 V266 F285	S265-N288 WeakPolarHBondContact CB-O 3.38Å; S265-N288 PolarHBondContact OG-O 2.9Å; V266-N288 WeakPolarHBondContact CB-OD1 3.01Å; V266-N288 PolarHBondContact N-OD1 3.08Å; V266-N288 PolarHBondContact O-ND2 2.85Å; V266-N288 PolarHBondContact O-OD1 3.32Å; F285-N288 VanDerWaalsContact O-CA 3.28Å; F285-N288 WeakPolarHBondContact O-CA 3.49Å; F285-N288 PolarHBondContact O-N 2.86Å; F285-N288 VanDerWaalsContact O-N 3.15Å
289	R	93	Very high	92	Very high	99 Å²	99	54.8 Å²	54.8	37%	0.374	27%	0.268	S	S	.	.			trans	-147	122.1	-166.1	-176.9	-174.2	-68.4	170	-1.1	110.3	P237 P263 C264 F285 P287 L291	P237-R289 VanDerWaalsContact CB-CZ 3.42Å; P263-R289 HydrophobicContact CB-CG 3.84Å; P263-R289 HydrophobicContact CG-CG 4.27Å; C264-R289 CarbonylContact O-C 3.45Å; C264-R289 WeakPolarHBondContact O-CA 3.34Å; F285-R289 VanDerWaalsContact CZ-O 3.23Å; F285-R289 WeakPolarHBondContact CZ-O 3.35Å; P287-R289 HydrophobicContact CB-CB 4.27Å; P287-R289 HydrophobicContact CG-CB 4.16Å; P287-R289 PolarHBondContact O-N 3.42Å; R289-L291 HydrophobicContact CG-CD2 4.42Å
290	V	94.6	Very high	92	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-113.9	124	170.5	179.5	0	0	0	0	106.7	P263 C264 V266 F285 E294 V296 C315	P263-V290 CarbonylContact C-O 3.56Å; P263-V290 WeakPolarHBondContact CA-O 3.46Å; P263-V290 WeakPolarHBondContact CB-O 3.45Å; C264-V290 PolarHBondContact N-O 2.81Å; C264-V290 PolarHBondContact O-N 3.15Å; V266-V290 HydrophobicContact CG2-CG2 3.64Å; F285-V290 HydrophobicContact CE1-CG2 3.89Å; F285-V290 HydrophobicContact CZ-CG2 3.92Å; V290-E294 HydrophobicContact CG1-CB 3.6Å; V290-V296 HydrophobicContact CG2-CB 4.3Å; V290-V296 HydrophobicContact CG2-CG1 4.2Å; V290-C315 HydrophobicContact CB-CB 4.44Å; V290-C315 HydrophobicContact CG1-CB 3.92Å
291	L	95.6	Very high	91.9	Very high	61 Å²	61	51.3 Å²	51.3	32%	0.319	25%	0.253	S	S	.	.			trans	-70.1	158	-177.9	-60.7	-179.6	0	0	0	110.8	V239 P263 R289 L293 E294 C315	V239-L291 HydrophobicContact CG2-CB 3.87Å; V239-L291 HydrophobicContact CG2-CD1 4.48Å; V239-L291 HydrophobicContact CG2-CD2 4.31Å; V239-L291 HydrophobicContact CG2-CG 4.45Å; P263-L291 HydrophobicContact CB-CD2 4.28Å; R289-L291 HydrophobicContact CG-CD2 4.42Å; L291-L293 PolarHBondContact O-N 2.99Å; L291-E294 HydrophobicContact CB-CG 3.88Å; L291-E294 PolarHBondContact N-OE2 2.85Å; L291-E294 VanDerWaalsContact O-CB 3.27Å; L291-E294 WeakPolarHBondContact O-CB 3.33Å; L291-E294 PolarHBondContact O-N 3.28Å; L291-C315 WeakPolarHBondContact O-CB 3.4Å
292	H	96.3	Very high	92	Very high	11 Å²	11	50.9 Å²	50.9	5%	0.051	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	138.6	176.4	177.9	52.5	0	0	0	111.1	V239 E241 K261 E294 C315 D317	V239-H292 HydrophobicContact CB-CB 4.06Å; V239-H292 HydrophobicContact CG2-CB 4.23Å; E241-H292 IonicContact OE1-NE2 2.82Å; E241-H292 PolarHBondContact OE1-NE2 3.12Å; E241-H292 IonicContact OE2-NE2 3.95Å; K261-H292 HydrophobicContact CB-CB 3.8Å; K261-H292 WeakPolarHBondContact CB-CD2 3.28Å; K261-H292 VanDerWaalsContact CG-CD2 3.49Å; K261-H292 WeakPolarHBondContact CG-CD2 3.27Å; H292-E294 PolarHBondContact O-N 3.24Å; H292-E294 VanDerWaalsContact O-N 3.14Å; H292-C315 PolarHBondContact ND1-O 3.48Å; H292-D317 PolarHBondContact ND1-N 3.09Å
293	L	94.8	Very high	91.8	Very high	83 Å²	83	57 Å²	57	44%	0.435	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	-6.4	-172.3	-54.7	176.4	0	0	0	116	L291 Q314 C315 I316	L291-L293 PolarHBondContact O-N 2.99Å; L293-Q314 PolarHBondContact O-NE2 2.83Å; L293-C315 PolarHBondContact N-O 3.19Å; L293-I316 HydrophobicContact CD2-CD1 4.08Å
294	E	95.1	Very high	91.9	Very high	54 Å²	54	56.4 Å²	56.4	25%	0.252	30%	0.297	S	S	.	.			trans	-67.2	148.6	167.7	-71	-174.4	168	0	0	110.9	H275 V290 L291 H292 C315	H275-E294 IonicContact CE1-OE2 3.54Å; H275-E294 IonicContact NE2-OE2 3.56Å; H275-E294 PolarHBondContact NE2-OE2 3.01Å; V290-E294 HydrophobicContact CG1-CB 3.6Å; L291-E294 HydrophobicContact CB-CG 3.88Å; L291-E294 PolarHBondContact N-OE2 2.85Å; L291-E294 VanDerWaalsContact O-CB 3.27Å; L291-E294 WeakPolarHBondContact O-CB 3.33Å; L291-E294 PolarHBondContact O-N 3.28Å; H292-E294 PolarHBondContact O-N 3.24Å; H292-E294 VanDerWaalsContact O-N 3.14Å; E294-C315 PolarHBondContact O-N 2.03Å
295	I	94.1	Very high	91.7	Very high	88 Å²	88	60.3 Å²	60.3	45%	0.451	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	131.8	-179.5	-64.7	168.4	0	0	0	108.7	H275 P312 T313 Q314	H275-I295 PolarHBondContact CD2-O 2.7Å; I295-P312 HydrophobicContact CG2-CB 3.61Å; I295-T313 WeakPolarHBondContact CA-O 3.48Å; I295-Q314 HydrophobicContact CG1-CB 4.23Å; I295-Q314 HydrophobicContact CG1-CG 4.16Å
296	V	94.9	Very high	91.4	Very high	0 Å²	0	67 Å²	67	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	136	167.1	61.4	0	0	0	0	108.1	V266 I273 L274 H275 V290 T313 L320	V266-V296 HydrophobicContact CG2-CG1 4.33Å; I273-V296 HydrophobicContact CB-CG2 3.77Å; I273-V296 HydrophobicContact CD1-CG2 3.83Å; I273-V296 HydrophobicContact CG1-CG2 4.21Å; I273-V296 HydrophobicContact CG2-CG2 4.32Å; L274-V296 WeakPolarHBondContact O-CA 3.47Å; H275-V296 HydrophobicContact CB-CG2 4.33Å; V290-V296 HydrophobicContact CG2-CB 4.3Å; V290-V296 HydrophobicContact CG2-CG1 4.2Å; V296-T313 HydrophobicContact CG1-CG2 3.88Å; V296-T313 PolarHBondContact N-O 3.01Å; V296-T313 WeakPolarHBondContact O-CG2 3.34Å; V296-T313 PolarHBondContact O-N 2.92Å; V296-L320 HydrophobicContact CG1-CD1 3.87Å; V296-L320 HydrophobicContact CG1-CD2 3.63Å; V296-L320 HydrophobicContact CG1-CG 4.31Å
297	S	94.6	Very high	91.3	Very high	15 Å²	15	59.7 Å²	59.7	11%	0.105	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	137.3	175.6	-42.3	0	0	0	0	110.8	I273 L274 V311 P312	I273-S297 CarbonylContact C-O 3.58Å; I273-S297 WeakPolarHBondContact CA-O 3.26Å; L274-S297 PolarHBondContact N-O 2.79Å; L274-S297 PolarHBondContact O-N 3.43Å; S297-V311 VanDerWaalsContact CA-O 3.24Å; S297-V311 WeakPolarHBondContact CA-O 3.35Å; S297-V311 WeakPolarHBondContact CB-O 3.33Å; S297-P312 WeakPolarHBondContact OG-CA 3.33Å
298	V	92.8	Very high	91.2	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	156.5	167.3	-61	0	0	0	0	109	L268 I273 A310 V311 I322 P323 F326	L268-V298 HydrophobicContact CD1-CG1 4.11Å; I273-V298 HydrophobicContact CG2-CG1 4.39Å; V298-A310 CarbonylContact O-C 3.59Å; V298-A310 WeakPolarHBondContact O-CA 3.25Å; V298-V311 PolarHBondContact N-O 2.89Å; V298-V311 PolarHBondContact O-N 2.86Å; V298-I322 HydrophobicContact CG1-CD1 4.36Å; V298-I322 HydrophobicContact CG2-CG2 4.46Å; V298-P323 HydrophobicContact CG2-CB 4.25Å; V298-P323 HydrophobicContact CG2-CG 3.68Å; V298-F326 HydrophobicContact CB-CD2 3.8Å; V298-F326 HydrophobicContact CB-CE2 4.4Å; V298-F326 HydrophobicContact CB-CG 4.27Å; V298-F326 HydrophobicContact CG1-CD2 4.46Å; V298-F326 HydrophobicContact CG2-CB 3.9Å; V298-F326 HydrophobicContact CG2-CD2 4.11Å; V298-F326 HydrophobicContact CG2-CG 4.19Å
299	Y	91.6	Very high	91.2	Very high	11 Å²	11	57.1 Å²	57.1	4%	0.043	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	128.9	-179.4	-68.9	-98.3	0	0	0	110.4	R272 L274 K279 Y309 A310	R272-Y299 VanDerWaalsContact O-CD2 3.3Å; R272-Y299 WeakPolarHBondContact O-CD2 3.33Å; L274-Y299 HydrophobicContact CB-CE2 4.06Å; K279-Y299 VanDerWaalsContact CE-OH 3.31Å; K279-Y299 WeakPolarHBondContact CE-OH 3.32Å; K279-Y299 WeakPolarHBondContact CG-OH 3.29Å; Y299-Y309 WeakPolarHBondContact CA-O 3.48Å; Y299-A310 HydrophobicContact CD1-CB 4.17Å; Y299-A310 HydrophobicContact CE1-CB 3.89Å
300	C	90.8	Very high	91.2	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.007	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	152.4	173	-66	0	0	0	0	110	G308 Y309 V311 C325 F326	C300-G308 WeakPolarHBondContact O-CA 3.43Å; C300-Y309 HydrophobicContact CB-CE1 4.02Å; C300-Y309 HydrophobicContact CB-CE2 3.91Å; C300-Y309 PolarHBondContact N-O 3.3Å; C300-Y309 WeakPolarHBondContact O-CD1 3.39Å; C300-Y309 PolarHBondContact O-N 2.86Å; C300-V311 HydrophobicContact CB-CG2 4.12Å; C300-C325 HydrophobicContact CB-CB 3.68Å; C300-C325 WeakPolarHBondContact CB-SG 2.94Å; C300-C325 WeakPolarHBondContact SG-CB 3.25Å; C300-C325 PolarHBondContact SG-O 2.88Å; C300-C325 CovalentContact SG-SG 2.05Å; C300-C325 PolarHBondContact SG-SG 2.96Å; C300-F326 PolarHBondContact SG-N 2.83Å; C300-F326 VanDerWaalsContact SG-N 3.39Å
301	M	88.4	Confident	91.1	Very high	48 Å²	48	55.9 Å²	55.9	24%	0.236	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	138.9	178	-166.6	52.5	168.7	0	0	110.9	E303 K306 P342 I345	M301-E303 WeakPolarHBondContact CG-OE1 3.44Å; M301-K306 HydrophobicContact CE-CB 4.37Å; M301-P342 HydrophobicContact CB-CB 4.26Å; M301-P342 HydrophobicContact CB-CG 3.73Å; M301-P342 HydrophobicContact CG-CG 4.35Å; M301-P342 HydrophobicContact SD-CB 4.36Å; M301-P342 HydrophobicContact SD-CG 4.26Å; M301-I345 HydrophobicContact CE-CD1 3.53Å; M301-I345 HydrophobicContact SD-CD1 3.79Å
302	N	88.6	Confident	91.1	Very high	48 Å²	48	56.9 Å²	56.9	26%	0.257	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	98.1	162.9	-172.4	-38.5	0	0	0	109	A304 R305 K306 C307 Y309	N302-A304 VanDerWaalsContact C-N 3.25Å; N302-A304 PolarHBondContact O-N 3.35Å; N302-A304 PolarHBondContact OD1-N 3.02Å; N302-R305 HydrophobicContact CB-CB 4.46Å; N302-R305 PolarHBondContact O-N 2.03Å; N302-R305 PolarHBondContact OD1-N 3Å; N302-K306 WeakPolarHBondContact O-CA 3.49Å; N302-K306 PolarHBondContact O-N 3.36Å; N302-C307 WeakPolarHBondContact CB-O 3.28Å; N302-C307 PolarHBondContact N-O 2.74Å; N302-C307 PolarHBondContact O-N 2.95Å; N302-Y309 HydrophobicContact CB-CD1 4.19Å; N302-Y309 HydrophobicContact CB-CE1 4Å
303	E	84.9	Confident	91	Very high	139 Å²	139	57 Å²	57	65%	0.65	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-34.1	-177.3	-65.4	-55.8	139.6	0	0	113.6	M301	M301-E303 WeakPolarHBondContact CG-OE1 3.44Å
304	A	88.5	Confident	91	Very high	96 Å²	96	56.9 Å²	56.9	79%	0.793	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-35.5	-178.6	0	0	0	0	0	112.5	N302	N302-A304 VanDerWaalsContact C-N 3.25Å; N302-A304 PolarHBondContact O-N 3.35Å; N302-A304 PolarHBondContact OD1-N 3.02Å
305	R	85.8	Confident	91.1	Very high	188 Å²	188	54.3 Å²	54.3	71%	0.709	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-8.6	-177.5	-66.7	-175.2	178.2	-175.6	-0.3	113.6	N302 C307	N302-R305 HydrophobicContact CB-CB 4.46Å; N302-R305 PolarHBondContact O-N 2.03Å; N302-R305 PolarHBondContact OD1-N 3Å; R305-C307 VanDerWaalsContact C-N 3.26Å; R305-C307 WeakPolarHBondContact CB-SG 3.26Å; R305-C307 PolarHBondContact O-N 3.28Å
306	K	85.3	Confident	91.2	Very high	161 Å²	161	53.9 Å²	53.9	70%	0.7	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	45.8	-173.3	-57.9	-174.8	177.9	-176.4	0	112.3	M301 N302 I345	M301-K306 HydrophobicContact CE-CB 4.37Å; N302-K306 WeakPolarHBondContact O-CA 3.49Å; N302-K306 PolarHBondContact O-N 3.36Å; K306-I345 WeakPolarHBondContact O-CG2 3.06Å
307	C	86.9	Confident	91.2	Very high	12 Å²	12	57.1 Å²	57.1	8%	0.081	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	153.4	179.2	60.1	0	0	0	0	110.7	N302 R305 D346 C348	N302-C307 WeakPolarHBondContact CB-O 3.28Å; N302-C307 PolarHBondContact N-O 2.74Å; N302-C307 PolarHBondContact O-N 2.95Å; R305-C307 VanDerWaalsContact C-N 3.26Å; R305-C307 WeakPolarHBondContact CB-SG 3.26Å; R305-C307 PolarHBondContact O-N 3.28Å; C307-D346 VanDerWaalsContact CA-O 3.28Å; C307-D346 WeakPolarHBondContact CA-O 3.4Å; C307-D346 WeakPolarHBondContact CB-O 3.01Å; C307-C348 HydrophobicContact CB-CB 4.07Å; C307-C348 WeakPolarHBondContact CB-SG 3.37Å; C307-C348 PolarHBondContact O-SG 3.45Å; C307-C348 VanDerWaalsContact O-SG 3.33Å; C307-C348 VanDerWaalsContact SG-CA 3.59Å; C307-C348 WeakPolarHBondContact SG-CB 3.24Å; C307-C348 CovalentContact SG-SG 2.02Å; C307-C348 PolarHBondContact SG-SG 2.81Å
308	G	88	Confident	91.2	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.01	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	146.1	179	0	0	0	0	0	113	C300 P342 D346 Q347 C348	C300-G308 WeakPolarHBondContact O-CA 3.43Å; G308-P342 WeakPolarHBondContact CA-O 3.41Å; G308-D346 PolarHBondContact N-O 3.05Å; G308-D346 VanDerWaalsContact N-O 3.09Å; G308-Q347 WeakPolarHBondContact O-CA 3.46Å; G308-C348 PolarHBondContact O-N 2.81Å; G308-C348 VanDerWaalsContact O-N 3.08Å
309	Y	90.8	Very high	91.3	Very high	84 Å²	84	61.7 Å²	61.7	33%	0.329	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	145.2	176.1	62	-81.6	0	0	0	111.3	Y299 C300 N302 V311	Y299-Y309 WeakPolarHBondContact CA-O 3.48Å; C300-Y309 HydrophobicContact CB-CE1 4.02Å; C300-Y309 HydrophobicContact CB-CE2 3.91Å; C300-Y309 PolarHBondContact N-O 3.3Å; C300-Y309 WeakPolarHBondContact O-CD1 3.39Å; C300-Y309 PolarHBondContact O-N 2.86Å; N302-Y309 HydrophobicContact CB-CD1 4.19Å; N302-Y309 HydrophobicContact CB-CE1 4Å; Y309-V311 HydrophobicContact CD2-CG2 3.68Å; Y309-V311 HydrophobicContact CE2-CG2 3.42Å; Y309-V311 VanDerWaalsContact CE2-CG2 3.42Å
310	A	92.2	Very high	91.4	Very high	39 Å²	39	62.2 Å²	62.2	32%	0.322	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	127.1	-178.6	0	0	0	0	0	110.7	L274 V298 Y299	L274-A310 HydrophobicContact CD2-CB 4.32Å; V298-A310 CarbonylContact O-C 3.59Å; V298-A310 WeakPolarHBondContact O-CA 3.25Å; Y299-A310 HydrophobicContact CD1-CB 4.17Å; Y299-A310 HydrophobicContact CE1-CB 3.89Å
311	V	94.3	Very high	91.5	Very high	34 Å²	34	67.8 Å²	67.8	21%	0.206	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	114.8	175.4	-175.1	0	0	0	0	108.9	S297 V298 C300 Y309 P323	S297-V311 VanDerWaalsContact CA-O 3.24Å; S297-V311 WeakPolarHBondContact CA-O 3.35Å; S297-V311 WeakPolarHBondContact CB-O 3.33Å; V298-V311 PolarHBondContact N-O 2.89Å; V298-V311 PolarHBondContact O-N 2.86Å; C300-V311 HydrophobicContact CB-CG2 4.12Å; Y309-V311 HydrophobicContact CD2-CG2 3.68Å; Y309-V311 HydrophobicContact CE2-CG2 3.42Å; Y309-V311 VanDerWaalsContact CE2-CG2 3.42Å; V311-P323 HydrophobicContact CB-CB 4.27Å; V311-P323 HydrophobicContact CB-CG 3.94Å; V311-P323 HydrophobicContact CG1-CB 3.85Å; V311-P323 HydrophobicContact CG1-CG 3.52Å
312	P	94.8	Very high	91.7	Very high	82 Å²	82	68 Å²	68	53%	0.532	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	142.1	-179.6	29.9	-33.7	0	0	0	111.4	I295 S297	I295-P312 HydrophobicContact CG2-CB 3.61Å; S297-P312 WeakPolarHBondContact OG-CA 3.33Å
313	T	93.7	Very high	91.9	Very high	13 Å²	13	66.9 Å²	66.9	8%	0.08	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	144.6	164.7	172.3	0	0	0	0	109.2	I295 V296 L320 N321	I295-T313 WeakPolarHBondContact CA-O 3.48Å; V296-T313 HydrophobicContact CG1-CG2 3.88Å; V296-T313 PolarHBondContact N-O 3.01Å; V296-T313 WeakPolarHBondContact O-CG2 3.34Å; V296-T313 PolarHBondContact O-N 2.92Å; T313-L320 HydrophobicContact CG2-CD1 3.84Å; T313-L320 HydrophobicContact CG2-CD2 4.45Å; T313-L320 HydrophobicContact CG2-CG 4.05Å; T313-N321 WeakPolarHBondContact CB-O 3.44Å; T313-N321 PolarHBondContact OG1-O 3.03Å
314	Q	95.2	Very high	92.2	Very high	81 Å²	81	70.5 Å²	70.5	38%	0.379	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	140.8	-177.8	-169.9	173.8	36.9	0	0	110.6	L293 I295 I316	L293-Q314 PolarHBondContact O-NE2 2.83Å; I295-Q314 HydrophobicContact CG1-CB 4.23Å; I295-Q314 HydrophobicContact CG1-CG 4.16Å; Q314-I316 HydrophobicContact CB-CD1 4.4Å; Q314-I316 HydrophobicContact CG-CD1 3.96Å; Q314-I316 PolarHBondContact O-N 3.03Å
315	C	96.2	Very high	92.3	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	114.6	172.4	174.2	0	0	0	0	111	C264 V290 L291 H292 L293 E294 L320	C264-C315 HydrophobicContact CB-CB 3.74Å; C264-C315 WeakPolarHBondContact CB-SG 3.23Å; C264-C315 PolarHBondContact N-SG 2.81Å; C264-C315 WeakPolarHBondContact SG-CA 3.38Å; C264-C315 WeakPolarHBondContact SG-CB 3.39Å; C264-C315 CovalentContact SG-SG 2.03Å; C264-C315 PolarHBondContact SG-SG 2.67Å; V290-C315 HydrophobicContact CB-CB 4.44Å; V290-C315 HydrophobicContact CG1-CB 3.92Å; L291-C315 WeakPolarHBondContact O-CB 3.4Å; H292-C315 PolarHBondContact ND1-O 3.48Å; L293-C315 PolarHBondContact N-O 3.19Å; E294-C315 PolarHBondContact O-N 2.03Å; C315-L320 HydrophobicContact CB-CD1 4.24Å
316	I	96.4	Very high	92.5	Very high	78 Å²	78	61 Å²	61	40%	0.4	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	103.8	177.7	-54.4	-60.9	0	0	0	108.4	L293 Q314 G318 T319	L293-I316 HydrophobicContact CD2-CD1 4.08Å; Q314-I316 HydrophobicContact CB-CD1 4.4Å; Q314-I316 HydrophobicContact CG-CD1 3.96Å; Q314-I316 PolarHBondContact O-N 3.03Å; I316-G318 PolarHBondContact O-N 3.46Å; I316-T319 PolarHBondContact N-O 2.68Å; I316-T319 WeakPolarHBondContact O-CA 3.5Å; I316-T319 VanDerWaalsContact O-CB 3.32Å; I316-T319 WeakPolarHBondContact O-CB 3.44Å; I316-T319 PolarHBondContact O-N 2.82Å
317	D	95.9	Very high	92.5	Very high	68 Å²	68	61 Å²	61	36%	0.364	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.2	63.8	174.1	-154.2	5.3	0	0	0	114.2	K261 A262 H292 T319	K261-D317 WeakPolarHBondContact CA-OD1 3.39Å; K261-D317 HydrophobicContact CD-CB 3.83Å; K261-D317 WeakPolarHBondContact CD-OD1 3.48Å; K261-D317 WeakPolarHBondContact CD-OD2 3.39Å; K261-D317 IonicContact NZ-OD2 3.94Å; K261-D317 PolarHBondContact NZ-OD2 2.83Å; A262-D317 PolarHBondContact N-OD1 2.81Å; H292-D317 PolarHBondContact ND1-N 3.09Å; D317-T319 PolarHBondContact O-N 3.03Å; D317-T319 VanDerWaalsContact O-N 3.14Å
318	G	94.4	Very high	92.4	Very high	38 Å²	38	64.8 Å²	64.8	39%	0.392	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	-8.4	-179.2	0	0	0	0	0	115.3	A262 P263 I316	A262-G318 PolarHBondContact O-N 2.79Å; P263-G318 WeakPolarHBondContact O-CA 3.36Å; I316-G318 PolarHBondContact O-N 3.46Å
319	T	94.5	Very high	92	Very high	74 Å²	74	65.8 Å²	65.8	45%	0.454	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123.3	179.8	-52.7	0	0	0	0	111.4	C264 I316 D317	C264-T319 PolarHBondContact SG-N 2.93Å; C264-T319 VanDerWaalsContact SG-N 3.37Å; C264-T319 PolarHBondContact SG-O 2.99Å; I316-T319 PolarHBondContact N-O 2.68Å; I316-T319 WeakPolarHBondContact O-CA 3.5Å; I316-T319 VanDerWaalsContact O-CB 3.32Å; I316-T319 WeakPolarHBondContact O-CB 3.44Å; I316-T319 PolarHBondContact O-N 2.82Å; D317-T319 PolarHBondContact O-N 3.03Å; D317-T319 VanDerWaalsContact O-N 3.14Å
320	L	94.4	Very high	91.4	Very high	22 Å²	22	64.4 Å²	64.4	12%	0.115	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	109.6	171.8	-172.1	74	0	0	0	109.7	C264 V266 V296 T313 C315 I322	C264-L320 HydrophobicContact CB-CB 3.73Å; V266-L320 HydrophobicContact CB-CD2 4.3Å; V266-L320 HydrophobicContact CG1-CD2 4.49Å; V266-L320 HydrophobicContact CG2-CD2 3.73Å; V296-L320 HydrophobicContact CG1-CD1 3.87Å; V296-L320 HydrophobicContact CG1-CD2 3.63Å; V296-L320 HydrophobicContact CG1-CG 4.31Å; T313-L320 HydrophobicContact CG2-CD1 3.84Å; T313-L320 HydrophobicContact CG2-CD2 4.45Å; T313-L320 HydrophobicContact CG2-CG 4.05Å; C315-L320 HydrophobicContact CB-CD1 4.24Å; L320-I322 HydrophobicContact CD2-CD1 4.04Å; L320-I322 HydrophobicContact CG-CD1 4.33Å; L320-I322 PolarHBondContact O-N 3.42Å
321	N	92.5	Very high	90.3	Very high	117 Å²	117	63.9 Å²	63.9	63%	0.626	35%	0.353	S	S	*	.			trans	-86	97.6	-175.8	-68.7	-46.8	0	0	0	110.8	T313 P323	T313-N321 WeakPolarHBondContact CB-O 3.44Å; T313-N321 PolarHBondContact OG1-O 3.03Å; N321-P323 WeakPolarHBondContact O-CD 3.19Å
322	I	91.6	Very high	89	Confident	54 Å²	54	67 Å²	67	28%	0.277	37%	0.372	S	S	.	.			trans	-62.4	127	176.2	-55.1	-56.6	0	0	0	109.7	L268 V298 L320 K324 F326	L268-I322 HydrophobicContact CD1-CD1 4.27Å; L268-I322 HydrophobicContact CD2-CG1 4.34Å; V298-I322 HydrophobicContact CG1-CD1 4.36Å; V298-I322 HydrophobicContact CG2-CG2 4.46Å; L320-I322 HydrophobicContact CD2-CD1 4.04Å; L320-I322 HydrophobicContact CG-CD1 4.33Å; L320-I322 PolarHBondContact O-N 3.42Å; I322-K324 PolarHBondContact O-N 3.4Å; I322-F326 HydrophobicContact CG2-CB 3.9Å; I322-F326 HydrophobicContact CG2-CD1 3.76Å; I322-F326 HydrophobicContact CG2-CG 4Å
323	P	92.7	Very high	87.6	Confident	23 Å²	23	67.7 Å²	67.7	15%	0.149	37%	0.368	C	S	.	.			trans	-52.3	137	177	-29.6	34.2	0	0	0	113.1	V298 V311 N321 C325 F326	V298-P323 HydrophobicContact CG2-CB 4.25Å; V298-P323 HydrophobicContact CG2-CG 3.68Å; V311-P323 HydrophobicContact CB-CB 4.27Å; V311-P323 HydrophobicContact CB-CG 3.94Å; V311-P323 HydrophobicContact CG1-CB 3.85Å; V311-P323 HydrophobicContact CG1-CG 3.52Å; N321-P323 WeakPolarHBondContact O-CD 3.19Å; P323-C325 PolarHBondContact O-N 2.93Å; P323-C325 VanDerWaalsContact O-N 3.1Å; P323-F326 WeakPolarHBondContact O-CB 3.27Å; P323-F326 PolarHBondContact O-N 3.28Å
324	K	91.5	Very high	86.2	Confident	216 Å²	216	68.6 Å²	68.6	94%	0.939	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-21.8	179.8	-65.2	-177.3	179.5	179.8	0	114.4	I322	I322-K324 PolarHBondContact O-N 3.4Å
325	C	90.8	Very high	84.7	Confident	52 Å²	52	69.8 Å²	69.8	35%	0.351	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-11.4	177.1	60.3	0	0	0	0	113.5	C300 P323 E327	C300-C325 HydrophobicContact CB-CB 3.68Å; C300-C325 WeakPolarHBondContact CB-SG 2.94Å; C300-C325 WeakPolarHBondContact SG-CB 3.25Å; C300-C325 PolarHBondContact SG-O 2.88Å; C300-C325 CovalentContact SG-SG 2.05Å; C300-C325 PolarHBondContact SG-SG 2.96Å; P323-C325 PolarHBondContact O-N 2.93Å; P323-C325 VanDerWaalsContact O-N 3.1Å; C325-E327 PolarHBondContact O-N 2.73Å
326	F	90.3	Very high	83	Confident	31 Å²	31	75.9 Å²	75.9	14%	0.136	42%	0.415	C	S	.	.			trans	-78	123.3	176.3	175.7	-95.5	0	0	0	109	L268 A271 V298 C300 I322 P323 E328	L268-F326 HydrophobicContact CD1-CD1 4.45Å; L268-F326 HydrophobicContact CD1-CE1 3.85Å; L268-F326 HydrophobicContact CD1-CE2 4.49Å; L268-F326 HydrophobicContact CD1-CZ 3.87Å; L268-F326 HydrophobicContact CD2-CD1 4.21Å; L268-F326 HydrophobicContact CD2-CE1 3.61Å; L268-F326 HydrophobicContact CD2-CZ 4.35Å; L268-F326 HydrophobicContact CG-CE1 4.33Å; A271-F326 HydrophobicContact CB-CE2 4.08Å; A271-F326 HydrophobicContact CB-CZ 3.77Å; V298-F326 HydrophobicContact CB-CD2 3.8Å; V298-F326 HydrophobicContact CB-CE2 4.4Å; V298-F326 HydrophobicContact CB-CG 4.27Å; V298-F326 HydrophobicContact CG1-CD2 4.46Å; V298-F326 HydrophobicContact CG2-CB 3.9Å; V298-F326 HydrophobicContact CG2-CD2 4.11Å; V298-F326 HydrophobicContact CG2-CG 4.19Å; C300-F326 PolarHBondContact SG-N 2.83Å; C300-F326 VanDerWaalsContact SG-N 3.39Å; I322-F326 HydrophobicContact CG2-CB 3.9Å; I322-F326 HydrophobicContact CG2-CD1 3.76Å; I322-F326 HydrophobicContact CG2-CG 4Å; P323-F326 WeakPolarHBondContact O-CB 3.27Å; P323-F326 PolarHBondContact O-N 3.28Å; F326-E328 HydrophobicContact CE1-CB 4.02Å; F326-E328 HydrophobicContact CZ-CB 4.48Å
327	E	85.6	Confident	81.5	Confident	163 Å²	163	78.2 Å²	78.2	76%	0.762	42%	0.422	S	S	*	.			trans	-112.5	124.6	173.5	-64.8	-175.2	178.7	0	0	108.3	C325 P329	C325-E327 PolarHBondContact O-N 2.73Å; E327-P329 WeakPolarHBondContact O-CD 3.21Å
328	E	84.1	Confident	79.8	Confident	90 Å²	90	77.9 Å²	77.9	42%	0.421	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-73.1	120.1	179.8	-172.2	166.2	-144	0	0	109.9	Q269 R270 F326	Q269-E328 VanDerWaalsContact CA-OE1 3.3Å; Q269-E328 WeakPolarHBondContact CA-OE1 3.35Å; Q269-E328 VanDerWaalsContact CB-OE1 3.28Å; Q269-E328 WeakPolarHBondContact CB-OE1 3.14Å; Q269-E328 PolarHBondContact N-OE1 2.88Å; R270-E328 HydrophobicContact CB-CG 4.27Å; R270-E328 PolarHBondContact N-OE1 3.33Å; F326-E328 HydrophobicContact CE1-CB 4.02Å; F326-E328 HydrophobicContact CZ-CB 4.48Å
329	P	80.8	Confident	78.4	Confident	22 Å²	22	82.5 Å²	82.5	14%	0.143	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-64.1	144.5	-176.7	25.2	-35.3	0	0	0	111.9	R270 E327 Y334 L341	R270-P329 HydrophobicContact CB-CG 4.14Å; R270-P329 VanDerWaalsContact O-CD 3.28Å; R270-P329 WeakPolarHBondContact O-CD 3.06Å; E327-P329 WeakPolarHBondContact O-CD 3.21Å; P329-Y334 HydrophobicContact CG-CD2 3.8Å; P329-L341 HydrophobicContact CB-CD2 3.6Å; P329-L341 HydrophobicContact CG-CD2 3.74Å
330	S	76.7	Confident	77.1	Confident	55 Å²	55	81.6 Å²	81.6	39%	0.385	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-61.3	148.7	173.4	70.2	0	0	0	0	110.8	V332 E333 Y334	S330-V332 PolarHBondContact O-N 2.84Å; S330-V332 VanDerWaalsContact O-N 3.09Å; S330-E333 PolarHBondContact O-N 3.12Å; S330-E333 WeakPolarHBondContact OG-CB 3.42Å; S330-E333 WeakPolarHBondContact OG-CG 3.34Å; S330-E333 PolarHBondContact OG-N 3.26Å; S330-E333 PolarHBondContact OG-OE2 2.86Å; S330-Y334 VanDerWaalsContact O-CB 3.23Å; S330-Y334 WeakPolarHBondContact O-CB 3.4Å; S330-Y334 PolarHBondContact O-N 2.83Å
331	G	70.2	Confident	76.1	Confident	29 Å²	29	81.1 Å²	81.1	30%	0.299	43%	0.434	S	S	.	.	H	α-helix	trans	-57.5	-29.6	-178.3	0	0	0	0	0	113.9	T335	G331-T335 PolarHBondContact O-N 2.88Å; G331-T335 PolarHBondContact O-OG1 3.06Å
332	V	66.7	Low	75.4	Confident	99 Å²	99	77.2 Å²	77.2	60%	0.6	41%	0.414	S	S	*	.	H	α-helix	trans	-76.7	-45.9	179.4	-179.1	0	0	0	0	111.5	S330 Y334 T335 L336	S330-V332 PolarHBondContact O-N 2.84Å; S330-V332 VanDerWaalsContact O-N 3.09Å; V332-Y334 VanDerWaalsContact C-N 3.29Å; V332-Y334 PolarHBondContact O-N 2.78Å; V332-T335 PolarHBondContact O-N 3.48Å; V332-L336 HydrophobicContact CG1-CD1 3.76Å; V332-L336 WeakPolarHBondContact O-CB 3.33Å; V332-L336 PolarHBondContact O-N 3.4Å
333	E	65.8	Low	74.7	Confident	97 Å²	97	74.9 Å²	74.9	45%	0.453	40%	0.403	S	S	.	.	H	α-helix	trans	-65.1	-37.8	174.5	-74.4	169.9	145.6	0	0	111.4	S330 T335 K337	S330-E333 PolarHBondContact O-N 3.12Å; S330-E333 WeakPolarHBondContact OG-CB 3.42Å; S330-E333 WeakPolarHBondContact OG-CG 3.34Å; S330-E333 PolarHBondContact OG-N 3.26Å; S330-E333 PolarHBondContact OG-OE2 2.86Å; E333-T335 VanDerWaalsContact C-N 3.33Å; E333-T335 PolarHBondContact O-N 2.87Å; E333-K337 CarbonylContact O-C 3.54Å; E333-K337 PolarHBondContact O-N 2.9Å
334	Y	64.4	Low	74	Confident	32 Å²	32	76.6 Å²	76.6	13%	0.125	41%	0.409	C	S	.	.	H	α-helix	trans	-62	-36.4	178.3	-172.2	-98.1	0	0	0	113.1	R270 W281 P329 S330 V332 L341	R270-Y334 HydrophobicContact CB-CD2 3.69Å; R270-Y334 HydrophobicContact CB-CE2 3.66Å; R270-Y334 HydrophobicContact CB-CG 4.14Å; R270-Y334 HydrophobicContact CG-CD1 4.21Å; R270-Y334 HydrophobicContact CG-CD2 4.2Å; R270-Y334 HydrophobicContact CG-CE1 4.28Å; R270-Y334 HydrophobicContact CG-CE2 4.24Å; R270-Y334 HydrophobicContact CG-CG 4.16Å; W281-Y334 HydrophobicContact CE3-CE2 4.06Å; W281-Y334 AromaticContact CE3-CZ 3.93Å; W281-Y334 VanDerWaalsContact CE3-OH 3.26Å; W281-Y334 HydrophobicContact CZ3-CD2 4.46Å; W281-Y334 AromaticContact CZ3-CE2 3.57Å; W281-Y334 HydrophobicContact CZ3-CE2 3.57Å; W281-Y334 AromaticContact CZ3-CZ 3.79Å; P329-Y334 HydrophobicContact CG-CD2 3.8Å; S330-Y334 VanDerWaalsContact O-CB 3.23Å; S330-Y334 WeakPolarHBondContact O-CB 3.4Å; S330-Y334 PolarHBondContact O-N 2.83Å; V332-Y334 VanDerWaalsContact C-N 3.29Å; V332-Y334 PolarHBondContact O-N 2.78Å; Y334-L341 HydrophobicContact CD2-CD1 4.38Å
335	T	63.4	Low	73.4	Confident	106 Å²	106	68 Å²	68	65%	0.65	37%	0.373	S	S	*	.	H	α-helix	trans	-91.6	-31.3	-179	31.3	0	0	0	0	114.1	G331 V332 E333	G331-T335 PolarHBondContact O-N 2.88Å; G331-T335 PolarHBondContact O-OG1 3.06Å; V332-T335 PolarHBondContact O-N 3.48Å; E333-T335 VanDerWaalsContact C-N 3.33Å; E333-T335 PolarHBondContact O-N 2.87Å
336	L	60.1	Low	72.6	Confident	128 Å²	128	72.3 Å²	72.3	67%	0.67	39%	0.392	S	S	*	.	H	α-helix	trans	-103.4	-17.4	-171	-62.6	174.8	0	0	0	114	V332	V332-L336 HydrophobicContact CG1-CD1 3.76Å; V332-L336 WeakPolarHBondContact O-CB 3.33Å; V332-L336 PolarHBondContact O-N 3.4Å
337	K	65.3	Low	72.1	Confident	127 Å²	127	76.8 Å²	76.8	55%	0.552	41%	0.414	S	S	*	.			trans	-138.2	69	-176.4	-62.4	-177	-178.3	175.4	0	112.1	E333 N339 S340	E333-K337 CarbonylContact O-C 3.54Å; E333-K337 PolarHBondContact O-N 2.9Å; K337-N339 PolarHBondContact O-N 3.44Å; K337-S340 VanDerWaalsContact CB-OG 3.22Å; K337-S340 WeakPolarHBondContact CB-OG 3.03Å; K337-S340 PolarHBondContact O-N 2.74Å; K337-S340 VanDerWaalsContact O-N 3.13Å; K337-S340 PolarHBondContact O-OG 3.28Å
338	P	60.7	Low	71.7	Confident	61 Å²	61	73.2 Å²	73.2	40%	0.396	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-58.6	-36.5	178	21.8	-31.4	0	0	0	112.4	S340 L341 E344	P338-S340 PolarHBondContact O-N 3.15Å; P338-L341 PolarHBondContact O-N 3.17Å; P338-E344 VanDerWaalsContact O-CB 3.26Å; P338-E344 WeakPolarHBondContact O-CB 3.44Å; P338-E344 WeakPolarHBondContact O-CG 3.45Å
339	N	64.3	Low	71.1	Confident	134 Å²	134	72.4 Å²	72.4	72%	0.717	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-72.9	-3.4	-179.2	-62.6	-7.3	0	0	0	114.7	K337 I345	K337-N339 PolarHBondContact O-N 3.44Å; N339-I345 WeakPolarHBondContact O-CG1 3.47Å
340	S	66.4	Low	70.6	Confident	56 Å²	56	75.1 Å²	75.1	39%	0.392	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-98.6	-0.9	173.7	63.2	0	0	0	0	113.3	K337 P338	K337-S340 VanDerWaalsContact CB-OG 3.22Å; K337-S340 WeakPolarHBondContact CB-OG 3.03Å; K337-S340 PolarHBondContact O-N 2.74Å; K337-S340 VanDerWaalsContact O-N 3.13Å; K337-S340 PolarHBondContact O-OG 3.28Å; P338-S340 PolarHBondContact O-N 3.15Å
341	L	75.1	Confident	70.2	Confident	12 Å²	12	76.2 Å²	76.2	6%	0.063	42%	0.421	C	S	.	.	S	Bend	trans	-77.1	139.2	175.5	-64.6	174.1	0	0	0	109.9	W281 P329 Y334 P338 S343 E344 I345	W281-L341 HydrophobicContact CH2-CD1 3.72Å; W281-L341 HydrophobicContact CZ3-CD1 3.96Å; P329-L341 HydrophobicContact CB-CD2 3.6Å; P329-L341 HydrophobicContact CG-CD2 3.74Å; Y334-L341 HydrophobicContact CD2-CD1 4.38Å; P338-L341 PolarHBondContact O-N 3.17Å; L341-S343 PolarHBondContact O-N 3.31Å; L341-E344 HydrophobicContact CB-CG 4.23Å; L341-E344 PolarHBondContact O-N 3.17Å; L341-I345 WeakPolarHBondContact O-CG1 3.13Å; L341-I345 PolarHBondContact O-N 3.45Å
342	P	78.1	Confident	70.2	Confident	34 Å²	34	78.9 Å²	78.9	22%	0.221	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-24	177.8	-27.7	37.1	0	0	0	113.7	M301 G308 E344	M301-P342 HydrophobicContact CB-CB 4.26Å; M301-P342 HydrophobicContact CB-CG 3.73Å; M301-P342 HydrophobicContact CG-CG 4.35Å; M301-P342 HydrophobicContact SD-CB 4.36Å; M301-P342 HydrophobicContact SD-CG 4.26Å; G308-P342 WeakPolarHBondContact CA-O 3.41Å; P342-E344 VanDerWaalsContact C-N 3.34Å
343	S	75.6	Confident	70.5	Confident	5 Å²	5	77.7 Å²	77.7	4%	0.035	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-21.1	175.3	63.2	0	0	0	0	114.9	R272 K279 L341	R272-S343 WeakPolarHBondContact CB-OG 3.45Å; K279-S343 PolarHBondContact NZ-O 3.11Å; L341-S343 PolarHBondContact O-N 3.31Å
344	E	78.3	Confident	70.8	Confident	60 Å²	60	76.4 Å²	76.4	28%	0.28	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-8.7	-174.3	-54.1	-47.7	124.1	0	0	113.8	R272 P338 L341 P342	R272-E344 WeakPolarHBondContact CD-OE1 3.28Å; R272-E344 IonicContact CZ-OE1 2.7Å; R272-E344 IonicContact CZ-OE2 2.85Å; R272-E344 IonicContact NE-OE1 2.79Å; R272-E344 IonicContact NH1-OE1 3.55Å; R272-E344 PolarHBondContact NH1-OE1 3.15Å; R272-E344 IonicContact NH1-OE2 3.46Å; R272-E344 PolarHBondContact NH1-OE2 3.1Å; P338-E344 VanDerWaalsContact O-CB 3.26Å; P338-E344 WeakPolarHBondContact O-CB 3.44Å; P338-E344 WeakPolarHBondContact O-CG 3.45Å; L341-E344 HydrophobicContact CB-CG 4.23Å; L341-E344 PolarHBondContact O-N 3.17Å; P342-E344 VanDerWaalsContact C-N 3.34Å
345	I	78.1	Confident	71.2	Confident	35 Å²	35	79.6 Å²	79.6	18%	0.179	44%	0.436	C	S	.	.	S	Bend	trans	-79.9	158.2	173.6	-63	165.8	0	0	0	109.5	M301 K306 N339 L341 Q347	M301-I345 HydrophobicContact CE-CD1 3.53Å; M301-I345 HydrophobicContact SD-CD1 3.79Å; K306-I345 WeakPolarHBondContact O-CG2 3.06Å; N339-I345 WeakPolarHBondContact O-CG1 3.47Å; L341-I345 WeakPolarHBondContact O-CG1 3.13Å; L341-I345 PolarHBondContact O-N 3.45Å; I345-Q347 PolarHBondContact O-N 2.76Å
346	D	75.4	Confident	71.8	Confident	142 Å²	142	77.5 Å²	77.5	76%	0.759	42%	0.419	S	S	*	.			trans	-46	134.1	170.1	-75.5	-26.6	0	0	0	110.8	C307 G308	C307-D346 VanDerWaalsContact CA-O 3.28Å; C307-D346 WeakPolarHBondContact CA-O 3.4Å; C307-D346 WeakPolarHBondContact CB-O 3.01Å; G308-D346 PolarHBondContact N-O 3.05Å; G308-D346 VanDerWaalsContact N-O 3.09Å
347	Q	78.5	Confident	72.8	Confident	125 Å²	125	73.3 Å²	73.3	58%	0.584	40%	0.398	S	S	*	.	B	Isolated β-bridge	trans	-72.9	135	-178.9	-71.7	-172.3	-37.7	0	0	110.2	G308 I345	G308-Q347 WeakPolarHBondContact O-CA 3.46Å; I345-Q347 PolarHBondContact O-N 2.76Å
348	C	78	Confident	73.5	Confident	89 Å²	89	68.5 Å²	68.5	60%	0.601	38%	0.384	S	S	*	.			trans	-65.9	0	155.6	-40.4	0	0	0	0	108.5	C307 G308	C307-C348 HydrophobicContact CB-CB 4.07Å; C307-C348 WeakPolarHBondContact CB-SG 3.37Å; C307-C348 PolarHBondContact O-SG 3.45Å; C307-C348 VanDerWaalsContact O-SG 3.33Å; C307-C348 VanDerWaalsContact SG-CA 3.59Å; C307-C348 WeakPolarHBondContact SG-CB 3.24Å; C307-C348 CovalentContact SG-SG 2.02Å; C307-C348 PolarHBondContact SG-SG 2.81Å; G308-C348 PolarHBondContact O-N 2.81Å; G308-C348 VanDerWaalsContact O-N 3.08Å

Retrieved 348 of 348 residues in 2139.8 ms (Link to these results)

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