A0A096NJ06_PAPAN Loading...

Inactive serine protease 54

AlphaFold DB , UniProt , Accession A0A096NJ06, Species PAPAN (Papio anubis, Olive baboon), Gene PRSS54, Length 393 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.5	Very low	37.3	Very low	241 Å²	241	129.5 Å²	129.5	100%	1.187	87%	0.87	S	S	*	*				0	106.7	0	-156.2	173.1	-172.1	0	0	106.4
2	V	29.7	Very low	37.6	Very low	146 Å²	146	134.4 Å²	134.4	89%	0.885	87%	0.866	S	S	*	*			trans	-117.8	123.1	175	-178.7	0	0	0	0	106.2
3	S	29.3	Very low	37.7	Very low	110 Å²	110	139.4 Å²	139.4	77%	0.769	88%	0.875	S	S	*	*			trans	-114.6	124	177	-161.7	0	0	0	0	107.7
4	A	34	Very low	38.1	Very low	98 Å²	98	146.1 Å²	146.1	81%	0.81	88%	0.875	S	S	*	*			trans	-114.5	117.2	170.5	0	0	0	0	0	107.8
5	T	37.5	Very low	38.4	Very low	136 Å²	136	141.5 Å²	141.5	83%	0.834	87%	0.87	S	S	*	*			trans	-93.6	118.4	176.9	48.1	0	0	0	0	109.8
6	G	35.5	Very low	38.8	Very low	79 Å²	79	140.6 Å²	140.6	81%	0.814	86%	0.864	S	S	*	*			trans	-115.3	114.5	163.7	0	0	0	0	0	109.4
7	L	39.4	Very low	38.8	Very low	181 Å²	181	141.5 Å²	141.5	95%	0.948	86%	0.861	S	S	*	*			trans	-86.7	123.3	170.8	-91.6	145.4	0	0	0	108.8
8	S	34.3	Very low	39	Very low	114 Å²	114	141.7 Å²	141.7	80%	0.797	86%	0.855	S	S	*	*			trans	-129.7	129.9	157.6	-171.7	0	0	0	0	108.5	D10	S8-D10 PolarHBondContact O-N 3.16Å; S8-D10 VanDerWaalsContact O-N 3.16Å
9	G	44.8	Very low	39.1	Very low	81 Å²	81	139.9 Å²	139.9	84%	0.835	85%	0.845	S	S	*	*			trans	-74.6	98.4	-175.4	0	0	0	0	0	111.3
10	D	44.5	Very low	39.2	Very low	155 Å²	155	141.2 Å²	141.2	83%	0.829	85%	0.846	S	S	*	*	S	Bend	trans	-158.4	138.5	136.4	-142	-11.6	0	0	0	109.1	S8 K12	S8-D10 PolarHBondContact O-N 3.16Å; S8-D10 VanDerWaalsContact O-N 3.16Å; D10-K12 VanDerWaalsContact C-N 3.3Å; D10-K12 PolarHBondContact O-N 2.77Å
11	G	46.8	Very low	39.4	Very low	84 Å²	84	142.2 Å²	142.2	87%	0.866	85%	0.846	S	S	*	*	S	Bend	trans	-70.3	66.9	-164.1	0	0	0	0	0	115.8
12	K	41.1	Very low	39.6	Very low	188 Å²	188	133.5 Å²	133.5	82%	0.817	82%	0.819	S	S	*	*			trans	-130.4	117.4	169.3	-105.3	175.2	177.6	171.6	0	110.7	D10 R14	D10-K12 VanDerWaalsContact C-N 3.3Å; D10-K12 PolarHBondContact O-N 2.77Å; K12-R14 PolarHBondContact O-N 2.98Å
13	M	39.3	Very low	39.9	Very low	199 Å²	199	133.4 Å²	133.4	98%	0.98	81%	0.812	S	S	*	*			trans	-56.8	107.6	167.6	-90.7	-150.1	-72.9	0	0	109.3
14	R	42.4	Very low	40.1	Very low	233 Å²	233	136.2 Å²	136.2	88%	0.879	82%	0.818	S	S	*	*			trans	-87.8	122.2	164.4	-78.7	-175	162.8	-154.4	-4.1	107.8	K12 V16	K12-R14 PolarHBondContact O-N 2.98Å; R14-V16 PolarHBondContact O-N 3.38Å
15	G	42.4	Very low	40.2	Very low	78 Å²	78	138.4 Å²	138.4	80%	0.804	81%	0.811	S	S	*	*			trans	-54.7	129.7	179.2	0	0	0	0	0	111.5	L17	G15-L17 PolarHBondContact O-N 3.32Å
16	V	45.5	Very low	40.2	Very low	127 Å²	127	136.3 Å²	136.3	77%	0.77	80%	0.802	S	S	*	*			trans	-75.6	109.6	175.1	177.3	0	0	0	0	107.8	R14 L18	R14-V16 PolarHBondContact O-N 3.38Å; V16-L18 HydrophobicContact CG1-CG 4.34Å; V16-L18 PolarHBondContact O-N 3.18Å
17	L	39	Very low	40.6	Very low	156 Å²	156	137.8 Å²	137.8	82%	0.817	80%	0.799	S	S	*	*			trans	-79	97.2	170.3	-167.4	75	0	0	0	108.7	G15 V19	G15-L17 PolarHBondContact O-N 3.32Å; L17-V19 HydrophobicContact CD2-CG2 4.34Å; L17-V19 HydrophobicContact CG-CG2 4.5Å; L17-V19 PolarHBondContact O-N 3.19Å
18	L	41.1	Very low	41.3	Very low	144 Å²	144	130.4 Å²	130.4	75%	0.754	76%	0.762	S	S	*	*			trans	-72.1	100.4	169.6	-86.6	152.3	0	0	0	109.1	V16 L20	V16-L18 HydrophobicContact CG1-CG 4.34Å; V16-L18 PolarHBondContact O-N 3.18Å; L18-L20 PolarHBondContact O-N 3.16Å; L18-L20 VanDerWaalsContact O-N 3.16Å
19	V	41.4	Very low	43.5	Very low	109 Å²	109	127.4 Å²	127.4	66%	0.661	74%	0.741	S	S	*	*			trans	-77.6	97.6	168.8	-179.1	0	0	0	0	108.1	L17 L21	L17-V19 HydrophobicContact CD2-CG2 4.34Å; L17-V19 HydrophobicContact CG-CG2 4.5Å; L17-V19 PolarHBondContact O-N 3.19Å; V19-L21 PolarHBondContact O-N 3.1Å; V19-L21 VanDerWaalsContact O-N 3.1Å
20	L	41	Very low	45.6	Very low	165 Å²	165	123.6 Å²	123.6	86%	0.864	70%	0.702	S	S	*	*			trans	-71.1	95.8	165.7	-80.7	161.1	0	0	0	108.1	L18 G22	L18-L20 PolarHBondContact O-N 3.16Å; L18-L20 VanDerWaalsContact O-N 3.16Å; L20-G22 PolarHBondContact O-N 3.01Å
21	L	43.6	Very low	47.7	Very low	162 Å²	162	116.2 Å²	116.2	85%	0.848	66%	0.662	S	S	*	*			trans	-66.7	84.4	159	-88.6	152.7	0	0	0	107.5	V19 L23	V19-L21 PolarHBondContact O-N 3.1Å; V19-L21 VanDerWaalsContact O-N 3.1Å; L21-L23 PolarHBondContact O-N 2.87Å
22	G	38.8	Very low	49.7	Very low	59 Å²	59	114.6 Å²	114.6	61%	0.608	64%	0.636	S	S	*	*			trans	-64.4	99.8	164.9	0	0	0	0	0	107.8	L20 L24	L20-G22 PolarHBondContact O-N 3.01Å; G22-L24 PolarHBondContact O-N 2.75Å
23	L	37	Very low	51.8	Low	144 Å²	144	107.7 Å²	107.7	75%	0.754	61%	0.606	S	S	*	*			trans	-62.3	94.2	155.1	-72.4	167.7	0	0	0	105.6	L21 H25	L21-L23 PolarHBondContact O-N 2.87Å; L23-H25 PolarHBondContact O-N 2.88Å
24	L	33.3	Very low	53.4	Low	169 Å²	169	103.3 Å²	103.3	89%	0.885	58%	0.582	S	S	*	*			trans	-59.5	83.7	158.3	-84.5	132.5	0	0	0	106.1	G22 S26	G22-L24 PolarHBondContact O-N 2.75Å; L24-S26 PolarHBondContact O-N 2.96Å
25	H	34.7	Very low	54.6	Low	144 Å²	144	93.2 Å²	93.2	67%	0.667	55%	0.548	S	S	*	.			trans	-63.2	99.6	153.3	-74.5	81.6	0	0	0	103.8	L23 S27	L23-H25 PolarHBondContact O-N 2.88Å; H25-S27 VanDerWaalsContact C-N 3.26Å; H25-S27 PolarHBondContact O-N 2.87Å
26	S	37.5	Very low	55.1	Low	91 Å²	91	93.3 Å²	93.3	64%	0.636	54%	0.536	S	S	*	.			trans	-53.7	104.3	159.3	50.8	0	0	0	0	105.2	L24 T28	L24-S26 PolarHBondContact O-N 2.96Å; S26-T28 PolarHBondContact O-N 3.43Å
27	S	43.6	Very low	55.5	Low	110 Å²	110	91.8 Å²	91.8	77%	0.769	53%	0.527	S	S	*	.			trans	-59.9	97	166.2	41.7	0	0	0	0	105.7	H25 S29	H25-S27 VanDerWaalsContact C-N 3.26Å; H25-S27 PolarHBondContact O-N 2.87Å; S27-S29 VanDerWaalsContact C-N 3.3Å; S27-S29 PolarHBondContact O-N 2.85Å
28	T	55.2	Low	55.6	Low	26 Å²	26	91.7 Å²	91.7	16%	0.16	52%	0.52	C	S	.	.			trans	-71.6	86	-175.6	37.5	0	0	0	0	108.6	S26 C30 E75 H279	S26-T28 PolarHBondContact O-N 3.43Å; T28-C30 PolarHBondContact O-N 3.46Å; T28-E75 VanDerWaalsContact CG2-OE1 3.24Å; T28-E75 WeakPolarHBondContact CG2-OE1 3.42Å; T28-H279 PolarHBondContact O-CD2 2.96Å; T28-H279 PolarHBondContact O-NE2 2.89Å; T28-H279 PolarHBondContact OG1-NE2 2.88Å
29	S	79.6	Confident	55.7	Low	51 Å²	51	95.3 Å²	95.3	36%	0.357	53%	0.526	S	S	.	.			trans	-59.4	125.3	-179.8	-166.1	0	0	0	0	110.4	S27 V32	S27-S29 VanDerWaalsContact C-N 3.3Å; S27-S29 PolarHBondContact O-N 2.85Å; S29-V32 VanDerWaalsContact OG-CG2 3.23Å; S29-V32 WeakPolarHBondContact OG-CG2 3.23Å
30	C	89.2	Confident	55.7	Low	2 Å²	2	91.7 Å²	91.7	1%	0.014	51%	0.51	C	S	.	.	S	Bend	trans	-85.3	164.5	171.8	63.4	0	0	0	0	111	T28 V32 S147 C149 L234 H279	T28-C30 PolarHBondContact O-N 3.46Å; C30-V32 PolarHBondContact O-N 3.16Å; C30-V32 VanDerWaalsContact O-N 3.13Å; C30-S147 CarbonylContact C-O 3.53Å; C30-S147 WeakPolarHBondContact CA-O 3.44Å; C30-C149 HydrophobicContact CB-CB 4.06Å; C30-C149 WeakPolarHBondContact CB-SG 3.47Å; C30-C149 PolarHBondContact O-SG 2.94Å; C30-C149 WeakPolarHBondContact SG-CA 3.38Å; C30-C149 WeakPolarHBondContact SG-CB 3.37Å; C30-C149 CovalentContact SG-SG 2.03Å; C30-C149 PolarHBondContact SG-SG 2.85Å; C30-L234 WeakPolarHBondContact O-CD2 3.45Å; C30-H279 HydrophobicContact CB-CB 4.45Å; C30-H279 VanDerWaalsContact SG-CB 3.54Å
31	G	89.8	Confident	55.7	Low	0 Å²	0	91 Å²	91	0%	0	52%	0.515	C	S	.	.	S	Bend	trans	67.3	16	167.8	0	0	0	0	0	114.8	S147 W235	G31-S147 PolarHBondContact N-O 2.87Å; G31-W235 VanDerWaalsContact CA-O 3.25Å; G31-W235 WeakPolarHBondContact CA-O 3.26Å; G31-W235 PolarHBondContact O-N 3.41Å
32	V	88.6	Confident	55.8	Low	50 Å²	50	89.9 Å²	89.9	30%	0.303	51%	0.51	S	S	.	.			trans	-90.8	113.5	-179.7	-178.3	0	0	0	0	109.7	S29 C30 K34 L234	S29-V32 VanDerWaalsContact OG-CG2 3.23Å; S29-V32 WeakPolarHBondContact OG-CG2 3.23Å; C30-V32 PolarHBondContact O-N 3.16Å; C30-V32 VanDerWaalsContact O-N 3.13Å; V32-K34 HydrophobicContact CG1-CG 4.46Å; V32-L234 HydrophobicContact CG2-CD2 4.27Å
33	Q	85.7	Confident	56.4	Low	42 Å²	42	90.8 Å²	90.8	20%	0.196	50%	0.501	C	S	.	.			trans	-87.4	117.6	171.1	-174.8	174.2	49.5	0	0	109.1	A35 E52 W55	Q33-A35 HydrophobicContact CG-CB 4.21Å; Q33-E52 WeakPolarHBondContact CG-O 3.46Å; Q33-E52 VanDerWaalsContact NE2-CG 3.25Å; Q33-E52 PolarHBondContact NE2-O 3.34Å; Q33-W55 HydrophobicContact CB-CH2 4.11Å
34	K	72.4	Confident	57.3	Low	108 Å²	108	90.9 Å²	90.9	47%	0.47	50%	0.495	S	S	.	.			trans	-90.8	-9.9	178.9	-74.4	-178.3	175.5	173.4	0	113.8	V32 S36 N143	V32-K34 HydrophobicContact CG1-CG 4.46Å; K34-S36 PolarHBondContact O-N 3.22Å; K34-N143 VanDerWaalsContact CD-OD1 3.32Å; K34-N143 WeakPolarHBondContact CD-OD1 3.43Å; K34-N143 PolarHBondContact NZ-OD1 3.4Å
35	A	67.3	Low	58.8	Low	21 Å²	21	89 Å²	89	17%	0.174	48%	0.481	C	S	.	.			trans	-62.4	112.3	174	0	0	0	0	0	109	Q33 V37 M51 E52	Q33-A35 HydrophobicContact CG-CB 4.21Å; A35-V37 PolarHBondContact O-N 3.37Å; A35-V37 VanDerWaalsContact O-N 3.11Å; A35-M51 HydrophobicContact CB-CB 4.43Å; A35-E52 HydrophobicContact CB-CB 4.4Å
36	S	53.6	Low	60.5	Low	80 Å²	80	83.1 Å²	83.1	56%	0.559	46%	0.461	S	S	*	.			trans	-59.6	113.9	159	46.5	0	0	0	0	106.5	K34 F38	K34-S36 PolarHBondContact O-N 3.22Å; S36-F38 PolarHBondContact O-N 3.36Å; S36-F38 WeakPolarHBondContact OG-CD2 3.35Å; S36-F38 WeakPolarHBondContact OG-CE2 3.37Å
37	V	52.8	Low	62.5	Low	95 Å²	95	80.5 Å²	80.5	58%	0.576	44%	0.439	S	S	*	.			trans	-63.7	82.1	169.7	-177.7	0	0	0	0	106.9	A35 Y39	A35-V37 PolarHBondContact O-N 3.37Å; A35-V37 VanDerWaalsContact O-N 3.11Å; V37-Y39 HydrophobicContact CG1-CD2 4.33Å; V37-Y39 HydrophobicContact CG1-CE2 3.95Å; V37-Y39 PolarHBondContact O-N 3.18Å
38	F	42.5	Very low	64.3	Low	154 Å²	154	75.8 Å²	75.8	68%	0.675	41%	0.406	S	S	*	.			trans	-73.4	107.8	168.7	-90.1	-83.5	0	0	0	105.9	S36 G40 L43	S36-F38 PolarHBondContact O-N 3.36Å; S36-F38 WeakPolarHBondContact OG-CD2 3.35Å; S36-F38 WeakPolarHBondContact OG-CE2 3.37Å; F38-G40 PolarHBondContact O-N 3.28Å; F38-L43 WeakPolarHBondContact O-CD1 3.41Å
39	Y	42.9	Very low	65.7	Low	220 Å²	220	76.5 Å²	76.5	86%	0.863	41%	0.412	S	S	*	.			trans	-66.7	63.9	155.7	-63.8	-84.7	0	0	0	108.3	V37	V37-Y39 HydrophobicContact CG1-CD2 4.33Å; V37-Y39 HydrophobicContact CG1-CE2 3.95Å; V37-Y39 PolarHBondContact O-N 3.18Å
40	G	40.1	Very low	65.8	Low	32 Å²	32	76.5 Å²	76.5	33%	0.33	41%	0.412	S	S	.	.			trans	-88.3	150.8	171.8	0	0	0	0	0	109.6	F38 D42 L43	F38-G40 PolarHBondContact O-N 3.28Å; G40-D42 PolarHBondContact O-N 3.16Å; G40-L43 PolarHBondContact O-N 3.49Å
41	P	41.7	Very low	65.6	Low	150 Å²	150	79.5 Å²	79.5	97%	0.974	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	5.2	-176.8	25.8	-33.8	0	0	0	115.3
42	D	45	Very low	65.6	Low	139 Å²	139	80.4 Å²	80.4	74%	0.743	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.8	8.2	-173.3	-144.8	8.7	0	0	0	113.6	G40 K44	G40-D42 PolarHBondContact O-N 3.16Å; D42-K44 PolarHBondContact O-N 2.84Å
43	L	51.4	Low	65.8	Low	79 Å²	79	78.3 Å²	78.3	41%	0.414	42%	0.417	S	S	.	.			trans	-73.1	93.5	172.4	-132	117.9	0	0	0	108.7	F38 G40 E45	F38-L43 WeakPolarHBondContact O-CD1 3.41Å; G40-L43 PolarHBondContact O-N 3.49Å; L43-E45 PolarHBondContact O-N 2.89Å
44	K	56.1	Low	66.1	Low	146 Å²	146	76.4 Å²	76.4	64%	0.635	41%	0.409	S	S	*	.			trans	-60.3	110	171.4	-68.6	-179.9	-177.7	176.4	0	108.3	D42 G46 L47	D42-K44 PolarHBondContact O-N 2.84Å; K44-G46 PolarHBondContact O-N 3.03Å; K44-L47 HydrophobicContact CB-CD1 3.67Å; K44-L47 HydrophobicContact CB-CG 4Å; K44-L47 HydrophobicContact CD-CD1 4.01Å; K44-L47 HydrophobicContact CG-CD1 4.42Å; K44-L47 PolarHBondContact O-N 3.14Å; K44-L47 VanDerWaalsContact O-N 3.14Å
45	E	64.3	Low	67.2	Low	128 Å²	128	71.3 Å²	71.3	60%	0.598	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.7	130.7	-179.5	-67.8	174.8	176.2	0	0	111.8	L43	L43-E45 PolarHBondContact O-N 2.89Å
46	G	71.1	Confident	68.6	Low	22 Å²	22	70.4 Å²	70.4	23%	0.227	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	2.2	178.5	0	0	0	0	0	116.4	K44 R185 K186	K44-G46 PolarHBondContact O-N 3.03Å; G46-R185 VanDerWaalsContact O-CA 3.26Å; G46-R185 WeakPolarHBondContact O-CA 3.45Å; G46-R185 WeakPolarHBondContact O-CB 3.47Å; G46-K186 PolarHBondContact O-N 2.89Å
47	L	80.1	Confident	70.6	Confident	35 Å²	35	66.6 Å²	66.6	18%	0.183	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-89.9	148	168.8	-58.1	-170.3	0	0	0	111.2	K44 I183 R185 K186	K44-L47 HydrophobicContact CB-CD1 3.67Å; K44-L47 HydrophobicContact CB-CG 4Å; K44-L47 HydrophobicContact CD-CD1 4.01Å; K44-L47 HydrophobicContact CG-CD1 4.42Å; K44-L47 PolarHBondContact O-N 3.14Å; K44-L47 VanDerWaalsContact O-N 3.14Å; L47-I183 HydrophobicContact CD1-CG2 4.14Å; L47-I183 HydrophobicContact CD2-CG2 3.86Å; L47-I183 HydrophobicContact CG-CG2 4.48Å; L47-R185 HydrophobicContact CD2-CG 3.9Å; L47-K186 WeakPolarHBondContact O-CE 3.18Å
48	V	82	Confident	72.5	Confident	12 Å²	12	62 Å²	62	7%	0.073	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-80.6	124.1	169.7	179.8	0	0	0	0	108.6	E52 F53 S167 L184 R185 K186	V48-E52 HydrophobicContact CG1-CB 3.94Å; V48-F53 HydrophobicContact CG1-CD2 3.78Å; V48-F53 HydrophobicContact CG1-CE2 4.41Å; V48-F53 HydrophobicContact CG2-CD2 3.92Å; V48-F53 HydrophobicContact CG2-CE2 4.1Å; V48-S167 WeakPolarHBondContact CG2-OG 3.34Å; V48-L184 HydrophobicContact CB-CB 4.28Å; V48-L184 HydrophobicContact CB-CD2 3.98Å; V48-L184 HydrophobicContact CB-CG 4.16Å; V48-L184 HydrophobicContact CG1-CD2 3.98Å; V48-L184 HydrophobicContact CG2-CB 4.43Å; V48-L184 HydrophobicContact CG2-CD2 3.96Å; V48-L184 HydrophobicContact CG2-CG 3.91Å; V48-L184 PolarHBondContact N-O 3.11Å; V48-R185 VanDerWaalsContact CG2-C 3.49Å; V48-R185 WeakPolarHBondContact CG2-O 3.28Å; V48-K186 HydrophobicContact CG2-CB 3.81Å; V48-K186 HydrophobicContact CG2-CD 4.4Å; V48-K186 HydrophobicContact CG2-CG 4.29Å
49	S	84	Confident	75	Confident	40 Å²	40	54.7 Å²	54.7	28%	0.28	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-71.9	154	173.4	-61.4	0	0	0	0	110.4	M51 E52	S49-M51 PolarHBondContact O-N 3.23Å; S49-E52 PolarHBondContact N-OE2 3.2Å; S49-E52 WeakPolarHBondContact O-CB 3.22Å; S49-E52 PolarHBondContact O-N 2.69Å; S49-E52 VanDerWaalsContact O-N 3.11Å
50	S	80.9	Confident	77.4	Confident	51 Å²	51	44.8 Å²	44.8	36%	0.357	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	136.6	172.1	-166.9	0	0	0	0	109.9	E52	S50-E52 PolarHBondContact O-N 3.28Å
51	M	85.8	Confident	79.8	Confident	65 Å²	65	44.3 Å²	44.3	32%	0.32	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	4.5	-179.2	-45.6	170.3	-171.9	0	0	115.6	A35 S49 N143 L144	A35-M51 HydrophobicContact CB-CB 4.43Å; S49-M51 PolarHBondContact O-N 3.23Å; M51-N143 WeakPolarHBondContact CB-O 3.42Å; M51-N143 HydrophobicContact CE-CB 4.04Å; M51-N143 HydrophobicContact CG-CB 4.02Å; M51-N143 HydrophobicContact SD-CB 3.66Å; M51-L144 HydrophobicContact CB-CD2 4.36Å; M51-L144 HydrophobicContact CG-CD2 3.58Å; M51-L144 HydrophobicContact CG-CG 4.32Å
52	E	88.8	Confident	81.9	Confident	20 Å²	20	41.1 Å²	41.1	9%	0.093	23%	0.225	C	C	.	.	S	Bend	trans	-72	-45.9	-177.5	-171	177.5	178.8	0	0	112.1	Q33 A35 V48 S49 S50 P54 K186	Q33-E52 WeakPolarHBondContact CG-O 3.46Å; Q33-E52 VanDerWaalsContact NE2-CG 3.25Å; Q33-E52 PolarHBondContact NE2-O 3.34Å; A35-E52 HydrophobicContact CB-CB 4.4Å; V48-E52 HydrophobicContact CG1-CB 3.94Å; S49-E52 PolarHBondContact N-OE2 3.2Å; S49-E52 WeakPolarHBondContact O-CB 3.22Å; S49-E52 PolarHBondContact O-N 2.69Å; S49-E52 VanDerWaalsContact O-N 3.11Å; S50-E52 PolarHBondContact O-N 3.28Å; E52-P54 VanDerWaalsContact C-CD 3.48Å; E52-P54 WeakPolarHBondContact O-CD 3Å; E52-K186 WeakPolarHBondContact OE1-CD 3.45Å; E52-K186 IonicContact OE1-NZ 2.58Å; E52-K186 PolarHBondContact OE1-NZ 3.43Å; E52-K186 IonicContact OE2-NZ 2.83Å; E52-K186 PolarHBondContact OE2-NZ 3.03Å
53	F	92.6	Very high	83.8	Confident	5 Å²	5	40.9 Å²	40.9	2%	0.022	22%	0.22	C	C	.	.	S	Bend	trans	-124.1	70.6	178.1	-57.2	-50.1	0	0	0	111.5	V48 W55 V56 W165 K186 M226 W235	V48-F53 HydrophobicContact CG1-CD2 3.78Å; V48-F53 HydrophobicContact CG1-CE2 4.41Å; V48-F53 HydrophobicContact CG2-CD2 3.92Å; V48-F53 HydrophobicContact CG2-CE2 4.1Å; F53-W55 AromaticContact CD1-CZ2 3.98Å; F53-W55 HydrophobicContact CD1-CZ2 3.98Å; F53-W55 PolarHBondContact O-N 3.49Å; F53-W55 VanDerWaalsContact O-N 3.08Å; F53-V56 HydrophobicContact CB-CB 4.46Å; F53-V56 HydrophobicContact CB-CG2 3.64Å; F53-V56 PolarHBondContact O-N 3Å; F53-V56 VanDerWaalsContact O-N 3.15Å; F53-W165 HydrophobicContact CZ-CB 3.88Å; F53-W165 HydrophobicContact CZ-CG 4.19Å; F53-K186 HydrophobicContact CE2-CB 3.94Å; F53-K186 HydrophobicContact CE2-CD 3.92Å; F53-K186 HydrophobicContact CZ-CD 4.29Å; F53-M226 HydrophobicContact CB-SD 4.38Å; F53-M226 HydrophobicContact CD1-CE 4.26Å; F53-M226 HydrophobicContact CD1-SD 4.19Å; F53-M226 HydrophobicContact CD2-CE 4.23Å; F53-M226 HydrophobicContact CE1-CE 4.41Å; F53-M226 HydrophobicContact CE2-CE 4.37Å; F53-M226 HydrophobicContact CG-CE 4.18Å; F53-M226 HydrophobicContact CG-SD 4.25Å; F53-M226 HydrophobicContact CZ-CE 4.47Å; F53-W235 AromaticContact CE1-CH2 3.75Å; F53-W235 HydrophobicContact CE1-CH2 3.75Å; F53-W235 HydrophobicContact CE1-CZ2 4.13Å; F53-W235 HydrophobicContact CE1-CZ3 4Å; F53-W235 HydrophobicContact CZ-CH2 4.39Å
54	P	93.4	Very high	85.4	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.019	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-6.9	-171.9	30.3	-37.4	0	0	0	114.4	E52 L144 V145 Q146	E52-P54 VanDerWaalsContact C-CD 3.48Å; E52-P54 WeakPolarHBondContact O-CD 3Å; P54-L144 WeakPolarHBondContact CA-O 3.24Å; P54-V145 VanDerWaalsContact O-CA 3.32Å; P54-V145 WeakPolarHBondContact O-CA 3.28Å; P54-Q146 HydrophobicContact CB-CB 4.08Å; P54-Q146 HydrophobicContact CB-CG 4.32Å; P54-Q146 HydrophobicContact CG-CB 3.87Å; P54-Q146 HydrophobicContact CG-CG 4.2Å; P54-Q146 PolarHBondContact O-N 3.11Å; P54-Q146 VanDerWaalsContact O-N 3.1Å
55	W	95.6	Very high	86.8	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-9.4	177.2	42.6	72.8	0	0	0	113.4	Q33 F53 C71 I72 Q146 I148 M226 W235	Q33-W55 HydrophobicContact CB-CH2 4.11Å; F53-W55 AromaticContact CD1-CZ2 3.98Å; F53-W55 HydrophobicContact CD1-CZ2 3.98Å; F53-W55 PolarHBondContact O-N 3.49Å; F53-W55 VanDerWaalsContact O-N 3.08Å; W55-C71 CarbonylContact O-C 3.51Å; W55-C71 VanDerWaalsContact O-CA 3.27Å; W55-C71 WeakPolarHBondContact O-CA 3.37Å; W55-I72 HydrophobicContact CB-CB 4.4Å; W55-I72 PolarHBondContact O-N 3.11Å; W55-Q146 WeakPolarHBondContact CA-O 3.48Å; W55-Q146 VanDerWaalsContact CB-O 3.22Å; W55-Q146 WeakPolarHBondContact CB-O 3.38Å; W55-I148 HydrophobicContact CB-CB 3.89Å; W55-I148 HydrophobicContact CD2-CB 3.9Å; W55-I148 HydrophobicContact CD2-CD1 4.17Å; W55-I148 HydrophobicContact CD2-CG1 4.07Å; W55-I148 HydrophobicContact CE3-CB 4.3Å; W55-I148 HydrophobicContact CE3-CG1 4.49Å; W55-I148 HydrophobicContact CG-CB 3.7Å; W55-I148 HydrophobicContact CG-CD1 4.17Å; W55-I148 HydrophobicContact CG-CG1 4.23Å; W55-I148 HydrophobicContact CZ2-CD1 4.46Å; W55-M226 PolarHBondContact NE1-SD 3.48Å; W55-W235 HydrophobicContact CH2-CB 3.46Å; W55-W235 VanDerWaalsContact CH2-CB 3.46Å; W55-W235 AromaticContact CH2-CD1 3.53Å; W55-W235 HydrophobicContact CH2-CD2 4.1Å; W55-W235 AromaticContact CH2-CG 3.4Å; W55-W235 HydrophobicContact CH2-CG 3.4Å; W55-W235 HydrophobicContact CZ2-CB 3.58Å; W55-W235 AromaticContact CZ2-CD2 3.85Å; W55-W235 HydrophobicContact CZ2-CD2 3.85Å; W55-W235 HydrophobicContact CZ2-CE3 4.3Å; W55-W235 AromaticContact CZ2-CG 3.55Å; W55-W235 HydrophobicContact CZ2-CG 3.55Å; W55-W235 HydrophobicContact CZ3-CB 4.25Å
56	V	95.4	Very high	87.9	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.012	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	131.4	179.6	-174	0	0	0	0	109.2	F53 F69 I97 P224 M226	F53-V56 HydrophobicContact CB-CB 4.46Å; F53-V56 HydrophobicContact CB-CG2 3.64Å; F53-V56 PolarHBondContact O-N 3Å; F53-V56 VanDerWaalsContact O-N 3.15Å; V56-F69 HydrophobicContact CG1-CD1 3.83Å; V56-F69 HydrophobicContact CG1-CE1 4.4Å; V56-I97 HydrophobicContact CB-CD1 4.47Å; V56-I97 HydrophobicContact CG1-CD1 3.87Å; V56-P224 HydrophobicContact CG1-CG 4.2Å; V56-P224 HydrophobicContact CG2-CG 3.83Å; V56-M226 HydrophobicContact CG2-CE 4.28Å; V56-M226 HydrophobicContact CG2-SD 3.56Å; V56-M226 VanDerWaalsContact CG2-SD 3.56Å
57	V	95.6	Very high	88.8	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	156.9	-177.8	-61.3	0	0	0	0	111.2	F69 G70 I72 V78 V93 I94 V95	V57-F69 WeakPolarHBondContact O-CA 3.45Å; V57-F69 WeakPolarHBondContact O-CD1 3.42Å; V57-G70 VanDerWaalsContact CG2-C 3.42Å; V57-G70 WeakPolarHBondContact CG2-O 3.38Å; V57-G70 PolarHBondContact N-O 2.93Å; V57-G70 PolarHBondContact O-N 2.9Å; V57-I72 HydrophobicContact CG1-CD1 3.67Å; V57-I72 HydrophobicContact CG1-CG1 3.55Å; V57-V78 HydrophobicContact CG2-CG1 3.7Å; V57-V93 HydrophobicContact CB-CG1 3.76Å; V57-V93 HydrophobicContact CG1-CG1 3.92Å; V57-V93 HydrophobicContact CG2-CG1 3.84Å; V57-I94 WeakPolarHBondContact CA-O 3.33Å; V57-I94 WeakPolarHBondContact CB-O 3.43Å; V57-V95 HydrophobicContact CG1-CB 4.36Å; V57-V95 HydrophobicContact CG1-CG1 3.82Å
58	S	94.1	Very high	89.4	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.3	170.6	165.6	0	0	0	0	109.1	Q60 H66 I94 W169	S58-Q60 VanDerWaalsContact OG-CG 3.27Å; S58-Q60 WeakPolarHBondContact OG-CG 3.38Å; S58-Q60 PolarHBondContact OG-NE2 3.1Å; S58-Q60 VanDerWaalsContact OG-NE2 3.16Å; S58-H66 PolarHBondContact OG-ND1 3.37Å; S58-I94 PolarHBondContact N-O 2.82Å; S58-I94 PolarHBondContact O-N 2.88Å; S58-W169 VanDerWaalsContact CB-CH2 3.41Å
59	L	94.8	Very high	90	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	125.2	168.9	-57.4	-179.3	0	0	0	108.5	L67 A68 V78 I85 I91 V93 L133	L59-L67 PolarHBondContact O-N 2.83Å; L59-A68 WeakPolarHBondContact CB-O 3.28Å; L59-A68 PolarHBondContact N-O 2.93Å; L59-V78 HydrophobicContact CD2-CG1 4.32Å; L59-I85 HydrophobicContact CD1-CG2 4.28Å; L59-I91 HydrophobicContact CB-CG2 4.18Å; L59-I91 HydrophobicContact CD2-CG2 4.32Å; L59-V93 HydrophobicContact CD2-CB 4.42Å; L59-V93 HydrophobicContact CD2-CG1 4.47Å; L59-V93 HydrophobicContact CD2-CG2 3.82Å; L59-L133 HydrophobicContact CD1-CD1 4.08Å; L59-L133 HydrophobicContact CD1-CD2 3.88Å; L59-L133 HydrophobicContact CD2-CD2 4.09Å
60	Q	92.3	Very high	90.6	Very high	12 Å²	12	29.4 Å²	29.4	6%	0.056	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	153.3	-178.7	-54.3	-173.8	-1.3	0	0	111.4	S58 Y64 T65 I91 V92 I94	S58-Q60 VanDerWaalsContact OG-CG 3.27Å; S58-Q60 WeakPolarHBondContact OG-CG 3.38Å; S58-Q60 PolarHBondContact OG-NE2 3.1Å; S58-Q60 VanDerWaalsContact OG-NE2 3.16Å; Q60-Y64 PolarHBondContact OE1-O 3.18Å; Q60-T65 WeakPolarHBondContact CA-O 3.3Å; Q60-T65 WeakPolarHBondContact CB-O 3.33Å; Q60-I91 WeakPolarHBondContact O-CA 3.31Å; Q60-V92 HydrophobicContact CB-CG2 3.95Å; Q60-V92 PolarHBondContact N-O 2.83Å; Q60-V92 PolarHBondContact O-N 2.91Å; Q60-I94 HydrophobicContact CG-CG1 3.93Å
61	D	90.3	Very high	91.4	Very high	21 Å²	21	27 Å²	27	11%	0.112	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-179.5	171.5	68.7	14.6	0	0	0	112.4	Q63 Y64 T65 L67	D61-Q63 PolarHBondContact O-N 2.6Å; D61-Q63 WeakPolarHBondContact OD1-CA 3.3Å; D61-Q63 WeakPolarHBondContact OD1-CB 3.31Å; D61-Q63 PolarHBondContact OD1-N 2.89Å; D61-Y64 PolarHBondContact O-N 3.39Å; D61-Y64 PolarHBondContact OD1-N 3.41Å; D61-T65 PolarHBondContact N-O 2.99Å; D61-T65 WeakPolarHBondContact OD1-CB 3.44Å; D61-T65 PolarHBondContact OD1-N 3.37Å; D61-T65 PolarHBondContact OD1-OG1 3.23Å; D61-L67 HydrophobicContact CB-CD1 4.09Å; D61-L67 HydrophobicContact CB-CD2 4.23Å; D61-L67 HydrophobicContact CB-CG 4.3Å
62	S	86.9	Confident	91.9	Very high	84 Å²	84	23.9 Å²	23.9	59%	0.587	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-13.8	177.6	63	0	0	0	0	114.7
63	Q	85.4	Confident	92.3	Very high	134 Å²	134	23.1 Å²	23.1	63%	0.626	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.1	9	175.9	-58.7	-175.5	-4.6	0	0	111.8	D61 T65	D61-Q63 PolarHBondContact O-N 2.6Å; D61-Q63 WeakPolarHBondContact OD1-CA 3.3Å; D61-Q63 WeakPolarHBondContact OD1-CB 3.31Å; D61-Q63 PolarHBondContact OD1-N 2.89Å; Q63-T65 PolarHBondContact O-N 3.36Å
64	Y	84.4	Confident	92.3	Very high	138 Å²	138	22.9 Å²	22.9	54%	0.541	12%	0.116	S	C	.	.			trans	59.7	27.5	-174.2	-61	-86.3	0	0	0	113	Q60 D61 E109	Q60-Y64 PolarHBondContact OE1-O 3.18Å; D61-Y64 PolarHBondContact O-N 3.39Å; D61-Y64 PolarHBondContact OD1-N 3.41Å; Y64-E109 WeakPolarHBondContact CE1-OE2 3.4Å
65	T	85	Confident	92.3	Very high	38 Å²	38	24.7 Å²	24.7	23%	0.233	12%	0.124	C	C	.	.			trans	-82.6	127.1	173.3	-49.2	0	0	0	0	108.8	Q60 D61 Q63 L67	Q60-T65 WeakPolarHBondContact CA-O 3.3Å; Q60-T65 WeakPolarHBondContact CB-O 3.33Å; D61-T65 PolarHBondContact N-O 2.99Å; D61-T65 WeakPolarHBondContact OD1-CB 3.44Å; D61-T65 PolarHBondContact OD1-N 3.37Å; D61-T65 PolarHBondContact OD1-OG1 3.23Å; Q63-T65 PolarHBondContact O-N 3.36Å; T65-L67 PolarHBondContact O-N 2.84Å
66	H	87.5	Confident	92.2	Very high	20 Å²	20	27.4 Å²	27.4	9%	0.093	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	125.1	173.6	-177.1	75.3	0	0	0	110.9	S58 A68 F69 W169 M179	S58-H66 PolarHBondContact OG-ND1 3.37Å; H66-A68 PolarHBondContact CE1-O 3.22Å; H66-F69 AromaticContact CE1-CD2 3.69Å; H66-F69 AromaticContact CE1-CE2 3.66Å; H66-F69 AromaticContact CE1-CG 3.95Å; H66-F69 AromaticContact CE1-CZ 3.93Å; H66-F69 AromaticContact NE2-CD2 3.47Å; H66-F69 WeakPolarHBondContact NE2-CD2 3.19Å; H66-F69 AromaticContact NE2-CE2 3.4Å; H66-F69 WeakPolarHBondContact NE2-CE2 3.16Å; H66-W169 HydrophobicContact CB-CZ3 4.15Å; H66-W169 AromaticContact CE1-CZ3 3.78Å; H66-W169 AromaticContact CG-CZ3 3.74Å; H66-W169 AromaticContact ND1-CE3 3.91Å; H66-W169 AromaticContact ND1-CZ3 3.31Å; H66-W169 VanDerWaalsContact ND1-CZ3 3.31Å; H66-W169 WeakPolarHBondContact ND1-CZ3 3.5Å; H66-M179 HydrophobicContact CB-SD 3.81Å
67	L	90.5	Very high	92.3	Very high	25 Å²	25	27.4 Å²	27.4	13%	0.131	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-46	178.8	-62.3	177	0	0	0	111.6	L59 D61 T65 R88 I91	L59-L67 PolarHBondContact O-N 2.83Å; D61-L67 HydrophobicContact CB-CD1 4.09Å; D61-L67 HydrophobicContact CB-CD2 4.23Å; D61-L67 HydrophobicContact CB-CG 4.3Å; T65-L67 PolarHBondContact O-N 2.84Å; L67-R88 HydrophobicContact CD1-CG 4.17Å; L67-I91 HydrophobicContact CD1-CG1 4.31Å
68	A	92.9	Very high	92.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.8	160.9	-176.2	0	0	0	0	0	109.9	L59 H66 A84 P221	L59-A68 WeakPolarHBondContact CB-O 3.28Å; L59-A68 PolarHBondContact N-O 2.93Å; H66-A68 PolarHBondContact CE1-O 3.22Å; A68-A84 HydrophobicContact CB-CB 3.69Å; A68-P221 CarbonylContact C-O 3.59Å; A68-P221 VanDerWaalsContact CA-O 3.29Å; A68-P221 WeakPolarHBondContact CA-O 3.5Å; A68-P221 HydrophobicContact CB-CB 4.4Å; A68-P221 VanDerWaalsContact CB-O 3.28Å; A68-P221 WeakPolarHBondContact CB-O 3.38Å
69	F	94.6	Very high	92.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	159	162.5	-73.7	-86	0	0	0	111	V56 V57 H66 S80 I97 W169 L184 D220 P221	V56-F69 HydrophobicContact CG1-CD1 3.83Å; V56-F69 HydrophobicContact CG1-CE1 4.4Å; V57-F69 WeakPolarHBondContact O-CA 3.45Å; V57-F69 WeakPolarHBondContact O-CD1 3.42Å; H66-F69 AromaticContact CE1-CD2 3.69Å; H66-F69 AromaticContact CE1-CE2 3.66Å; H66-F69 AromaticContact CE1-CG 3.95Å; H66-F69 AromaticContact CE1-CZ 3.93Å; H66-F69 AromaticContact NE2-CD2 3.47Å; H66-F69 WeakPolarHBondContact NE2-CD2 3.19Å; H66-F69 AromaticContact NE2-CE2 3.4Å; H66-F69 WeakPolarHBondContact NE2-CE2 3.16Å; F69-S80 PolarHBondContact O-OG 3.29Å; F69-I97 HydrophobicContact CD1-CD1 4.05Å; F69-I97 HydrophobicContact CE1-CD1 3.66Å; F69-W169 HydrophobicContact CE1-CD2 4.22Å; F69-W169 HydrophobicContact CE1-CE3 4.2Å; F69-W169 HydrophobicContact CE2-CE3 4.31Å; F69-W169 HydrophobicContact CZ-CB 4.18Å; F69-W169 AromaticContact CZ-CD2 3.64Å; F69-W169 HydrophobicContact CZ-CD2 3.64Å; F69-W169 AromaticContact CZ-CE3 3.57Å; F69-W169 HydrophobicContact CZ-CE3 3.57Å; F69-W169 AromaticContact CZ-CG 3.94Å; F69-W169 HydrophobicContact CZ-CG 3.94Å; F69-W169 HydrophobicContact CZ-CZ3 4.27Å; F69-L184 HydrophobicContact CE1-CD1 3.98Å; F69-L184 HydrophobicContact CZ-CD1 4.27Å; F69-D220 HydrophobicContact CD2-CB 3.4Å; F69-D220 VanDerWaalsContact CD2-CB 3.4Å; F69-D220 HydrophobicContact CE2-CB 3.34Å; F69-D220 WeakPolarHBondContact CE2-OD2 3.48Å; F69-P221 PolarHBondContact N-O 2.92Å
70	G	96.6	Very high	92.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	175.6	170.9	0	0	0	0	0	111.5	V57 L79	V57-G70 VanDerWaalsContact CG2-C 3.42Å; V57-G70 WeakPolarHBondContact CG2-O 3.38Å; V57-G70 PolarHBondContact N-O 2.93Å; V57-G70 PolarHBondContact O-N 2.9Å; G70-L79 CarbonylContact C-O 3.59Å; G70-L79 WeakPolarHBondContact CA-O 3.3Å
71	C	97.1	Very high	92.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	130.3	177.6	-153.6	0	0	0	0	112.4	W55 L73 V78 L79 I148 P224 L237	W55-C71 CarbonylContact O-C 3.51Å; W55-C71 VanDerWaalsContact O-CA 3.27Å; W55-C71 WeakPolarHBondContact O-CA 3.37Å; C71-L73 PolarHBondContact O-N 2.88Å; C71-V78 CarbonylContact O-C 3.54Å; C71-V78 WeakPolarHBondContact O-CA 3.4Å; C71-L79 PolarHBondContact N-O 3.25Å; C71-L79 PolarHBondContact O-N 3.12Å; C71-I148 WeakPolarHBondContact SG-CG2 3.44Å; C71-P224 HydrophobicContact CB-CB 4.12Å; C71-L237 HydrophobicContact CB-CD1 4.32Å; C71-L237 HydrophobicContact CB-CD2 3.95Å
72	I	97.1	Very high	93.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	119.8	179.7	-59	175.7	0	0	0	109.2	W55 V57 S74 V78 V95 M139 F141 V145 S147 I148	W55-I72 HydrophobicContact CB-CB 4.4Å; W55-I72 PolarHBondContact O-N 3.11Å; V57-I72 HydrophobicContact CG1-CD1 3.67Å; V57-I72 HydrophobicContact CG1-CG1 3.55Å; I72-S74 WeakPolarHBondContact CG2-O 3.11Å; I72-V78 HydrophobicContact CG1-CG2 4.45Å; I72-V95 HydrophobicContact CD1-CG1 4.23Å; I72-M139 HydrophobicContact CD1-SD 3.97Å; I72-M139 HydrophobicContact CG1-CE 4.44Å; I72-M139 HydrophobicContact CG1-SD 4.06Å; I72-M139 HydrophobicContact CG2-CE 3.96Å; I72-M139 HydrophobicContact CG2-SD 4.38Å; I72-F141 HydrophobicContact CG2-CE1 3.86Å; I72-F141 HydrophobicContact CG2-CZ 3.97Å; I72-V145 HydrophobicContact CD1-CG1 3.68Å; I72-S147 CarbonylContact O-C 3.59Å; I72-S147 VanDerWaalsContact O-CA 3.3Å; I72-S147 WeakPolarHBondContact O-CA 3.41Å; I72-I148 PolarHBondContact O-N 3.07Å
73	L	95.4	Very high	93.6	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.016	11%	0.111	C	C	.	.			trans	-97.7	-30.1	174.1	-59.9	-170.4	0	0	0	112.4	C71 W77 L79 L132 S147 I148 F150 L237 I264 L278	C71-L73 PolarHBondContact O-N 2.88Å; L73-W77 HydrophobicContact CB-CB 4.31Å; L73-W77 PolarHBondContact N-O 3.26Å; L73-L79 HydrophobicContact CD1-CB 3.83Å; L73-L79 HydrophobicContact CD1-CD1 4.19Å; L73-L79 HydrophobicContact CD1-CD2 4.46Å; L73-L79 HydrophobicContact CD1-CG 4.4Å; L73-L79 HydrophobicContact CD2-CB 4.23Å; L73-L79 HydrophobicContact CG-CB 3.95Å; L73-L132 HydrophobicContact CD1-CD1 3.97Å; L73-S147 WeakPolarHBondContact O-CB 2.99Å; L73-I148 HydrophobicContact CD2-CG2 4.15Å; L73-F150 HydrophobicContact CD2-CD1 4.15Å; L73-L237 HydrophobicContact CD2-CD2 4.16Å; L73-I264 HydrophobicContact CD1-CG2 3.71Å; L73-L278 HydrophobicContact CB-CD2 3.63Å; L73-L278 WeakPolarHBondContact O-CD2 3.46Å
74	S	93.3	Very high	93.9	Very high	1 Å²	1	18 Å²	18	1%	0.007	9%	0.089	C	C	.	.	S	Bend	trans	-157.3	-174.1	173.6	76.8	0	0	0	0	110.7	I72 F76 W77 M139 S277	I72-S74 WeakPolarHBondContact CG2-O 3.11Å; S74-F76 PolarHBondContact O-N 3.3Å; S74-F76 VanDerWaalsContact O-N 3.12Å; S74-F76 PolarHBondContact OG-N 3.47Å; S74-W77 PolarHBondContact N-O 2.69Å; S74-W77 PolarHBondContact O-N 3.4Å; S74-W77 WeakPolarHBondContact OG-CB 3.23Å; S74-W77 PolarHBondContact OG-N 3.08Å; S74-M139 WeakPolarHBondContact O-CE 3.26Å; S74-S277 WeakPolarHBondContact CB-OG 2.89Å
75	E	93.4	Very high	94.3	Very high	41 Å²	41	11.5 Å²	11.5	19%	0.192	6%	0.064	C	C	.	.	S	Bend	trans	-60.3	-20	176.4	-56.2	88	164.3	0	0	113.3	T28 A138 M139 F141 S277	T28-E75 VanDerWaalsContact CG2-OE1 3.24Å; T28-E75 WeakPolarHBondContact CG2-OE1 3.42Å; E75-A138 HydrophobicContact CB-CB 4.24Å; E75-A138 CarbonylContact O-C 3.54Å; E75-A138 WeakPolarHBondContact O-CA 3.37Å; E75-M139 WeakPolarHBondContact O-CB 3.4Å; E75-M139 WeakPolarHBondContact O-CE 3.4Å; E75-M139 PolarHBondContact O-N 3.35Å; E75-F141 HydrophobicContact CG-CD1 4.4Å; E75-F141 HydrophobicContact CG-CD2 4.4Å; E75-F141 HydrophobicContact CG-CE1 4.14Å; E75-F141 HydrophobicContact CG-CE2 4.13Å; E75-F141 HydrophobicContact CG-CZ 4Å; E75-S277 WeakPolarHBondContact OE2-CB 3.05Å
76	F	94.6	Very high	94.6	Very high	56 Å²	56	12.8 Å²	12.8	25%	0.246	7%	0.067	C	C	.	.	S	Bend	trans	-117.3	-18.1	-180	-69.7	-83.7	0	0	0	113.8	S74 K134 T135 A138 P273	S74-F76 PolarHBondContact O-N 3.3Å; S74-F76 VanDerWaalsContact O-N 3.12Å; S74-F76 PolarHBondContact OG-N 3.47Å; F76-K134 HydrophobicContact CB-CG 4.41Å; F76-K134 CarbonylContact O-C 3.52Å; F76-K134 VanDerWaalsContact O-CA 3.3Å; F76-K134 WeakPolarHBondContact O-CA 3.41Å; F76-T135 WeakPolarHBondContact CA-OG1 3.07Å; F76-T135 PolarHBondContact O-N 3.11Å; F76-T135 PolarHBondContact O-OG1 2.72Å; F76-A138 HydrophobicContact CE1-CB 3.9Å; F76-A138 HydrophobicContact CE2-CB 3.89Å; F76-A138 HydrophobicContact CZ-CB 3.53Å; F76-P273 HydrophobicContact CD2-CG 4.02Å; F76-P273 HydrophobicContact CE2-CG 4.07Å
77	W	96.2	Very high	94.6	Very high	2 Å²	2	18.5 Å²	18.5	1%	0.008	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128.6	-164.3	-67	115.3	0	0	0	111.6	L73 S74 I116 L132 K134 A268 A271	L73-W77 HydrophobicContact CB-CB 4.31Å; L73-W77 PolarHBondContact N-O 3.26Å; S74-W77 PolarHBondContact N-O 2.69Å; S74-W77 PolarHBondContact O-N 3.4Å; S74-W77 WeakPolarHBondContact OG-CB 3.23Å; S74-W77 PolarHBondContact OG-N 3.08Å; W77-I116 HydrophobicContact CH2-CD1 4.02Å; W77-I116 HydrophobicContact CZ3-CD1 4.04Å; W77-L132 HydrophobicContact CB-CD1 4.43Å; W77-L132 HydrophobicContact CD2-CD2 4.04Å; W77-L132 HydrophobicContact CD2-CG 4.33Å; W77-L132 HydrophobicContact CE3-CD1 4.15Å; W77-L132 HydrophobicContact CE3-CD2 3.44Å; W77-L132 VanDerWaalsContact CE3-CD2 3.44Å; W77-L132 HydrophobicContact CE3-CG 3.45Å; W77-L132 VanDerWaalsContact CE3-CG 3.45Å; W77-L132 HydrophobicContact CH2-CD2 4.18Å; W77-L132 HydrophobicContact CZ3-CD2 3.48Å; W77-L132 VanDerWaalsContact CZ3-CD2 3.48Å; W77-L132 HydrophobicContact CZ3-CG 3.72Å; W77-K134 HydrophobicContact CD2-CG 4.33Å; W77-K134 HydrophobicContact CE3-CB 3.83Å; W77-K134 HydrophobicContact CE3-CG 4.1Å; W77-K134 HydrophobicContact CH2-CB 3.83Å; W77-K134 HydrophobicContact CH2-CD 3.8Å; W77-K134 HydrophobicContact CH2-CG 3.85Å; W77-K134 HydrophobicContact CZ2-CB 4.49Å; W77-K134 HydrophobicContact CZ2-CD 3.95Å; W77-K134 HydrophobicContact CZ2-CG 4.04Å; W77-K134 HydrophobicContact CZ3-CB 3.47Å; W77-K134 VanDerWaalsContact CZ3-CB 3.47Å; W77-K134 HydrophobicContact CZ3-CD 4.31Å; W77-K134 HydrophobicContact CZ3-CG 3.9Å; W77-A268 HydrophobicContact CD2-CB 4.23Å; W77-A268 HydrophobicContact CZ2-CB 3.99Å; W77-A268 WeakPolarHBondContact CZ2-O 3.3Å; W77-A271 HydrophobicContact CH2-CB 3.83Å; W77-A271 HydrophobicContact CZ2-CB 4.38Å
78	V	97.7	Very high	94.6	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	136.3	172.5	176.9	0	0	0	0	109	V57 L59 C71 I72 V93 L133 M139	V57-V78 HydrophobicContact CG2-CG1 3.7Å; L59-V78 HydrophobicContact CD2-CG1 4.32Å; C71-V78 CarbonylContact O-C 3.54Å; C71-V78 WeakPolarHBondContact O-CA 3.4Å; I72-V78 HydrophobicContact CG1-CG2 4.45Å; V78-V93 HydrophobicContact CG2-CG1 4.04Å; V78-V93 HydrophobicContact CG2-CG2 4.16Å; V78-L133 HydrophobicContact CB-CB 4.42Å; V78-L133 PolarHBondContact N-O 2.97Å; V78-L133 PolarHBondContact O-N 2.86Å; V78-M139 HydrophobicContact CG2-CE 3.78Å; V78-M139 HydrophobicContact CG2-SD 4.23Å
79	L	97.9	Very high	94.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	138.1	173.1	-161.3	72.5	0	0	0	110.4	G70 C71 L73 I130 L132 L237 V240 V257 I264	G70-L79 CarbonylContact C-O 3.59Å; G70-L79 WeakPolarHBondContact CA-O 3.3Å; C71-L79 PolarHBondContact N-O 3.25Å; C71-L79 PolarHBondContact O-N 3.12Å; L73-L79 HydrophobicContact CD1-CB 3.83Å; L73-L79 HydrophobicContact CD1-CD1 4.19Å; L73-L79 HydrophobicContact CD1-CD2 4.46Å; L73-L79 HydrophobicContact CD1-CG 4.4Å; L73-L79 HydrophobicContact CD2-CB 4.23Å; L73-L79 HydrophobicContact CG-CB 3.95Å; L79-I130 HydrophobicContact CD1-CD1 3.95Å; L79-I130 HydrophobicContact CD1-CG1 3.87Å; L79-I130 HydrophobicContact CD2-CD1 4.2Å; L79-I130 HydrophobicContact CG-CD1 4.4Å; L79-I130 HydrophobicContact CG-CG1 4.28Å; L79-L132 HydrophobicContact CD1-CD1 3.9Å; L79-L237 HydrophobicContact CD2-CD2 3.67Å; L79-V240 HydrophobicContact CD2-CG1 4.26Å; L79-V257 HydrophobicContact CD2-CG1 3.98Å; L79-V257 HydrophobicContact CD2-CG2 3.83Å; L79-I264 HydrophobicContact CD1-CD1 3.95Å; L79-I264 HydrophobicContact CD1-CG1 4.03Å; L79-I264 HydrophobicContact CD2-CD1 3.98Å
80	S	97.6	Very high	93.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	-159.9	170.8	-170.2	0	0	0	0	109.3	F69 A131	F69-S80 PolarHBondContact O-OG 3.29Å; S80-A131 PolarHBondContact N-O 3.31Å; S80-A131 PolarHBondContact O-N 2.9Å
81	I	96.4	Very high	93.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.182	C	C	.	.			trans	-104	147.2	-179.9	59.3	165.6	0	0	0	111.5	S83 A84 I85 N129 P221 V240 L241	I81-S83 WeakPolarHBondContact CD1-OG 3.39Å; I81-A84 HydrophobicContact CD1-CB 4.17Å; I81-A84 HydrophobicContact CG1-CB 3.98Å; I81-I85 WeakPolarHBondContact O-CG1 3.27Å; I81-N129 WeakPolarHBondContact CB-OD1 3.36Å; I81-P221 HydrophobicContact CD1-CB 3.48Å; I81-P221 VanDerWaalsContact CD1-CB 3.48Å; I81-V240 HydrophobicContact CG2-CB 4.21Å; I81-V240 HydrophobicContact CG2-CG2 3.76Å; I81-L241 WeakPolarHBondContact CG2-O 3.47Å
82	A	96.9	Very high	93.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.8	-41.1	-178.1	0	0	0	0	0	113.2	A84 I85 Q86 I117 F121 N129 A131	A82-A84 PolarHBondContact O-N 2.7Å; A82-A84 VanDerWaalsContact O-N 3.15Å; A82-I85 PolarHBondContact O-N 3.44Å; A82-Q86 WeakPolarHBondContact O-CB 3.46Å; A82-Q86 PolarHBondContact O-N 3.45Å; A82-I117 HydrophobicContact CB-CD1 4.07Å; A82-I117 HydrophobicContact CB-CG2 3.69Å; A82-F121 HydrophobicContact CB-CB 4.3Å; A82-F121 HydrophobicContact CB-CD1 3.64Å; A82-F121 HydrophobicContact CB-CD2 3.81Å; A82-F121 HydrophobicContact CB-CE1 3.87Å; A82-F121 HydrophobicContact CB-CE2 4.05Å; A82-F121 HydrophobicContact CB-CG 3.61Å; A82-F121 HydrophobicContact CB-CZ 4.08Å; A82-N129 WeakPolarHBondContact CA-OD1 3.4Å; A82-N129 WeakPolarHBondContact CB-OD1 3.39Å; A82-N129 PolarHBondContact N-OD1 3.15Å; A82-A131 HydrophobicContact CB-CB 4.29Å
83	S	94.6	Very high	93.8	Very high	35 Å²	35	38.6 Å²	38.6	25%	0.245	19%	0.189	C	C	.	.	H	α-helix	trans	-57	-34	-174.3	60.6	0	0	0	0	112.8	I81 N129	I81-S83 WeakPolarHBondContact CD1-OG 3.39Å; S83-N129 PolarHBondContact N-OD1 3.01Å; S83-N129 PolarHBondContact OG-ND2 2.87Å; S83-N129 PolarHBondContact OG-OD1 3.25Å
84	A	92.6	Very high	93.7	Very high	20 Å²	20	38.5 Å²	38.5	17%	0.165	19%	0.188	C	C	.	.	H	α-helix	trans	-77.2	-24.1	178.7	0	0	0	0	0	114.1	A68 I81 A82	A68-A84 HydrophobicContact CB-CB 3.69Å; I81-A84 HydrophobicContact CD1-CB 4.17Å; I81-A84 HydrophobicContact CG1-CB 3.98Å; A82-A84 PolarHBondContact O-N 2.7Å; A82-A84 VanDerWaalsContact O-N 3.15Å
85	I	92.8	Very high	93.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-125.4	-15.1	-165.4	73.4	178.1	0	0	0	116.1	L59 I81 A82 N87 R88 I91 I115 I117 A131 L133	L59-I85 HydrophobicContact CD1-CG2 4.28Å; I81-I85 WeakPolarHBondContact O-CG1 3.27Å; A82-I85 PolarHBondContact O-N 3.44Å; I85-N87 PolarHBondContact O-N 3.25Å; I85-R88 WeakPolarHBondContact O-CB 3.34Å; I85-R88 PolarHBondContact O-N 3.45Å; I85-I91 HydrophobicContact CB-CD1 3.76Å; I85-I91 HydrophobicContact CG2-CD1 3.83Å; I85-I115 HydrophobicContact CD1-CG2 3.83Å; I85-I115 HydrophobicContact CG1-CG2 4.12Å; I85-I117 HydrophobicContact CD1-CD1 4.3Å; I85-I117 HydrophobicContact CG1-CD1 3.82Å; I85-A131 HydrophobicContact CD1-CB 3.41Å; I85-A131 VanDerWaalsContact CD1-CB 3.41Å; I85-A131 HydrophobicContact CG1-CB 4Å; I85-L133 HydrophobicContact CD1-CD1 3.64Å; I85-L133 HydrophobicContact CD1-CD2 3.88Å; I85-L133 HydrophobicContact CD1-CG 3.77Å
86	Q	90.2	Very high	93.6	Very high	65 Å²	65	37.4 Å²	37.4	30%	0.304	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-27.4	-173.2	59.8	178.1	-30.4	0	0	116.2	A82 I117 N123	A82-Q86 WeakPolarHBondContact O-CB 3.46Å; A82-Q86 PolarHBondContact O-N 3.45Å; Q86-I117 HydrophobicContact CB-CD1 4.15Å; Q86-I117 HydrophobicContact CB-CG1 4.23Å; Q86-N123 PolarHBondContact NE2-OD1 2.82Å
87	N	88.8	Confident	93.3	Very high	140 Å²	140	35 Å²	35	75%	0.749	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.8	16.2	-177.3	-65.7	-41	0	0	0	113	I85	I85-N87 PolarHBondContact O-N 3.25Å
88	R	89.1	Confident	92.6	Very high	120 Å²	120	36 Å²	36	45%	0.453	18%	0.184	S	C	.	.			trans	-104.6	141.2	-177.6	-55.7	-63.1	-176.1	165.8	1.3	109.5	L67 I85 I91 I115	L67-R88 HydrophobicContact CD1-CG 4.17Å; I85-R88 WeakPolarHBondContact O-CB 3.34Å; I85-R88 PolarHBondContact O-N 3.45Å; R88-I91 HydrophobicContact CB-CD1 3.84Å; R88-I91 HydrophobicContact CB-CG1 3.86Å; R88-I115 WeakPolarHBondContact O-CD1 3.39Å
89	K	83.2	Confident	91.6	Very high	186 Å²	186	40.9 Å²	40.9	81%	0.809	21%	0.21	S	C	*	.	S	Bend	trans	-108.8	-39.6	178.5	-65.8	-174.9	179.4	-178.5	0	111.8
90	D	91.3	Very high	90.4	Very high	114 Å²	114	42.3 Å²	42.3	61%	0.61	22%	0.217	S	C	*	.			trans	-109.2	100.8	-177.8	-52.4	-57	0	0	0	108.6
91	I	95.3	Very high	89	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138	174.5	-58.8	-179.5	0	0	0	108.5	L59 Q60 L67 I85 R88 V112 I115 L133	L59-I91 HydrophobicContact CB-CG2 4.18Å; L59-I91 HydrophobicContact CD2-CG2 4.32Å; Q60-I91 WeakPolarHBondContact O-CA 3.31Å; L67-I91 HydrophobicContact CD1-CG1 4.31Å; I85-I91 HydrophobicContact CB-CD1 3.76Å; I85-I91 HydrophobicContact CG2-CD1 3.83Å; R88-I91 HydrophobicContact CB-CD1 3.84Å; R88-I91 HydrophobicContact CB-CG1 3.86Å; I91-V112 HydrophobicContact CB-CB 4.16Å; I91-V112 HydrophobicContact CB-CG2 4.06Å; I91-V112 HydrophobicContact CG2-CG2 3.91Å; I91-V112 WeakPolarHBondContact O-CB 3.43Å; I91-V112 PolarHBondContact O-N 3.29Å; I91-I115 HydrophobicContact CD1-CD1 3.59Å; I91-I115 HydrophobicContact CD1-CG1 4.48Å; I91-I115 HydrophobicContact CG1-CD1 4.21Å; I91-L133 HydrophobicContact CD1-CD2 4.08Å; I91-L133 HydrophobicContact CG2-CD2 4.16Å
92	V	95.4	Very high	87.3	Confident	23 Å²	23	49.2 Å²	49.2	14%	0.139	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	139.2	168	-64.9	0	0	0	0	110.1	Q60 I94	Q60-V92 HydrophobicContact CB-CG2 3.95Å; Q60-V92 PolarHBondContact N-O 2.83Å; Q60-V92 PolarHBondContact O-N 2.91Å; V92-I94 HydrophobicContact CB-CD1 4.25Å; V92-I94 HydrophobicContact CG2-CD1 3.7Å; V92-I94 HydrophobicContact CG2-CG1 4.48Å
93	V	96.7	Very high	85.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	115.5	170.9	-176.9	0	0	0	0	107.9	V57 L59 V78 V95 E109 Y110 V112 T135	V57-V93 HydrophobicContact CB-CG1 3.76Å; V57-V93 HydrophobicContact CG1-CG1 3.92Å; V57-V93 HydrophobicContact CG2-CG1 3.84Å; L59-V93 HydrophobicContact CD2-CB 4.42Å; L59-V93 HydrophobicContact CD2-CG1 4.47Å; L59-V93 HydrophobicContact CD2-CG2 3.82Å; V78-V93 HydrophobicContact CG2-CG1 4.04Å; V78-V93 HydrophobicContact CG2-CG2 4.16Å; V93-V95 HydrophobicContact CG1-CG1 4.04Å; V93-E109 CarbonylContact O-C 3.56Å; V93-E109 VanDerWaalsContact O-CA 3.27Å; V93-E109 WeakPolarHBondContact O-CA 3.44Å; V93-Y110 PolarHBondContact N-O 3.25Å; V93-Y110 PolarHBondContact O-N 3.23Å; V93-V112 HydrophobicContact CG2-CG2 3.64Å; V93-T135 HydrophobicContact CB-CG2 4.38Å; V93-T135 HydrophobicContact CG2-CG2 3.86Å
94	I	94.3	Very high	83.9	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.01	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	125.6	171.9	-38.4	-62	0	0	0	109.9	V57 S58 Q60 V92 I97 M100 H107 E109	V57-I94 WeakPolarHBondContact CA-O 3.33Å; V57-I94 WeakPolarHBondContact CB-O 3.43Å; S58-I94 PolarHBondContact N-O 2.82Å; S58-I94 PolarHBondContact O-N 2.88Å; Q60-I94 HydrophobicContact CG-CG1 3.93Å; V92-I94 HydrophobicContact CB-CD1 4.25Å; V92-I94 HydrophobicContact CG2-CD1 3.7Å; V92-I94 HydrophobicContact CG2-CG1 4.48Å; I94-I97 VanDerWaalsContact O-CG2 3.28Å; I94-I97 WeakPolarHBondContact O-CG2 3.46Å; I94-M100 HydrophobicContact CB-CE 3.82Å; I94-M100 HydrophobicContact CG2-CE 3.05Å; I94-H107 HydrophobicContact CG2-CB 3.5Å; I94-E109 HydrophobicContact CD1-CB 3.53Å
95	V	94	Very high	82.1	Confident	6 Å²	6	65.4 Å²	65.4	4%	0.036	34%	0.339	C	S	.	.			trans	-108.9	167.2	-175.5	-54.7	0	0	0	0	112	V57 I72 V93 I97 T108 Y110 M139 V145	V57-V95 HydrophobicContact CG1-CB 4.36Å; V57-V95 HydrophobicContact CG1-CG1 3.82Å; I72-V95 HydrophobicContact CD1-CG1 4.23Å; V93-V95 HydrophobicContact CG1-CG1 4.04Å; V95-I97 PolarHBondContact O-N 2.98Å; V95-T108 HydrophobicContact CG2-CG2 3.71Å; V95-T108 PolarHBondContact N-O 2.9Å; V95-T108 VanDerWaalsContact N-O 3.11Å; V95-Y110 HydrophobicContact CG1-CD2 3.93Å; V95-Y110 HydrophobicContact CG1-CE2 4.1Å; V95-Y110 HydrophobicContact CG2-CD2 4.3Å; V95-Y110 HydrophobicContact CG2-CE2 3.81Å; V95-M139 HydrophobicContact CG1-SD 4.11Å; V95-V145 HydrophobicContact CB-CG1 4.36Å; V95-V145 HydrophobicContact CB-CG2 3.89Å; V95-V145 HydrophobicContact CG1-CG1 4.45Å; V95-V145 HydrophobicContact CG2-CG1 4.48Å; V95-V145 HydrophobicContact CG2-CG2 3.57Å
96	G	90.5	Very high	80.7	Confident	13 Å²	13	69.6 Å²	69.6	13%	0.134	37%	0.374	C	S	.	.			trans	65.9	26.9	177.8	0	0	0	0	0	113.7	S98 N99	G96-S98 PolarHBondContact O-N 2.03Å; G96-N99 PolarHBondContact O-N 3.24Å
97	I	88	Confident	80.3	Confident	5 Å²	5	68.9 Å²	68.9	3%	0.026	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-64.5	-15.4	-169.3	66.7	168.3	0	0	0	114.3	V56 F69 I94 V95 N99 M100 W169 L184	V56-I97 HydrophobicContact CB-CD1 4.47Å; V56-I97 HydrophobicContact CG1-CD1 3.87Å; F69-I97 HydrophobicContact CD1-CD1 4.05Å; F69-I97 HydrophobicContact CE1-CD1 3.66Å; I94-I97 VanDerWaalsContact O-CG2 3.28Å; I94-I97 WeakPolarHBondContact O-CG2 3.46Å; V95-I97 PolarHBondContact O-N 2.98Å; I97-N99 PolarHBondContact O-N 3.26Å; I97-M100 HydrophobicContact CB-CE 4.19Å; I97-M100 HydrophobicContact CB-CG 4.46Å; I97-M100 HydrophobicContact CB-SD 3.69Å; I97-M100 HydrophobicContact CG2-CE 3.6Å; I97-M100 HydrophobicContact CG2-SD 3.77Å; I97-M100 WeakPolarHBondContact O-CB 3.3Å; I97-M100 PolarHBondContact O-N 2.76Å; I97-W169 HydrophobicContact CB-CZ2 4.12Å; I97-W169 HydrophobicContact CD1-CZ2 4.28Å; I97-L184 HydrophobicContact CD1-CD1 4.07Å; I97-L184 HydrophobicContact CD1-CD2 4.21Å; I97-L184 HydrophobicContact CG1-CD2 4.02Å
98	S	81.9	Confident	80.4	Confident	24 Å²	24	66.1 Å²	66.1	17%	0.168	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-68.7	-20.5	173.6	63.9	0	0	0	0	113.6	G96	G96-S98 PolarHBondContact O-N 2.03Å
99	N	76.6	Confident	80.6	Confident	102 Å²	102	63.9 Å²	63.9	55%	0.545	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-115.8	23.2	179.3	-167.2	44.5	0	0	0	111.5	G96 I97 D101 L144	G96-N99 PolarHBondContact O-N 3.24Å; I97-N99 PolarHBondContact O-N 3.26Å; N99-D101 PolarHBondContact O-N 2.75Å; N99-L144 HydrophobicContact CB-CD1 4.25Å; N99-L144 HydrophobicContact CB-CD2 4.36Å
100	M	73.3	Confident	81.2	Confident	29 Å²	29	55.7 Å²	55.7	14%	0.143	32%	0.318	C	S	.	.			trans	-67	131	175.3	-92.6	172.6	168.2	0	0	110.5	I94 I97 H107 W169 M181	I94-M100 HydrophobicContact CB-CE 3.82Å; I94-M100 HydrophobicContact CG2-CE 3.05Å; I97-M100 HydrophobicContact CB-CE 4.19Å; I97-M100 HydrophobicContact CB-CG 4.46Å; I97-M100 HydrophobicContact CB-SD 3.69Å; I97-M100 HydrophobicContact CG2-CE 3.6Å; I97-M100 HydrophobicContact CG2-SD 3.77Å; I97-M100 WeakPolarHBondContact O-CB 3.3Å; I97-M100 PolarHBondContact O-N 2.76Å; M100-H107 HydrophobicContact CE-CB 4.11Å; M100-W169 HydrophobicContact SD-CH2 4.16Å; M100-W169 HydrophobicContact SD-CZ2 3.73Å; M100-M181 HydrophobicContact CB-CE 3.87Å; M100-M181 HydrophobicContact CE-SD 4.31Å; M100-M181 HydrophobicContact CG-CE 4.1Å; M100-M181 HydrophobicContact CG-SD 4.33Å; M100-M181 HydrophobicContact SD-CE 4.35Å; M100-M181 HydrophobicContact SD-SD 3.84Å
101	D	66.4	Low	81.4	Confident	53 Å²	53	53.3 Å²	53.3	28%	0.283	31%	0.308	S	S	.	.			trans	-106.5	114.7	173	-178.1	-14.8	0	0	0	107.5	N99 S103 K104 M181	N99-D101 PolarHBondContact O-N 2.75Å; D101-S103 PolarHBondContact O-N 3.43Å; D101-S103 VanDerWaalsContact O-N 3.07Å; D101-S103 VanDerWaalsContact OD1-CB 3.3Å; D101-S103 WeakPolarHBondContact OD1-CB 3.23Å; D101-S103 PolarHBondContact OD1-N 3.28Å; D101-S103 PolarHBondContact OD1-OG 2.82Å; D101-S103 PolarHBondContact OD2-OG 3.44Å; D101-K104 HydrophobicContact CB-CB 4.23Å; D101-K104 HydrophobicContact CB-CD 3.88Å; D101-K104 HydrophobicContact CB-CG 3.89Å; D101-K104 PolarHBondContact O-N 2.89Å; D101-K104 VanDerWaalsContact OD2-CE 3.31Å; D101-K104 WeakPolarHBondContact OD2-CE 3.29Å; D101-M181 WeakPolarHBondContact O-CE 3.21Å
102	P	61.9	Low	81.5	Confident	92 Å²	92	53.9 Å²	53.9	60%	0.597	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-15.8	179.4	25.1	-33.1	0	0	0	113.4	M181	P102-M181 HydrophobicContact CB-CB 4.29Å; P102-M181 HydrophobicContact CB-CE 4.41Å
103	S	59.4	Low	81.5	Confident	94 Å²	94	56.4 Å²	56.4	66%	0.657	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-11	175.3	74.6	0	0	0	0	113.8	D101	D101-S103 PolarHBondContact O-N 3.43Å; D101-S103 VanDerWaalsContact O-N 3.07Å; D101-S103 VanDerWaalsContact OD1-CB 3.3Å; D101-S103 WeakPolarHBondContact OD1-CB 3.23Å; D101-S103 PolarHBondContact OD1-N 3.28Å; D101-S103 PolarHBondContact OD1-OG 2.82Å; D101-S103 PolarHBondContact OD2-OG 3.44Å
104	K	60.3	Low	81.4	Confident	128 Å²	128	58.5 Å²	58.5	56%	0.557	34%	0.338	S	S	*	.			trans	-98	132.7	178.5	-66.7	-177.6	-173.2	169.5	0	110.1	D101 H107	D101-K104 HydrophobicContact CB-CB 4.23Å; D101-K104 HydrophobicContact CB-CD 3.88Å; D101-K104 HydrophobicContact CB-CG 3.89Å; D101-K104 PolarHBondContact O-N 2.89Å; D101-K104 VanDerWaalsContact OD2-CE 3.31Å; D101-K104 WeakPolarHBondContact OD2-CE 3.29Å; K104-H107 PolarHBondContact O-NE2 2.84Å
105	I	54.3	Low	81.5	Confident	173 Å²	173	60.8 Å²	60.8	89%	0.887	35%	0.35	S	S	*	.	S	Bend	trans	-83.8	-28.4	178.2	-59.6	171.2	0	0	0	111
106	A	63.9	Low	81.6	Confident	88 Å²	88	61.6 Å²	61.6	73%	0.727	35%	0.353	S	S	*	.			trans	-96.9	112.7	-176.5	0	0	0	0	0	111.1
107	H	81.4	Confident	82	Confident	51 Å²	51	63.1 Å²	63.1	24%	0.236	36%	0.358	C	S	.	.			trans	-110	156.9	165.7	-61.2	-58.9	0	0	0	110	I94 M100 K104 E109 M181	I94-H107 HydrophobicContact CG2-CB 3.5Å; M100-H107 HydrophobicContact CE-CB 4.11Å; K104-H107 PolarHBondContact O-NE2 2.84Å; H107-E109 PolarHBondContact O-N 2.86Å; H107-M181 VanDerWaalsContact CE1-CE 3.42Å; H107-M181 WeakPolarHBondContact CE1-CE 3.41Å; H107-M181 WeakPolarHBondContact NE2-CE 3.07Å; H107-M181 PolarHBondContact NE2-SD 2.56Å
108	T	90.8	Very high	82.4	Confident	82 Å²	82	63.4 Å²	63.4	50%	0.503	36%	0.359	S	S	.	.			trans	-70.6	118.3	171.9	-53.8	0	0	0	0	108.3	V95 Y110	V95-T108 HydrophobicContact CG2-CG2 3.71Å; V95-T108 PolarHBondContact N-O 2.9Å; V95-T108 VanDerWaalsContact N-O 3.11Å; T108-Y110 HydrophobicContact CG2-CE2 3.69Å
109	E	93.3	Very high	83.1	Confident	73 Å²	73	67.6 Å²	67.6	34%	0.341	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	152.9	-175.4	67.1	-178.9	-158.6	0	0	112.1	Y64 V93 I94 H107	Y64-E109 WeakPolarHBondContact CE1-OE2 3.4Å; V93-E109 CarbonylContact O-C 3.56Å; V93-E109 VanDerWaalsContact O-CA 3.27Å; V93-E109 WeakPolarHBondContact O-CA 3.44Å; I94-E109 HydrophobicContact CD1-CB 3.53Å; H107-E109 PolarHBondContact O-N 2.86Å
110	Y	96.2	Very high	84.1	Confident	13 Å²	13	68 Å²	68	5%	0.051	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	111.4	178.5	-64.5	-88.4	0	0	0	109.2	V93 V95 T108 T137 A138 M139 H140	V93-Y110 PolarHBondContact N-O 3.25Å; V93-Y110 PolarHBondContact O-N 3.23Å; V95-Y110 HydrophobicContact CG1-CD2 3.93Å; V95-Y110 HydrophobicContact CG1-CE2 4.1Å; V95-Y110 HydrophobicContact CG2-CD2 4.3Å; V95-Y110 HydrophobicContact CG2-CE2 3.81Å; T108-Y110 HydrophobicContact CG2-CE2 3.69Å; Y110-T137 WeakPolarHBondContact CD1-OG1 3.4Å; Y110-A138 WeakPolarHBondContact CE1-O 3.27Å; Y110-M139 HydrophobicContact CD1-CG 3.97Å; Y110-M139 HydrophobicContact CD2-CG 3.65Å; Y110-M139 HydrophobicContact CD2-SD 4.48Å; Y110-M139 HydrophobicContact CE1-CB 4.39Å; Y110-M139 HydrophobicContact CE1-CG 4.17Å; Y110-M139 HydrophobicContact CE2-CB 4.21Å; Y110-M139 HydrophobicContact CE2-CG 3.82Å; Y110-M139 HydrophobicContact CG-CG 3.72Å; Y110-H140 PolarHBondContact OH-CD2 2.99Å; Y110-H140 PolarHBondContact OH-N 3.22Å
111	P	96.6	Very high	85.2	Confident	64 Å²	64	67.9 Å²	67.9	42%	0.416	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	139.8	174.8	-24.7	34.7	0	0	0	111.7	T135 D136	P111-T135 CarbonylContact O-C 3.55Å; P111-T135 VanDerWaalsContact O-CA 3.31Å; P111-T135 WeakPolarHBondContact O-CA 3.27Å; P111-D136 PolarHBondContact O-N 2.87Å
112	V	96.8	Very high	86.4	Confident	16 Å²	16	68.1 Å²	68.1	10%	0.097	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	125.5	174.7	177.7	0	0	0	0	109.1	I91 V93 T114 I115 L133 K134	I91-V112 HydrophobicContact CB-CB 4.16Å; I91-V112 HydrophobicContact CB-CG2 4.06Å; I91-V112 HydrophobicContact CG2-CG2 3.91Å; I91-V112 WeakPolarHBondContact O-CB 3.43Å; I91-V112 PolarHBondContact O-N 3.29Å; V93-V112 HydrophobicContact CG2-CG2 3.64Å; V112-T114 WeakPolarHBondContact CG1-O 3.16Å; V112-I115 HydrophobicContact CG1-CD1 4.5Å; V112-I115 HydrophobicContact CG1-CG1 3.73Å; V112-L133 HydrophobicContact CG1-CB 4.01Å; V112-L133 HydrophobicContact CG1-CD2 4.23Å; V112-L133 HydrophobicContact CG2-CB 4.29Å; V112-L133 HydrophobicContact CG2-CD2 4.01Å; V112-K134 WeakPolarHBondContact CA-O 3.35Å; V112-K134 WeakPolarHBondContact CG1-O 3.35Å
113	N	94.3	Very high	87.8	Confident	76 Å²	76	66 Å²	66	41%	0.406	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-19	176.2	72.3	5.1	0	0	0	113.4	K134 D136	N113-K134 PolarHBondContact N-O 2.99Å; N113-K134 PolarHBondContact OD1-O 2.92Å; N113-D136 HydrophobicContact CB-CB 4.11Å; N113-D136 WeakPolarHBondContact ND2-CA 3.22Å; N113-D136 PolarHBondContact ND2-OD1 2.91Å
114	T	95.1	Very high	89.3	Confident	45 Å²	45	66.8 Å²	66.8	28%	0.276	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	127.6	-179.1	-44.7	0	0	0	0	110	V112 I116 L133 K134	V112-T114 WeakPolarHBondContact CG1-O 3.16Å; T114-I116 HydrophobicContact CG2-CD1 4.38Å; T114-I116 HydrophobicContact CG2-CG1 3.97Å; T114-L133 WeakPolarHBondContact O-CA 3.31Å; T114-K134 PolarHBondContact N-O 2.84Å; T114-K134 PolarHBondContact O-N 2.88Å
115	I	96.3	Very high	90.6	Very high	50 Å²	50	62.7 Å²	62.7	26%	0.256	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	125.1	172.2	-60.1	169.1	0	0	0	107.6	I85 R88 I91 V112 I117	I85-I115 HydrophobicContact CD1-CG2 3.83Å; I85-I115 HydrophobicContact CG1-CG2 4.12Å; R88-I115 WeakPolarHBondContact O-CD1 3.39Å; I91-I115 HydrophobicContact CD1-CD1 3.59Å; I91-I115 HydrophobicContact CD1-CG1 4.48Å; I91-I115 HydrophobicContact CG1-CD1 4.21Å; V112-I115 HydrophobicContact CG1-CD1 4.5Å; V112-I115 HydrophobicContact CG1-CG1 3.73Å; I115-I117 HydrophobicContact CG2-CD1 3.79Å; I115-I117 HydrophobicContact CG2-CG1 4.33Å
116	I	96.8	Very high	92.4	Very high	22 Å²	22	56 Å²	56	11%	0.113	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	104.7	179.9	-51.5	176.8	0	0	0	108	W77 T114 A131 L132 W263 K267 A271	W77-I116 HydrophobicContact CH2-CD1 4.02Å; W77-I116 HydrophobicContact CZ3-CD1 4.04Å; T114-I116 HydrophobicContact CG2-CD1 4.38Å; T114-I116 HydrophobicContact CG2-CG1 3.97Å; I116-A131 CarbonylContact O-C 3.58Å; I116-A131 VanDerWaalsContact O-CA 3.3Å; I116-A131 WeakPolarHBondContact O-CA 3.32Å; I116-L132 HydrophobicContact CB-CB 4.3Å; I116-L132 PolarHBondContact N-O 2.88Å; I116-L132 PolarHBondContact O-N 3.02Å; I116-W263 HydrophobicContact CG2-CH2 4.49Å; I116-W263 HydrophobicContact CG2-CZ2 4.09Å; I116-K267 HydrophobicContact CD1-CB 4.26Å; I116-K267 HydrophobicContact CG2-CB 4.25Å; I116-K267 HydrophobicContact CG2-CD 3.86Å; I116-K267 HydrophobicContact CG2-CG 4.01Å; I116-A271 HydrophobicContact CD1-CB 3.68Å
117	I	97.8	Very high	93.7	Very high	45 Å²	45	53.1 Å²	53.1	23%	0.231	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	143.9	172.7	-53.5	-56	0	0	0	109.2	A82 I85 Q86 I115 E119 F121 A131	A82-I117 HydrophobicContact CB-CD1 4.07Å; A82-I117 HydrophobicContact CB-CG2 3.69Å; I85-I117 HydrophobicContact CD1-CD1 4.3Å; I85-I117 HydrophobicContact CG1-CD1 3.82Å; Q86-I117 HydrophobicContact CB-CD1 4.15Å; Q86-I117 HydrophobicContact CB-CG1 4.23Å; I115-I117 HydrophobicContact CG2-CD1 3.79Å; I115-I117 HydrophobicContact CG2-CG1 4.33Å; I117-E119 PolarHBondContact O-N 3.47Å; I117-F121 HydrophobicContact CG2-CB 3.88Å; I117-F121 HydrophobicContact CG2-CD1 4.02Å; I117-F121 HydrophobicContact CG2-CG 4.23Å; I117-A131 HydrophobicContact CD1-CB 3.63Å
118	H	97.6	Very high	94.3	Very high	11 Å²	11	51.7 Å²	51.7	5%	0.051	28%	0.28	C	S	.	.			trans	-61	132.7	171.1	-169	-72.7	0	0	0	110.4	D120 F121 N128 I130 Y260 W263	H118-D120 VanDerWaalsContact C-N 3.26Å; H118-D120 IonicContact CE1-OD2 2.87Å; H118-D120 PolarHBondContact ND1-N 3.36Å; H118-D120 VanDerWaalsContact ND1-N 3.15Å; H118-D120 PolarHBondContact O-N 2.81Å; H118-F121 HydrophobicContact CB-CB 4.49Å; H118-F121 WeakPolarHBondContact O-CB 3.39Å; H118-F121 PolarHBondContact O-N 2.89Å; H118-N128 HydrophobicContact CB-CB 4.27Å; H118-N128 WeakPolarHBondContact ND1-CB 3.25Å; H118-I130 HydrophobicContact CB-CG2 3.7Å; H118-I130 PolarHBondContact N-O 3.25Å; H118-Y260 AromaticContact CD2-CD1 3.65Å; H118-Y260 AromaticContact CD2-CE1 3.68Å; H118-Y260 AromaticContact NE2-CD1 3.85Å; H118-Y260 AromaticContact NE2-CE1 3.74Å; H118-W263 VanDerWaalsContact CA-CZ2 3.46Å; H118-W263 HydrophobicContact CB-CH2 4.44Å; H118-W263 HydrophobicContact CB-CZ2 3.88Å; H118-W263 AromaticContact CD2-CD1 3.55Å; H118-W263 AromaticContact CD2-CD2 3.71Å; H118-W263 AromaticContact CD2-CE2 3.6Å; H118-W263 AromaticContact CD2-CG 3.73Å; H118-W263 AromaticContact CD2-NE1 3.44Å; H118-W263 PolarHBondContact CD2-NE1 3.36Å; H118-W263 AromaticContact CG-NE1 3.9Å; H118-W263 AromaticContact NE2-CD1 3.75Å
119	E	97.1	Very high	94.6	Very high	113 Å²	113	47.8 Å²	47.8	53%	0.528	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-34.3	-170.6	-59.6	95.1	134.2	0	0	112.9	I117 F121 W263 K267	I117-E119 PolarHBondContact O-N 3.47Å; E119-F121 VanDerWaalsContact C-N 3.33Å; E119-W263 PolarHBondContact OE2-NE1 3.19Å; E119-K267 VanDerWaalsContact CD-CE 3.46Å; E119-K267 WeakPolarHBondContact OE1-CE 3.47Å; E119-K267 IonicContact OE1-NZ 2.6Å; E119-K267 PolarHBondContact OE1-NZ 2.97Å; E119-K267 WeakPolarHBondContact OE2-CE 3.48Å; E119-K267 IonicContact OE2-NZ 3.56Å
120	D	96.3	Very high	94.8	Very high	109 Å²	109	44.3 Å²	44.3	58%	0.583	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	19.3	176.7	-49.8	-43.7	0	0	0	113.2	H118 D122 N128	H118-D120 VanDerWaalsContact C-N 3.26Å; H118-D120 IonicContact CE1-OD2 2.87Å; H118-D120 PolarHBondContact ND1-N 3.36Å; H118-D120 VanDerWaalsContact ND1-N 3.15Å; H118-D120 PolarHBondContact O-N 2.81Å; D120-D122 PolarHBondContact O-N 2.89Å; D120-N128 WeakPolarHBondContact CB-ND2 3.47Å; D120-N128 PolarHBondContact O-ND2 2.99Å
121	F	96.1	Very high	94.9	Very high	28 Å²	28	43.7 Å²	43.7	12%	0.123	24%	0.238	C	C	.	.			trans	-64.9	124.5	174	172.5	-117.3	0	0	0	110	A82 I117 H118 E119 N123 S127 N129	A82-F121 HydrophobicContact CB-CB 4.3Å; A82-F121 HydrophobicContact CB-CD1 3.64Å; A82-F121 HydrophobicContact CB-CD2 3.81Å; A82-F121 HydrophobicContact CB-CE1 3.87Å; A82-F121 HydrophobicContact CB-CE2 4.05Å; A82-F121 HydrophobicContact CB-CG 3.61Å; A82-F121 HydrophobicContact CB-CZ 4.08Å; I117-F121 HydrophobicContact CG2-CB 3.88Å; I117-F121 HydrophobicContact CG2-CD1 4.02Å; I117-F121 HydrophobicContact CG2-CG 4.23Å; H118-F121 HydrophobicContact CB-CB 4.49Å; H118-F121 WeakPolarHBondContact O-CB 3.39Å; H118-F121 PolarHBondContact O-N 2.89Å; E119-F121 VanDerWaalsContact C-N 3.33Å; F121-N123 HydrophobicContact CE1-CB 4.15Å; F121-N123 HydrophobicContact CZ-CB 4.19Å; F121-S127 WeakPolarHBondContact CA-O 3.48Å; F121-S127 VanDerWaalsContact CD2-O 3.31Å; F121-S127 WeakPolarHBondContact CD2-O 3.44Å; F121-N129 HydrophobicContact CD2-CB 4.04Å; F121-N129 HydrophobicContact CE2-CB 3.72Å; F121-N129 WeakPolarHBondContact CE2-OD1 3.32Å
122	D	92.8	Very high	94.9	Very high	58 Å²	58	40.7 Å²	40.7	31%	0.31	22%	0.218	S	C	.	.	B	Isolated β-bridge	trans	-116.9	119	174.4	173.1	51.8	0	0	0	110.5	D120 N124 S125 M126 S127	D120-D122 PolarHBondContact O-N 2.89Å; D122-N124 PolarHBondContact O-N 3.1Å; D122-S125 WeakPolarHBondContact CB-OG 3.41Å; D122-S125 WeakPolarHBondContact OD2-CB 3.45Å; D122-S125 PolarHBondContact OD2-N 2.74Å; D122-S125 PolarHBondContact OD2-OG 3.25Å; D122-M126 VanDerWaalsContact O-CA 3.26Å; D122-M126 WeakPolarHBondContact O-CA 3.44Å; D122-M126 PolarHBondContact O-N 3.28Å; D122-S127 PolarHBondContact N-O 3.13Å; D122-S127 VanDerWaalsContact N-O 3.11Å
123	N	91.3	Very high	94.9	Very high	47 Å²	47	40 Å²	40	25%	0.251	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-19.3	-175.3	-168.8	68.8	0	0	0	113.3	Q86 F121 M126 P351	Q86-N123 PolarHBondContact NE2-OD1 2.82Å; F121-N123 HydrophobicContact CE1-CB 4.15Å; F121-N123 HydrophobicContact CZ-CB 4.19Å; N123-M126 WeakPolarHBondContact O-CE 3.44Å; N123-P351 VanDerWaalsContact ND2-CD 3.31Å; N123-P351 WeakPolarHBondContact ND2-CD 2.9Å; N123-P351 WeakPolarHBondContact ND2-CG 3.28Å
124	N	89.3	Confident	95	Very high	110 Å²	110	37.9 Å²	37.9	59%	0.588	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-50	180	-60.1	-42.6	0	0	0	111.3	D122 V349	D122-N124 PolarHBondContact O-N 3.1Å; N124-V349 PolarHBondContact OD1-O 3.22Å
125	S	88.8	Confident	95.1	Very high	43 Å²	43	35.8 Å²	35.8	30%	0.301	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-13	178.9	62.6	0	0	0	0	113.6	D122 S127 L200	D122-S125 WeakPolarHBondContact CB-OG 3.41Å; D122-S125 WeakPolarHBondContact OD2-CB 3.45Å; D122-S125 PolarHBondContact OD2-N 2.74Å; D122-S125 PolarHBondContact OD2-OG 3.25Å; S125-S127 PolarHBondContact O-N 3.26Å; S125-S127 WeakPolarHBondContact OG-CB 3.48Å; S125-S127 PolarHBondContact OG-N 2.92Å; S125-S127 PolarHBondContact OG-OG 2.95Å; S125-L200 WeakPolarHBondContact O-CD1 3.22Å; S125-L200 VanDerWaalsContact O-CD2 3.27Å; S125-L200 WeakPolarHBondContact O-CD2 3.44Å
126	M	91.3	Very high	94.9	Very high	33 Å²	33	38 Å²	38	16%	0.163	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	22.2	-168.9	-60.9	-64.8	173.5	0	0	113.5	D122 N123 N129 L200 N242 P351	D122-M126 VanDerWaalsContact O-CA 3.26Å; D122-M126 WeakPolarHBondContact O-CA 3.44Å; D122-M126 PolarHBondContact O-N 3.28Å; N123-M126 WeakPolarHBondContact O-CE 3.44Å; M126-N129 WeakPolarHBondContact O-CB 3.43Å; M126-L200 HydrophobicContact CB-CD1 4.29Å; M126-N242 PolarHBondContact O-ND2 3.38Å; M126-P351 HydrophobicContact CE-CB 3.34Å; M126-P351 HydrophobicContact CE-CG 3.58Å
127	S	91.8	Very high	94.8	Very high	27 Å²	27	40.4 Å²	40.4	19%	0.189	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-75.2	145.1	175.2	65.9	0	0	0	0	111	F121 D122 S125 N129	F121-S127 WeakPolarHBondContact CA-O 3.48Å; F121-S127 VanDerWaalsContact CD2-O 3.31Å; F121-S127 WeakPolarHBondContact CD2-O 3.44Å; D122-S127 PolarHBondContact N-O 3.13Å; D122-S127 VanDerWaalsContact N-O 3.11Å; S125-S127 PolarHBondContact O-N 3.26Å; S125-S127 WeakPolarHBondContact OG-CB 3.48Å; S125-S127 PolarHBondContact OG-N 2.92Å; S125-S127 PolarHBondContact OG-OG 2.95Å; S127-N129 PolarHBondContact O-N 3.1Å
128	N	94.8	Very high	94.6	Very high	21 Å²	21	40 Å²	40	11%	0.112	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	36	-173.4	-48.3	-77	0	0	0	114.2	H118 D120 I130 K202 Y260	H118-N128 HydrophobicContact CB-CB 4.27Å; H118-N128 WeakPolarHBondContact ND1-CB 3.25Å; D120-N128 WeakPolarHBondContact CB-ND2 3.47Å; D120-N128 PolarHBondContact O-ND2 2.99Å; N128-I130 VanDerWaalsContact C-N 3.29Å; N128-I130 PolarHBondContact O-N 2.98Å; N128-K202 PolarHBondContact OD1-NZ 3.47Å; N128-Y260 VanDerWaalsContact CA-OH 3.31Å; N128-Y260 WeakPolarHBondContact CA-OH 3.43Å; N128-Y260 HydrophobicContact CB-CE1 4.2Å; N128-Y260 PolarHBondContact OD1-OH 3Å
129	N	96.1	Very high	94.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.218	C	C	.	.			trans	-73.1	81.4	177.7	-167.7	12.7	0	0	0	111.6	I81 A82 S83 F121 M126 S127 N242 T255	I81-N129 WeakPolarHBondContact CB-OD1 3.36Å; A82-N129 WeakPolarHBondContact CA-OD1 3.4Å; A82-N129 WeakPolarHBondContact CB-OD1 3.39Å; A82-N129 PolarHBondContact N-OD1 3.15Å; S83-N129 PolarHBondContact N-OD1 3.01Å; S83-N129 PolarHBondContact OG-ND2 2.87Å; S83-N129 PolarHBondContact OG-OD1 3.25Å; F121-N129 HydrophobicContact CD2-CB 4.04Å; F121-N129 HydrophobicContact CE2-CB 3.72Å; F121-N129 WeakPolarHBondContact CE2-OD1 3.32Å; M126-N129 WeakPolarHBondContact O-CB 3.43Å; S127-N129 PolarHBondContact O-N 3.1Å; N129-N242 WeakPolarHBondContact CB-OD1 3.33Å; N129-N242 PolarHBondContact ND2-OD1 3.33Å; N129-T255 PolarHBondContact O-OG1 2.97Å
130	I	97.8	Very high	94.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.225	C	C	.	.			trans	-151.2	143	179.7	-166.8	172.1	0	0	0	109.8	L79 H118 N128 T255 Y260 W263 I264	L79-I130 HydrophobicContact CD1-CD1 3.95Å; L79-I130 HydrophobicContact CD1-CG1 3.87Å; L79-I130 HydrophobicContact CD2-CD1 4.2Å; L79-I130 HydrophobicContact CG-CD1 4.4Å; L79-I130 HydrophobicContact CG-CG1 4.28Å; H118-I130 HydrophobicContact CB-CG2 3.7Å; H118-I130 PolarHBondContact N-O 3.25Å; N128-I130 VanDerWaalsContact C-N 3.29Å; N128-I130 PolarHBondContact O-N 2.98Å; I130-T255 HydrophobicContact CB-CG2 4.18Å; I130-Y260 HydrophobicContact CD1-CD1 4.29Å; I130-Y260 HydrophobicContact CD1-CD2 4.05Å; I130-Y260 HydrophobicContact CD1-CG 3.74Å; I130-Y260 HydrophobicContact CG2-CD1 3.71Å; I130-Y260 HydrophobicContact CG2-CE1 3.82Å; I130-Y260 HydrophobicContact CG2-CG 4.22Å; I130-W263 HydrophobicContact CD1-CZ3 4.37Å; I130-W263 HydrophobicContact CG1-CZ3 4.24Å; I130-W263 HydrophobicContact CG2-CE3 4.33Å; I130-W263 HydrophobicContact CG2-CH2 4.37Å; I130-W263 HydrophobicContact CG2-CZ3 4.07Å; I130-I264 HydrophobicContact CD1-CD1 4.27Å; I130-I264 HydrophobicContact CD1-CG1 4.43Å
131	A	97.9	Very high	94.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	148.4	176.1	0	0	0	0	0	112.2	S80 A82 I85 I116 I117	S80-A131 PolarHBondContact N-O 3.31Å; S80-A131 PolarHBondContact O-N 2.9Å; A82-A131 HydrophobicContact CB-CB 4.29Å; I85-A131 HydrophobicContact CD1-CB 3.41Å; I85-A131 VanDerWaalsContact CD1-CB 3.41Å; I85-A131 HydrophobicContact CG1-CB 4Å; I116-A131 CarbonylContact O-C 3.58Å; I116-A131 VanDerWaalsContact O-CA 3.3Å; I116-A131 WeakPolarHBondContact O-CA 3.32Å; I117-A131 HydrophobicContact CD1-CB 3.63Å
132	L	97.3	Very high	93.8	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.4	178.7	-166.6	72.2	0	0	0	109	L73 W77 L79 I116 W263 I264 K267 A268	L73-L132 HydrophobicContact CD1-CD1 3.97Å; W77-L132 HydrophobicContact CB-CD1 4.43Å; W77-L132 HydrophobicContact CD2-CD2 4.04Å; W77-L132 HydrophobicContact CD2-CG 4.33Å; W77-L132 HydrophobicContact CE3-CD1 4.15Å; W77-L132 HydrophobicContact CE3-CD2 3.44Å; W77-L132 VanDerWaalsContact CE3-CD2 3.44Å; W77-L132 HydrophobicContact CE3-CG 3.45Å; W77-L132 VanDerWaalsContact CE3-CG 3.45Å; W77-L132 HydrophobicContact CH2-CD2 4.18Å; W77-L132 HydrophobicContact CZ3-CD2 3.48Å; W77-L132 VanDerWaalsContact CZ3-CD2 3.48Å; W77-L132 HydrophobicContact CZ3-CG 3.72Å; L79-L132 HydrophobicContact CD1-CD1 3.9Å; I116-L132 HydrophobicContact CB-CB 4.3Å; I116-L132 PolarHBondContact N-O 2.88Å; I116-L132 PolarHBondContact O-N 3.02Å; L132-W263 HydrophobicContact CB-CH2 4.15Å; L132-W263 HydrophobicContact CB-CZ3 4.25Å; L132-I264 HydrophobicContact CD1-CG2 4.3Å; L132-K267 HydrophobicContact CD2-CB 4.25Å; L132-A268 HydrophobicContact CD2-CB 4.02Å
133	L	97.4	Very high	93.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.1	179.8	-56.8	88.7	0	0	0	109.1	L59 V78 I85 I91 V112 T114	L59-L133 HydrophobicContact CD1-CD1 4.08Å; L59-L133 HydrophobicContact CD1-CD2 3.88Å; L59-L133 HydrophobicContact CD2-CD2 4.09Å; V78-L133 HydrophobicContact CB-CB 4.42Å; V78-L133 PolarHBondContact N-O 2.97Å; V78-L133 PolarHBondContact O-N 2.86Å; I85-L133 HydrophobicContact CD1-CD1 3.64Å; I85-L133 HydrophobicContact CD1-CD2 3.88Å; I85-L133 HydrophobicContact CD1-CG 3.77Å; I91-L133 HydrophobicContact CD1-CD2 4.08Å; I91-L133 HydrophobicContact CG2-CD2 4.16Å; V112-L133 HydrophobicContact CG1-CB 4.01Å; V112-L133 HydrophobicContact CG1-CD2 4.23Å; V112-L133 HydrophobicContact CG2-CB 4.29Å; V112-L133 HydrophobicContact CG2-CD2 4.01Å; T114-L133 WeakPolarHBondContact O-CA 3.31Å
134	K	95.8	Very high	93.5	Very high	32 Å²	32	39.7 Å²	39.7	14%	0.139	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	125	174.5	-161.7	-173.1	169.8	-170.8	0	109.9	F76 W77 V112 N113 T114 A271	F76-K134 HydrophobicContact CB-CG 4.41Å; F76-K134 CarbonylContact O-C 3.52Å; F76-K134 VanDerWaalsContact O-CA 3.3Å; F76-K134 WeakPolarHBondContact O-CA 3.41Å; W77-K134 HydrophobicContact CD2-CG 4.33Å; W77-K134 HydrophobicContact CE3-CB 3.83Å; W77-K134 HydrophobicContact CE3-CG 4.1Å; W77-K134 HydrophobicContact CH2-CB 3.83Å; W77-K134 HydrophobicContact CH2-CD 3.8Å; W77-K134 HydrophobicContact CH2-CG 3.85Å; W77-K134 HydrophobicContact CZ2-CB 4.49Å; W77-K134 HydrophobicContact CZ2-CD 3.95Å; W77-K134 HydrophobicContact CZ2-CG 4.04Å; W77-K134 HydrophobicContact CZ3-CB 3.47Å; W77-K134 VanDerWaalsContact CZ3-CB 3.47Å; W77-K134 HydrophobicContact CZ3-CD 4.31Å; W77-K134 HydrophobicContact CZ3-CG 3.9Å; V112-K134 WeakPolarHBondContact CA-O 3.35Å; V112-K134 WeakPolarHBondContact CG1-O 3.35Å; N113-K134 PolarHBondContact N-O 2.99Å; N113-K134 PolarHBondContact OD1-O 2.92Å; T114-K134 PolarHBondContact N-O 2.84Å; T114-K134 PolarHBondContact O-N 2.88Å; K134-A271 PolarHBondContact NZ-O 2.92Å
135	T	95.9	Very high	93.7	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	152.5	171.5	57.1	0	0	0	0	111	F76 V93 P111 T137 M139	F76-T135 WeakPolarHBondContact CA-OG1 3.07Å; F76-T135 PolarHBondContact O-N 3.11Å; F76-T135 PolarHBondContact O-OG1 2.72Å; V93-T135 HydrophobicContact CB-CG2 4.38Å; V93-T135 HydrophobicContact CG2-CG2 3.86Å; P111-T135 CarbonylContact O-C 3.55Å; P111-T135 VanDerWaalsContact O-CA 3.31Å; P111-T135 WeakPolarHBondContact O-CA 3.27Å; T135-T137 WeakPolarHBondContact CB-O 3.22Å; T135-T137 PolarHBondContact OG1-O 3.22Å; T135-M139 HydrophobicContact CG2-CE 4.26Å; T135-M139 HydrophobicContact CG2-CG 4.44Å; T135-M139 HydrophobicContact CG2-SD 4.43Å
136	D	93.8	Very high	93.9	Very high	98 Å²	98	34.1 Å²	34.1	52%	0.524	19%	0.189	S	C	.	.	S	Bend	trans	-68.6	-37.7	177.3	-165.1	42.9	0	0	0	112.5	P111 N113	P111-D136 PolarHBondContact O-N 2.87Å; N113-D136 HydrophobicContact CB-CB 4.11Å; N113-D136 WeakPolarHBondContact ND2-CA 3.22Å; N113-D136 PolarHBondContact ND2-OD1 2.91Å
137	T	94.3	Very high	94.1	Very high	72 Å²	72	32.6 Å²	32.6	44%	0.442	18%	0.182	S	C	.	.	S	Bend	trans	-118.5	157.7	178.1	58.3	0	0	0	0	111.2	Y110 T135 M139	Y110-T137 WeakPolarHBondContact CD1-OG1 3.4Å; T135-T137 WeakPolarHBondContact CB-O 3.22Å; T135-T137 PolarHBondContact OG1-O 3.22Å; T137-M139 PolarHBondContact O-N 2.87Å
138	A	94	Very high	94.2	Very high	36 Å²	36	31.4 Å²	31.4	30%	0.298	17%	0.173	S	C	.	.			trans	-67.1	126.1	176.6	0	0	0	0	0	110.5	E75 F76 Y110 H140	E75-A138 HydrophobicContact CB-CB 4.24Å; E75-A138 CarbonylContact O-C 3.54Å; E75-A138 WeakPolarHBondContact O-CA 3.37Å; F76-A138 HydrophobicContact CE1-CB 3.9Å; F76-A138 HydrophobicContact CE2-CB 3.89Å; F76-A138 HydrophobicContact CZ-CB 3.53Å; Y110-A138 WeakPolarHBondContact CE1-O 3.27Å; A138-H140 PolarHBondContact O-N 3Å
139	M	94.4	Very high	94.2	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	17%	0.168	C	C	.	.			trans	-60.7	128.4	167.6	-68.4	179.7	-83.5	0	0	110.4	I72 S74 E75 V78 V95 Y110 T135 T137 F141 V145	I72-M139 HydrophobicContact CD1-SD 3.97Å; I72-M139 HydrophobicContact CG1-CE 4.44Å; I72-M139 HydrophobicContact CG1-SD 4.06Å; I72-M139 HydrophobicContact CG2-CE 3.96Å; I72-M139 HydrophobicContact CG2-SD 4.38Å; S74-M139 WeakPolarHBondContact O-CE 3.26Å; E75-M139 WeakPolarHBondContact O-CB 3.4Å; E75-M139 WeakPolarHBondContact O-CE 3.4Å; E75-M139 PolarHBondContact O-N 3.35Å; V78-M139 HydrophobicContact CG2-CE 3.78Å; V78-M139 HydrophobicContact CG2-SD 4.23Å; V95-M139 HydrophobicContact CG1-SD 4.11Å; Y110-M139 HydrophobicContact CD1-CG 3.97Å; Y110-M139 HydrophobicContact CD2-CG 3.65Å; Y110-M139 HydrophobicContact CD2-SD 4.48Å; Y110-M139 HydrophobicContact CE1-CB 4.39Å; Y110-M139 HydrophobicContact CE1-CG 4.17Å; Y110-M139 HydrophobicContact CE2-CB 4.21Å; Y110-M139 HydrophobicContact CE2-CG 3.82Å; Y110-M139 HydrophobicContact CG-CG 3.72Å; T135-M139 HydrophobicContact CG2-CE 4.26Å; T135-M139 HydrophobicContact CG2-CG 4.44Å; T135-M139 HydrophobicContact CG2-SD 4.43Å; T137-M139 PolarHBondContact O-N 2.87Å; M139-F141 HydrophobicContact CB-CE1 4.34Å; M139-F141 PolarHBondContact O-N 3.15Å; M139-V145 HydrophobicContact CB-CG1 4.4Å
140	H	93.7	Very high	93.9	Very high	145 Å²	145	30.6 Å²	30.6	67%	0.671	17%	0.168	S	C	*	.			trans	-82.2	107.3	-179.8	-67.5	-59.1	0	0	0	109.8	Y110 A138	Y110-H140 PolarHBondContact OH-CD2 2.99Å; Y110-H140 PolarHBondContact OH-N 3.22Å; A138-H140 PolarHBondContact O-N 3Å
141	F	91.8	Very high	93.5	Very high	56 Å²	56	30.8 Å²	30.8	25%	0.246	17%	0.169	C	C	.	.			trans	-70.3	132.9	178.8	-75.9	7.5	0	0	0	111.5	I72 E75 M139 V145	I72-F141 HydrophobicContact CG2-CE1 3.86Å; I72-F141 HydrophobicContact CG2-CZ 3.97Å; E75-F141 HydrophobicContact CG-CD1 4.4Å; E75-F141 HydrophobicContact CG-CD2 4.4Å; E75-F141 HydrophobicContact CG-CE1 4.14Å; E75-F141 HydrophobicContact CG-CE2 4.13Å; E75-F141 HydrophobicContact CG-CZ 4Å; M139-F141 HydrophobicContact CB-CE1 4.34Å; M139-F141 PolarHBondContact O-N 3.15Å; F141-V145 CarbonylContact C-O 3.55Å; F141-V145 VanDerWaalsContact CA-O 3.26Å; F141-V145 WeakPolarHBondContact CA-O 3.34Å; F141-V145 HydrophobicContact CD1-CG1 4.09Å; F141-V145 HydrophobicContact CE1-CG1 4.49Å
142	G	89.6	Confident	92.8	Very high	29 Å²	29	30.8 Å²	30.8	30%	0.299	17%	0.17	S	C	.	.	S	Bend	trans	-154.4	-153.7	-176.4	0	0	0	0	0	110.4	V145 Q146	G142-V145 PolarHBondContact N-O 3.02Å; G142-V145 VanDerWaalsContact O-O 3.08Å; G142-Q146 WeakPolarHBondContact O-CG 3.49Å; G142-Q146 PolarHBondContact O-NE2 3.31Å
143	N	88.6	Confident	91.7	Very high	81 Å²	81	37.5 Å²	37.5	43%	0.433	20%	0.195	S	C	.	.	S	Bend	trans	-79.2	-23.9	179.4	-63.6	-16.4	0	0	0	113	K34 M51	K34-N143 VanDerWaalsContact CD-OD1 3.32Å; K34-N143 WeakPolarHBondContact CD-OD1 3.43Å; K34-N143 PolarHBondContact NZ-OD1 3.4Å; M51-N143 WeakPolarHBondContact CB-O 3.42Å; M51-N143 HydrophobicContact CE-CB 4.04Å; M51-N143 HydrophobicContact CG-CB 4.02Å; M51-N143 HydrophobicContact SD-CB 3.66Å
144	L	89.6	Confident	90.1	Very high	47 Å²	47	45.3 Å²	45.3	25%	0.246	23%	0.229	C	C	.	.	S	Bend	trans	-101.7	-6.3	-179.5	-65	174	0	0	0	113.6	M51 P54 N99	M51-L144 HydrophobicContact CB-CD2 4.36Å; M51-L144 HydrophobicContact CG-CD2 3.58Å; M51-L144 HydrophobicContact CG-CG 4.32Å; P54-L144 WeakPolarHBondContact CA-O 3.24Å; N99-L144 HydrophobicContact CB-CD1 4.25Å; N99-L144 HydrophobicContact CB-CD2 4.36Å
145	V	93	Very high	88.5	Confident	13 Å²	13	45 Å²	45	8%	0.079	23%	0.229	C	C	.	.			trans	-138.7	111.8	-174.8	-171.3	0	0	0	0	107.8	P54 I72 V95 M139 F141 G142	P54-V145 VanDerWaalsContact O-CA 3.32Å; P54-V145 WeakPolarHBondContact O-CA 3.28Å; I72-V145 HydrophobicContact CD1-CG1 3.68Å; V95-V145 HydrophobicContact CB-CG1 4.36Å; V95-V145 HydrophobicContact CB-CG2 3.89Å; V95-V145 HydrophobicContact CG1-CG1 4.45Å; V95-V145 HydrophobicContact CG2-CG1 4.48Å; V95-V145 HydrophobicContact CG2-CG2 3.57Å; M139-V145 HydrophobicContact CB-CG1 4.4Å; F141-V145 CarbonylContact C-O 3.55Å; F141-V145 VanDerWaalsContact CA-O 3.26Å; F141-V145 WeakPolarHBondContact CA-O 3.34Å; F141-V145 HydrophobicContact CD1-CG1 4.09Å; F141-V145 HydrophobicContact CE1-CG1 4.49Å; G142-V145 PolarHBondContact N-O 3.02Å; G142-V145 VanDerWaalsContact O-O 3.08Å
146	Q	93.7	Very high	86.8	Confident	23 Å²	23	54.2 Å²	54.2	11%	0.107	27%	0.271	C	S	.	.			trans	-149.4	158.7	176.7	-72.4	-64.2	-34.4	0	0	109.3	P54 W55 G142	P54-Q146 HydrophobicContact CB-CB 4.08Å; P54-Q146 HydrophobicContact CB-CG 4.32Å; P54-Q146 HydrophobicContact CG-CB 3.87Å; P54-Q146 HydrophobicContact CG-CG 4.2Å; P54-Q146 PolarHBondContact O-N 3.11Å; P54-Q146 VanDerWaalsContact O-N 3.1Å; W55-Q146 WeakPolarHBondContact CA-O 3.48Å; W55-Q146 VanDerWaalsContact CB-O 3.22Å; W55-Q146 WeakPolarHBondContact CB-O 3.38Å; G142-Q146 WeakPolarHBondContact O-CG 3.49Å; G142-Q146 PolarHBondContact O-NE2 3.31Å
147	S	94.6	Very high	85.5	Confident	1 Å²	1	55 Å²	55	1%	0.007	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-80.6	145.9	170.9	51.2	0	0	0	0	112.5	C30 G31 I72 L73	C30-S147 CarbonylContact C-O 3.53Å; C30-S147 WeakPolarHBondContact CA-O 3.44Å; G31-S147 PolarHBondContact N-O 2.87Å; I72-S147 CarbonylContact O-C 3.59Å; I72-S147 VanDerWaalsContact O-CA 3.3Å; I72-S147 WeakPolarHBondContact O-CA 3.41Å; L73-S147 WeakPolarHBondContact O-CB 2.99Å
148	I	95	Very high	84.4	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-89.7	154.1	164.7	-159.6	169.2	0	0	0	110.9	W55 C71 I72 L73 M226 W235 L237	W55-I148 HydrophobicContact CB-CB 3.89Å; W55-I148 HydrophobicContact CD2-CB 3.9Å; W55-I148 HydrophobicContact CD2-CD1 4.17Å; W55-I148 HydrophobicContact CD2-CG1 4.07Å; W55-I148 HydrophobicContact CE3-CB 4.3Å; W55-I148 HydrophobicContact CE3-CG1 4.49Å; W55-I148 HydrophobicContact CG-CB 3.7Å; W55-I148 HydrophobicContact CG-CD1 4.17Å; W55-I148 HydrophobicContact CG-CG1 4.23Å; W55-I148 HydrophobicContact CZ2-CD1 4.46Å; C71-I148 WeakPolarHBondContact SG-CG2 3.44Å; I72-I148 PolarHBondContact O-N 3.07Å; L73-I148 HydrophobicContact CD2-CG2 4.15Å; I148-M226 HydrophobicContact CD1-CB 4.04Å; I148-M226 HydrophobicContact CD1-CG 3.8Å; I148-W235 HydrophobicContact CD1-CB 4.4Å; I148-W235 HydrophobicContact CG1-CB 4.27Å; I148-W235 WeakPolarHBondContact CG1-O 3.47Å; I148-L237 HydrophobicContact CD1-CB 4.05Å; I148-L237 HydrophobicContact CG1-CB 4.47Å; I148-L237 HydrophobicContact CG2-CB 3.79Å; I148-L237 HydrophobicContact CG2-CD2 4.44Å
149	C	93.3	Very high	83.7	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.007	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	165.7	169.4	-54.6	0	0	0	0	110.9	C30 W235 V236 L237	C30-C149 HydrophobicContact CB-CB 4.06Å; C30-C149 WeakPolarHBondContact CB-SG 3.47Å; C30-C149 PolarHBondContact O-SG 2.94Å; C30-C149 WeakPolarHBondContact SG-CA 3.38Å; C30-C149 WeakPolarHBondContact SG-CB 3.37Å; C30-C149 CovalentContact SG-SG 2.03Å; C30-C149 PolarHBondContact SG-SG 2.85Å; C149-W235 WeakPolarHBondContact CB-O 3.39Å; C149-W235 PolarHBondContact N-O 2.88Å; C149-V236 HydrophobicContact CB-CG1 3.89Å; C149-V236 CarbonylContact O-C 3.54Å; C149-V236 VanDerWaalsContact O-CA 3.29Å; C149-V236 WeakPolarHBondContact O-CA 3.42Å; C149-L237 PolarHBondContact O-N 3.33Å
150	F	91.6	Very high	83.2	Confident	2 Å²	2	59 Å²	59	1%	0.009	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	158.2	166	63.4	-83.2	0	0	0	110.4	L73 L237 V257 I264 L278	L73-F150 HydrophobicContact CD2-CD1 4.15Å; F150-L237 HydrophobicContact CB-CB 4.36Å; F150-V257 HydrophobicContact CB-CG1 3.89Å; F150-V257 HydrophobicContact CD2-CG1 4.38Å; F150-V257 HydrophobicContact CG-CG1 4.34Å; F150-I264 HydrophobicContact CZ-CG2 4.12Å; F150-L278 HydrophobicContact CE1-CB 4.36Å; F150-L278 HydrophobicContact CE1-CD2 4.14Å; F150-L278 HydrophobicContact CZ-CD1 4.44Å
151	L	87.8	Confident	83	Confident	4 Å²	4	53.7 Å²	53.7	2%	0.021	28%	0.279	C	S	.	.			trans	-84.4	146.3	-177.2	-61	-178.1	0	0	0	111.9	L155 P159 L161 L229 V236 E258 S261 W281	L151-L155 HydrophobicContact CB-CD1 4.23Å; L151-L155 HydrophobicContact CD2-CD1 4.36Å; L151-P159 HydrophobicContact CD1-CG 3.79Å; L151-P159 HydrophobicContact CD2-CG 3.8Å; L151-P159 HydrophobicContact CG-CG 4.47Å; L151-L161 HydrophobicContact CD1-CD1 4.31Å; L151-L161 HydrophobicContact CD1-CD2 4.42Å; L151-L229 HydrophobicContact CD2-CD2 4.26Å; L151-V236 HydrophobicContact CD2-CG1 4.06Å; L151-V236 HydrophobicContact CG-CG2 4.49Å; L151-E258 HydrophobicContact CB-CB 4.22Å; L151-E258 HydrophobicContact CB-CG 3.99Å; L151-E258 WeakPolarHBondContact O-CA 3.13Å; L151-S261 VanDerWaalsContact O-CB 3.31Å; L151-S261 WeakPolarHBondContact O-CB 3.36Å; L151-W281 HydrophobicContact CD2-CG 4.34Å
152	G	84.3	Confident	82.9	Confident	1 Å²	1	54 Å²	54	1%	0.01	28%	0.281	C	S	.	.			trans	-92.7	141.9	172.7	0	0	0	0	0	112	K154 L155 S261	G152-K154 PolarHBondContact O-N 3.15Å; G152-K154 VanDerWaalsContact O-N 3.08Å; G152-L155 VanDerWaalsContact O-CD1 3.23Å; G152-L155 WeakPolarHBondContact O-CD1 3.16Å; G152-L155 WeakPolarHBondContact O-CG 3.1Å; G152-S261 WeakPolarHBondContact CA-OG 3.44Å
153	R	74.4	Confident	82.9	Confident	142 Å²	142	56.1 Å²	56.1	54%	0.536	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-12.7	178	-163.7	175.4	175.1	-173	-1.9	115.6	L155 D259 S261	R153-L155 PolarHBondContact O-N 3.03Å; R153-D259 IonicContact NE-OD1 3.52Å; R153-S261 PolarHBondContact N-OG 3.15Å
154	K	64	Low	83	Confident	164 Å²	164	52.5 Å²	52.5	71%	0.713	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	12.2	-173.9	-73.2	-170.8	178.5	-178.8	0	113.9	G152 H156	G152-K154 PolarHBondContact O-N 3.15Å; G152-K154 VanDerWaalsContact O-N 3.08Å; K154-H156 PolarHBondContact O-N 3.08Å
155	L	62.4	Low	83.1	Confident	25 Å²	25	53.2 Å²	53.2	13%	0.131	27%	0.266	C	S	.	.			trans	-74.1	116.7	-176.7	-64.2	167.3	0	0	0	110.4	L151 G152 R153 T157 W281 E282	L151-L155 HydrophobicContact CB-CD1 4.23Å; L151-L155 HydrophobicContact CD2-CD1 4.36Å; G152-L155 VanDerWaalsContact O-CD1 3.23Å; G152-L155 WeakPolarHBondContact O-CD1 3.16Å; G152-L155 WeakPolarHBondContact O-CG 3.1Å; R153-L155 PolarHBondContact O-N 3.03Å; L155-T157 PolarHBondContact O-N 3.05Å; L155-W281 HydrophobicContact CD1-CZ2 3.6Å; L155-W281 VanDerWaalsContact CD1-NE1 3.31Å; L155-W281 HydrophobicContact CD2-CH2 4.09Å; L155-W281 HydrophobicContact CD2-CZ2 3.09Å; L155-W281 HydrophobicContact CG-CZ2 3.86Å; L155-E282 HydrophobicContact CD2-CG 3.8Å; L155-E282 WeakPolarHBondContact CD2-OE1 2.81Å
156	H	58.7	Low	83	Confident	194 Å²	194	52.6 Å²	52.6	90%	0.898	26%	0.262	S	S	*	.	S	Bend	trans	-62.7	-29.6	179.9	-140.1	-31	0	0	0	111.7	K154	K154-H156 PolarHBondContact O-N 3.08Å
157	T	66.9	Low	82.7	Confident	114 Å²	114	51.5 Å²	51.5	70%	0.699	26%	0.257	S	S	*	.	S	Bend	trans	-135.4	117.3	170.4	-49.7	0	0	0	0	107.6	L155	L155-T157 PolarHBondContact O-N 3.05Å
158	P	70.9	Confident	82	Confident	82 Å²	82	51.5 Å²	51.5	53%	0.532	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-59.5	136.5	174.7	-21.3	32.3	0	0	0	110.2
159	P	79.9	Confident	81.2	Confident	25 Å²	25	51.7 Å²	51.7	16%	0.162	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-66.2	148.8	174.9	28.4	-34.5	0	0	0	110.1	L151 L161 L229 W281	L151-P159 HydrophobicContact CD1-CG 3.79Å; L151-P159 HydrophobicContact CD2-CG 3.8Å; L151-P159 HydrophobicContact CG-CG 4.47Å; P159-L161 PolarHBondContact O-N 3.06Å; P159-L229 HydrophobicContact CB-CD2 3.5Å; P159-L229 HydrophobicContact CG-CD2 3.53Å; P159-W281 HydrophobicContact CG-CZ2 4.24Å
160	V	84.4	Confident	79.8	Confident	89 Å²	89	53.5 Å²	53.5	54%	0.539	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-73.2	124.5	173.2	-176.4	0	0	0	0	108.7	Q230	V160-Q230 HydrophobicContact CB-CB 4.5Å; V160-Q230 PolarHBondContact O-N 3.4Å
161	L	89.2	Confident	77.9	Confident	33 Å²	33	55.6 Å²	55.6	17%	0.173	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	142	175.7	-60.7	-178.9	0	0	0	109.9	L151 P159 C227 L229 V236 R238	L151-L161 HydrophobicContact CD1-CD1 4.31Å; L151-L161 HydrophobicContact CD1-CD2 4.42Å; P159-L161 PolarHBondContact O-N 3.06Å; L161-C227 HydrophobicContact CB-CB 4.02Å; L161-C227 HydrophobicContact CD1-CB 4.19Å; L161-C227 HydrophobicContact CD2-CB 4.29Å; L161-C227 HydrophobicContact CG-CB 4.4Å; L161-L229 HydrophobicContact CD2-CD2 3.75Å; L161-L229 HydrophobicContact CD2-CG 4.44Å; L161-V236 HydrophobicContact CD1-CG2 4.48Å; L161-V236 HydrophobicContact CD2-CG2 3.54Å; L161-R238 HydrophobicContact CD1-CB 4.32Å; L161-R238 VanDerWaalsContact CD1-CD 3.44Å; L161-R238 HydrophobicContact CD1-CG 3.91Å
162	Q	89.6	Confident	75.7	Confident	63 Å²	63	59.3 Å²	59.3	29%	0.294	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	172.9	175.9	66.5	-179.5	14.3	0	0	109.9	C164 Q228 Q230	Q162-C164 VanDerWaalsContact C-N 3.35Å; Q162-C164 PolarHBondContact O-N 2.81Å; Q162-Q228 HydrophobicContact CG-CB 4.37Å; Q162-Q228 PolarHBondContact N-O 3.1Å; Q162-Q228 PolarHBondContact O-N 2.87Å; Q162-Q230 HydrophobicContact CG-CB 4.29Å
163	N	89.1	Confident	73.3	Confident	72 Å²	72	63.8 Å²	63.8	39%	0.385	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.9	55.7	173.9	-60	-22.5	0	0	0	111.9	Q228	N163-Q228 HydrophobicContact CB-CB 4.38Å; N163-Q228 HydrophobicContact CB-CG 4.28Å; N163-Q228 PolarHBondContact ND2-OE1 2.85Å
164	C	91.3	Very high	71.5	Confident	5 Å²	5	61.6 Å²	61.6	3%	0.034	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	132.2	-179.9	-64.5	0	0	0	0	110.6	Q162 F188 V189 M226 C227	Q162-C164 VanDerWaalsContact C-N 3.35Å; Q162-C164 PolarHBondContact O-N 2.81Å; C164-F188 WeakPolarHBondContact O-CD2 3.11Å; C164-V189 VanDerWaalsContact CB-O 3.28Å; C164-V189 WeakPolarHBondContact CB-O 3.44Å; C164-V189 PolarHBondContact O-N 3.15Å; C164-M226 CarbonylContact C-O 3.54Å; C164-M226 VanDerWaalsContact CA-O 3.26Å; C164-M226 WeakPolarHBondContact CA-O 3.5Å; C164-C227 HydrophobicContact CB-CB 4.12Å; C164-C227 WeakPolarHBondContact CB-SG 3.31Å; C164-C227 WeakPolarHBondContact SG-CB 3.31Å; C164-C227 CovalentContact SG-SG 2.04Å; C164-C227 PolarHBondContact SG-SG 2.92Å
165	W	91.6	Very high	70	Confident	63 Å²	63	58 Å²	58	24%	0.239	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	149.6	-178.1	-64.3	86.1	0	0	0	110.8	F53 K186 I187 F188 M226 W235	F53-W165 HydrophobicContact CZ-CB 3.88Å; F53-W165 HydrophobicContact CZ-CG 4.19Å; W165-K186 HydrophobicContact CE3-CB 4.12Å; W165-K186 HydrophobicContact CE3-CD 4.08Å; W165-K186 HydrophobicContact CE3-CG 3.99Å; W165-K186 HydrophobicContact CZ3-CD 4.26Å; W165-K186 HydrophobicContact CZ3-CG 4.12Å; W165-I187 WeakPolarHBondContact CA-O 3.27Å; W165-F188 HydrophobicContact CE3-CB 4.37Å; W165-F188 HydrophobicContact CH2-CB 4.19Å; W165-F188 HydrophobicContact CZ2-CD2 4.16Å; W165-F188 HydrophobicContact CZ3-CB 4.08Å; W165-M226 PolarHBondContact N-O 3.14Å; W165-M226 VanDerWaalsContact O-CE 3.31Å; W165-M226 WeakPolarHBondContact O-CE 3.47Å; W165-M226 PolarHBondContact O-N 3.31Å; W165-W235 AromaticContact CD1-CH2 3.51Å; W165-W235 AromaticContact CD1-CZ3 3.86Å; W165-W235 HydrophobicContact CG-CH2 4.36Å
166	V	89.8	Confident	68.9	Low	0 Å²	0	59.7 Å²	59.7	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	143.9	166.4	165.5	0	0	0	0	108.3	K186 I187 V189 L218 M225 Y254	V166-K186 CarbonylContact O-C 3.56Å; V166-K186 WeakPolarHBondContact O-CA 3.29Å; V166-I187 HydrophobicContact CB-CG1 4.2Å; V166-I187 PolarHBondContact N-O 2.86Å; V166-I187 PolarHBondContact O-N 2.86Å; V166-V189 HydrophobicContact CB-CG2 3.91Å; V166-V189 HydrophobicContact CG2-CG2 3.56Å; V166-L218 HydrophobicContact CG1-CB 4.32Å; V166-M225 HydrophobicContact CG2-CB 4.08Å; V166-M225 HydrophobicContact CG2-CG 4.35Å; V166-Y254 HydrophobicContact CG2-CE1 4.18Å; V166-Y254 WeakPolarHBondContact CG2-OH 3.34Å
167	S	87.1	Confident	68	Low	0 Å²	0	57.7 Å²	57.7	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143	174.1	-175.1	0	0	0	0	110.7	V48 L184 R185	V48-S167 WeakPolarHBondContact CG2-OG 3.34Å; S167-L184 WeakPolarHBondContact OG-CD1 3.4Å; S167-L184 VanDerWaalsContact OG-CD2 3.3Å; S167-L184 WeakPolarHBondContact OG-CD2 3.5Å; S167-L184 WeakPolarHBondContact OG-CG 3.44Å; S167-R185 WeakPolarHBondContact CA-O 3.31Å; S167-R185 PolarHBondContact OG-O 3.2Å
168	G	80.6	Confident	66.8	Low	0 Å²	0	58.3 Å²	58.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	175.5	-177.5	0	0	0	0	0	111.7	R185	G168-R185 PolarHBondContact N-O 2.76Å; G168-R185 VanDerWaalsContact N-O 3.1Å; G168-R185 PolarHBondContact O-N 3.35Å
169	W	77.9	Confident	65.7	Low	7 Å²	7	58 Å²	58	3%	0.027	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	125.8	179.5	-78.9	-42.3	0	0	0	109.3	S58 H66 F69 I97 M100 P171 M179 S182 L184 D220	S58-W169 VanDerWaalsContact CB-CH2 3.41Å; H66-W169 HydrophobicContact CB-CZ3 4.15Å; H66-W169 AromaticContact CE1-CZ3 3.78Å; H66-W169 AromaticContact CG-CZ3 3.74Å; H66-W169 AromaticContact ND1-CE3 3.91Å; H66-W169 AromaticContact ND1-CZ3 3.31Å; H66-W169 VanDerWaalsContact ND1-CZ3 3.31Å; H66-W169 WeakPolarHBondContact ND1-CZ3 3.5Å; F69-W169 HydrophobicContact CE1-CD2 4.22Å; F69-W169 HydrophobicContact CE1-CE3 4.2Å; F69-W169 HydrophobicContact CE2-CE3 4.31Å; F69-W169 HydrophobicContact CZ-CB 4.18Å; F69-W169 AromaticContact CZ-CD2 3.64Å; F69-W169 HydrophobicContact CZ-CD2 3.64Å; F69-W169 AromaticContact CZ-CE3 3.57Å; F69-W169 HydrophobicContact CZ-CE3 3.57Å; F69-W169 AromaticContact CZ-CG 3.94Å; F69-W169 HydrophobicContact CZ-CG 3.94Å; F69-W169 HydrophobicContact CZ-CZ3 4.27Å; I97-W169 HydrophobicContact CB-CZ2 4.12Å; I97-W169 HydrophobicContact CD1-CZ2 4.28Å; M100-W169 HydrophobicContact SD-CH2 4.16Å; M100-W169 HydrophobicContact SD-CZ2 3.73Å; W169-P171 WeakPolarHBondContact O-CD 3.32Å; W169-M179 HydrophobicContact CE3-SD 4.46Å; W169-S182 VanDerWaalsContact CB-OG 3.25Å; W169-S182 WeakPolarHBondContact CB-OG 3.26Å; W169-S182 PolarHBondContact NE1-O 2.91Å; W169-L184 HydrophobicContact CG-CD1 4.28Å; W169-D220 PolarHBondContact N-OD2 2.85Å
170	N	64.8	Low	64.1	Low	39 Å²	39	60.4 Å²	60.4	21%	0.209	36%	0.36	C	S	.	.			trans	-91	117.7	167	-168.2	-3.6	0	0	0	106.9	T172 S182 A216 L218	N170-T172 PolarHBondContact O-N 3.26Å; N170-S182 VanDerWaalsContact O-CB 3.26Å; N170-S182 WeakPolarHBondContact O-CB 3.33Å; N170-S182 PolarHBondContact O-OG 3.2Å; N170-A216 WeakPolarHBondContact ND2-CB 3.5Å; N170-L218 HydrophobicContact CB-CD2 4.46Å
171	P	50.4	Low	62.7	Low	46 Å²	46	58.1 Å²	58.1	30%	0.299	34%	0.344	S	S	.	.			trans	-67.8	96.7	179.7	23.6	-29.3	0	0	0	109.2	W169 S173 Y357	W169-P171 WeakPolarHBondContact O-CD 3.32Å; P171-S173 PolarHBondContact O-N 3.27Å; P171-Y357 HydrophobicContact CB-CE1 4.3Å; P171-Y357 HydrophobicContact CG-CD1 4.3Å; P171-Y357 HydrophobicContact CG-CE1 3.32Å; P171-Y357 WeakPolarHBondContact CG-OH 3.21Å
172	T	42.5	Very low	61.5	Low	82 Å²	82	57.1 Å²	57.1	50%	0.503	34%	0.34	S	S	.	.			trans	-77.8	102	165	35.3	0	0	0	0	107.6	N170	N170-T172 PolarHBondContact O-N 3.26Å
173	S	32.9	Very low	60.7	Low	94 Å²	94	59.5 Å²	59.5	66%	0.657	35%	0.353	S	S	*	.	S	Bend	trans	70	112.9	173.2	21.7	0	0	0	0	116.3	P171 T175	P171-S173 PolarHBondContact O-N 3.27Å; S173-T175 PolarHBondContact O-N 2.93Å; S173-T175 VanDerWaalsContact O-N 3.14Å
174	A	37.2	Very low	60.4	Low	96 Å²	96	56.4 Å²	56.4	79%	0.793	34%	0.337	S	S	*	.			trans	-57.7	109.4	167.4	0	0	0	0	0	110.7
175	T	32.4	Very low	60.1	Low	88 Å²	88	58.4 Å²	58.4	54%	0.54	34%	0.343	S	S	.	.			trans	-115.2	73.8	161.1	40.4	0	0	0	0	108.6	S173 T180	S173-T175 PolarHBondContact O-N 2.93Å; S173-T175 VanDerWaalsContact O-N 3.14Å; T175-T180 WeakPolarHBondContact OG1-CG2 3.38Å; T175-T180 PolarHBondContact OG1-OG1 3.06Å
176	G	40.3	Very low	59.8	Low	61 Å²	61	56.6 Å²	56.6	63%	0.629	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	-168.1	173	0	0	0	0	0	115.5	H178	G176-H178 PolarHBondContact O-N 3.41Å
177	N	39	Very low	59.6	Low	152 Å²	152	57.5 Å²	57.5	81%	0.813	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	4.9	-176.3	-62.2	-6	0	0	0	114.5
178	H	42.5	Very low	59.6	Low	128 Å²	128	60.8 Å²	60.8	59%	0.593	36%	0.356	S	S	*	.	S	Bend	trans	-110.1	110.3	176.8	-60	-66.3	0	0	0	107.1	G176 T180	G176-H178 PolarHBondContact O-N 3.41Å; H178-T180 VanDerWaalsContact C-N 3.31Å; H178-T180 PolarHBondContact O-N 3.01Å
179	M	46.7	Very low	59.9	Low	76 Å²	76	60.8 Å²	60.8	37%	0.374	36%	0.357	S	S	.	.			trans	-61.6	98.7	172.7	-167.4	172.7	-79	0	0	107.2	H66 W169 M181	H66-M179 HydrophobicContact CB-SD 3.81Å; W169-M179 HydrophobicContact CE3-SD 4.46Å; M179-M181 PolarHBondContact O-N 2.8Å
180	T	46	Very low	60.3	Low	75 Å²	75	66.3 Å²	66.3	46%	0.46	38%	0.381	S	S	.	.			trans	-59.1	112.4	173.5	12	0	0	0	0	106.4	T175 H178 S182	T175-T180 WeakPolarHBondContact OG1-CG2 3.38Å; T175-T180 PolarHBondContact OG1-OG1 3.06Å; H178-T180 VanDerWaalsContact C-N 3.31Å; H178-T180 PolarHBondContact O-N 3.01Å; T180-S182 PolarHBondContact O-N 3.11Å
181	M	56.3	Low	61.2	Low	41 Å²	41	66.4 Å²	66.4	20%	0.202	38%	0.381	C	S	.	.			trans	-49.3	107.4	-173.6	-58.8	-159	-47.1	0	0	110.2	M100 D101 P102 H107 M179	M100-M181 HydrophobicContact CB-CE 3.87Å; M100-M181 HydrophobicContact CE-SD 4.31Å; M100-M181 HydrophobicContact CG-CE 4.1Å; M100-M181 HydrophobicContact CG-SD 4.33Å; M100-M181 HydrophobicContact SD-CE 4.35Å; M100-M181 HydrophobicContact SD-SD 3.84Å; D101-M181 WeakPolarHBondContact O-CE 3.21Å; P102-M181 HydrophobicContact CB-CB 4.29Å; P102-M181 HydrophobicContact CB-CE 4.41Å; H107-M181 VanDerWaalsContact CE1-CE 3.42Å; H107-M181 WeakPolarHBondContact CE1-CE 3.41Å; H107-M181 WeakPolarHBondContact NE2-CE 3.07Å; H107-M181 PolarHBondContact NE2-SD 2.56Å; M179-M181 PolarHBondContact O-N 2.8Å
182	S	62.5	Low	62.6	Low	12 Å²	12	66 Å²	66	8%	0.084	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-88.6	163.4	-175.7	73.5	0	0	0	0	110.5	W169 N170 T180 L184	W169-S182 VanDerWaalsContact CB-OG 3.25Å; W169-S182 WeakPolarHBondContact CB-OG 3.26Å; W169-S182 PolarHBondContact NE1-O 2.91Å; N170-S182 VanDerWaalsContact O-CB 3.26Å; N170-S182 WeakPolarHBondContact O-CB 3.33Å; N170-S182 PolarHBondContact O-OG 3.2Å; T180-S182 PolarHBondContact O-N 3.11Å; S182-L184 PolarHBondContact O-N 2.84Å
183	I	73.9	Confident	63.9	Low	113 Å²	113	69.1 Å²	69.1	58%	0.579	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-66.4	126.1	177.2	-59.3	171.5	0	0	0	108.2	L47 R185	L47-I183 HydrophobicContact CD1-CG2 4.14Å; L47-I183 HydrophobicContact CD2-CG2 3.86Å; L47-I183 HydrophobicContact CG-CG2 4.48Å; I183-R185 PolarHBondContact O-N 3.3Å
184	L	81.8	Confident	65.8	Low	7 Å²	7	71.5 Å²	71.5	4%	0.037	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	131.5	-179.9	-166.8	73	0	0	0	111	V48 F69 I97 S167 W169 S182	V48-L184 HydrophobicContact CB-CB 4.28Å; V48-L184 HydrophobicContact CB-CD2 3.98Å; V48-L184 HydrophobicContact CB-CG 4.16Å; V48-L184 HydrophobicContact CG1-CD2 3.98Å; V48-L184 HydrophobicContact CG2-CB 4.43Å; V48-L184 HydrophobicContact CG2-CD2 3.96Å; V48-L184 HydrophobicContact CG2-CG 3.91Å; V48-L184 PolarHBondContact N-O 3.11Å; F69-L184 HydrophobicContact CE1-CD1 3.98Å; F69-L184 HydrophobicContact CZ-CD1 4.27Å; I97-L184 HydrophobicContact CD1-CD1 4.07Å; I97-L184 HydrophobicContact CD1-CD2 4.21Å; I97-L184 HydrophobicContact CG1-CD2 4.02Å; S167-L184 WeakPolarHBondContact OG-CD1 3.4Å; S167-L184 VanDerWaalsContact OG-CD2 3.3Å; S167-L184 WeakPolarHBondContact OG-CD2 3.5Å; S167-L184 WeakPolarHBondContact OG-CG 3.44Å; W169-L184 HydrophobicContact CG-CD1 4.28Å; S182-L184 PolarHBondContact O-N 2.84Å
185	R	84.9	Confident	67.6	Low	46 Å²	46	67.4 Å²	67.4	17%	0.174	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	165	-177.6	-72.2	178.3	-177.9	-85.7	-0.6	111.1	G46 L47 V48 S167 G168 I183 L218	G46-R185 VanDerWaalsContact O-CA 3.26Å; G46-R185 WeakPolarHBondContact O-CA 3.45Å; G46-R185 WeakPolarHBondContact O-CB 3.47Å; L47-R185 HydrophobicContact CD2-CG 3.9Å; V48-R185 VanDerWaalsContact CG2-C 3.49Å; V48-R185 WeakPolarHBondContact CG2-O 3.28Å; S167-R185 WeakPolarHBondContact CA-O 3.31Å; S167-R185 PolarHBondContact OG-O 3.2Å; G168-R185 PolarHBondContact N-O 2.76Å; G168-R185 VanDerWaalsContact N-O 3.1Å; G168-R185 PolarHBondContact O-N 3.35Å; I183-R185 PolarHBondContact O-N 3.3Å; R185-L218 HydrophobicContact CB-CD1 4.08Å; R185-L218 HydrophobicContact CB-CD2 3.98Å
186	K	86.1	Confident	69.5	Low	25 Å²	25	67.7 Å²	67.7	11%	0.109	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	149.8	173.6	65	-173.3	-177.2	-167.5	0	111.5	G46 L47 V48 E52 F53 W165 V166	G46-K186 PolarHBondContact O-N 2.89Å; L47-K186 WeakPolarHBondContact O-CE 3.18Å; V48-K186 HydrophobicContact CG2-CB 3.81Å; V48-K186 HydrophobicContact CG2-CD 4.4Å; V48-K186 HydrophobicContact CG2-CG 4.29Å; E52-K186 WeakPolarHBondContact OE1-CD 3.45Å; E52-K186 IonicContact OE1-NZ 2.58Å; E52-K186 PolarHBondContact OE1-NZ 3.43Å; E52-K186 IonicContact OE2-NZ 2.83Å; E52-K186 PolarHBondContact OE2-NZ 3.03Å; F53-K186 HydrophobicContact CE2-CB 3.94Å; F53-K186 HydrophobicContact CE2-CD 3.92Å; F53-K186 HydrophobicContact CZ-CD 4.29Å; W165-K186 HydrophobicContact CE3-CB 4.12Å; W165-K186 HydrophobicContact CE3-CD 4.08Å; W165-K186 HydrophobicContact CE3-CG 3.99Å; W165-K186 HydrophobicContact CZ3-CD 4.26Å; W165-K186 HydrophobicContact CZ3-CG 4.12Å; V166-K186 CarbonylContact O-C 3.56Å; V166-K186 WeakPolarHBondContact O-CA 3.29Å
187	I	85.1	Confident	70.8	Confident	19 Å²	19	67.2 Å²	67.2	10%	0.097	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	147.2	172.3	63.2	-176.5	0	0	0	109.7	W165 V166 V189 H208 L218	W165-I187 WeakPolarHBondContact CA-O 3.27Å; V166-I187 HydrophobicContact CB-CG1 4.2Å; V166-I187 PolarHBondContact N-O 2.86Å; V166-I187 PolarHBondContact O-N 2.86Å; I187-V189 HydrophobicContact CG1-CG2 4.35Å; I187-H208 HydrophobicContact CD1-CB 3.87Å; I187-H208 VanDerWaalsContact CD1-CG 3.46Å; I187-H208 WeakPolarHBondContact CD1-ND1 3.49Å; I187-L218 HydrophobicContact CB-CD1 4.31Å; I187-L218 HydrophobicContact CD1-CB 3.83Å; I187-L218 HydrophobicContact CD1-CD1 4.32Å; I187-L218 HydrophobicContact CD1-CG 4.14Å; I187-L218 HydrophobicContact CG1-CB 4.38Å; I187-L218 HydrophobicContact CG1-CD1 4.01Å; I187-L218 HydrophobicContact CG1-CG 4.37Å; I187-L218 HydrophobicContact CG2-CD1 3.79Å; I187-L218 HydrophobicContact CG2-CG 4.01Å
188	F	86.9	Confident	72	Confident	69 Å²	69	68.5 Å²	68.5	30%	0.303	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	139.3	170.4	-176.4	-97	0	0	0	109.8	C164 W165 K190 T209	C164-F188 WeakPolarHBondContact O-CD2 3.11Å; W165-F188 HydrophobicContact CE3-CB 4.37Å; W165-F188 HydrophobicContact CH2-CB 4.19Å; W165-F188 HydrophobicContact CZ2-CD2 4.16Å; W165-F188 HydrophobicContact CZ3-CB 4.08Å; F188-K190 HydrophobicContact CE1-CB 4.39Å; F188-T209 HydrophobicContact CD1-CG2 4.47Å; F188-T209 PolarHBondContact O-N 2.87Å; F188-T209 PolarHBondContact O-OG1 2.98Å
189	V	86.9	Confident	72.9	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.006	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	125.9	176.4	-178	0	0	0	0	108.7	C164 V166 I187 D191 S207 M225	C164-V189 VanDerWaalsContact CB-O 3.28Å; C164-V189 WeakPolarHBondContact CB-O 3.44Å; C164-V189 PolarHBondContact O-N 3.15Å; V166-V189 HydrophobicContact CB-CG2 3.91Å; V166-V189 HydrophobicContact CG2-CG2 3.56Å; I187-V189 HydrophobicContact CG1-CG2 4.35Å; V189-D191 PolarHBondContact O-N 2.92Å; V189-S207 WeakPolarHBondContact CA-O 3.25Å; V189-M225 HydrophobicContact CB-SD 4.49Å; V189-M225 HydrophobicContact CG1-CG 4.44Å; V189-M225 HydrophobicContact CG1-SD 3.7Å
190	K	87.6	Confident	73.8	Confident	123 Å²	123	65.9 Å²	65.9	54%	0.535	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	112.3	168.7	-173.6	177.2	-179.4	177.4	0	108.4	F188 L192 S207	F188-K190 HydrophobicContact CE1-CB 4.39Å; K190-L192 HydrophobicContact CD-CD2 4.09Å; K190-L192 HydrophobicContact CG-CD2 4.04Å; K190-L192 PolarHBondContact O-N 3.27Å; K190-S207 PolarHBondContact N-O 3.07Å; K190-S207 PolarHBondContact O-N 3.32Å
191	D	83.4	Confident	75.1	Confident	40 Å²	40	70 Å²	70	21%	0.214	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	128.9	170.4	-167.7	3.5	0	0	0	108.9	V189 R238	V189-D191 PolarHBondContact O-N 2.92Å; D191-R238 IonicContact OD2-NE 3.15Å; D191-R238 PolarHBondContact OD2-NE 2.96Å
192	L	80.3	Confident	76.4	Confident	39 Å²	39	70.9 Å²	70.9	20%	0.204	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	111.3	-176.5	-63	179.4	0	0	0	110.4	K190 I194 C205 L251	K190-L192 HydrophobicContact CD-CD2 4.09Å; K190-L192 HydrophobicContact CG-CD2 4.04Å; K190-L192 PolarHBondContact O-N 3.27Å; L192-I194 VanDerWaalsContact C-N 3.25Å; L192-I194 PolarHBondContact O-N 2.88Å; L192-C205 HydrophobicContact CB-CB 4.11Å; L192-C205 HydrophobicContact CD1-CB 4.23Å; L192-C205 PolarHBondContact N-O 2.76Å; L192-C205 VanDerWaalsContact N-O 3.13Å; L192-L251 HydrophobicContact CD1-CD2 3.28Å
193	D	69.8	Low	77.4	Confident	146 Å²	146	70.9 Å²	70.9	78%	0.781	35%	0.349	S	S	*	.	S	Bend	trans	-56.6	-41.9	175.4	-63.8	-39.5	0	0	0	112.1	K199	D193-K199 PolarHBondContact O-NZ 3.32Å
194	I	72.8	Confident	78	Confident	144 Å²	144	65.9 Å²	65.9	74%	0.738	32%	0.323	S	S	*	.	S	Bend	trans	-106	106.2	177.9	-54.4	176	0	0	0	108.3	L192 P196	L192-I194 VanDerWaalsContact C-N 3.25Å; L192-I194 PolarHBondContact O-N 2.88Å; I194-P196 WeakPolarHBondContact O-CD 3.37Å
195	C	74.5	Confident	78.3	Confident	10 Å²	10	65.6 Å²	65.6	7%	0.068	32%	0.321	C	S	.	.			trans	-80.2	117.7	174.6	-171.3	0	0	0	0	109.1	L197 K199 C205 L253	C195-L197 PolarHBondContact O-N 2.92Å; C195-K199 HydrophobicContact CB-CD 4.24Å; C195-K199 HydrophobicContact CB-CG 3.9Å; C195-C205 WeakPolarHBondContact CA-SG 3.26Å; C195-C205 HydrophobicContact CB-CB 3.47Å; C195-C205 VanDerWaalsContact CB-CB 3.47Å; C195-C205 WeakPolarHBondContact CB-SG 3.29Å; C195-C205 WeakPolarHBondContact SG-CB 3.02Å; C195-C205 CovalentContact SG-SG 2.02Å; C195-C205 PolarHBondContact SG-SG 2.85Å; C195-L253 WeakPolarHBondContact SG-CD2 3.41Å
196	P	71	Confident	78.4	Confident	94 Å²	94	63.4 Å²	63.4	61%	0.61	31%	0.313	S	S	*	.			trans	-77.1	-11.4	178.1	32	-36.6	0	0	0	112.9	I194 L251	I194-P196 WeakPolarHBondContact O-CD 3.37Å; P196-L251 HydrophobicContact CG-CD1 3.42Å; P196-L251 VanDerWaalsContact CG-CD1 3.42Å; P196-L251 HydrophobicContact CG-CD2 4.39Å
197	L	68.9	Low	78.4	Confident	52 Å²	52	63.6 Å²	63.6	27%	0.272	32%	0.318	S	S	.	.	S	Bend	trans	-77.1	151.7	170.6	-61.6	173.2	0	0	0	110.2	C195 K199 L251 L253	C195-L197 PolarHBondContact O-N 2.92Å; L197-K199 PolarHBondContact O-N 3.05Å; L197-L251 HydrophobicContact CD1-CB 4.02Å; L197-L251 HydrophobicContact CG-CB 4.48Å; L197-L253 HydrophobicContact CB-CD1 3.82Å; L197-L253 HydrophobicContact CB-CG 4.39Å; L197-L253 HydrophobicContact CD1-CD1 3.74Å; L197-L253 HydrophobicContact CD1-CG 3.81Å; L197-L253 HydrophobicContact CG-CD1 4.43Å
198	H	63.6	Low	78.3	Confident	178 Å²	178	62.9 Å²	62.9	82%	0.824	31%	0.314	S	S	*	.			trans	-59.2	107.7	176.9	-167.1	77.3	0	0	0	109.3	L200	H198-L200 PolarHBondContact O-N 3.35Å; H198-L200 VanDerWaalsContact O-N 3.1Å
199	K	62.2	Low	77.6	Confident	110 Å²	110	62.1 Å²	62.1	48%	0.478	32%	0.315	S	S	.	.			trans	-66.1	113.1	-173.9	-75.1	-173	176.6	-174.4	0	109.6	D193 C195 L197	D193-K199 PolarHBondContact O-NZ 3.32Å; C195-K199 HydrophobicContact CB-CD 4.24Å; C195-K199 HydrophobicContact CB-CG 3.9Å; L197-K199 PolarHBondContact O-N 3.05Å
200	L	65.8	Low	76.5	Confident	39 Å²	39	68.7 Å²	68.7	20%	0.204	34%	0.343	C	S	.	.			trans	-61.4	151.8	152.4	-65.3	170.3	0	0	0	108.4	S125 M126 H198 K202 T203 F243	S125-L200 WeakPolarHBondContact O-CD1 3.22Å; S125-L200 VanDerWaalsContact O-CD2 3.27Å; S125-L200 WeakPolarHBondContact O-CD2 3.44Å; M126-L200 HydrophobicContact CB-CD1 4.29Å; H198-L200 PolarHBondContact O-N 3.35Å; H198-L200 VanDerWaalsContact O-N 3.1Å; L200-K202 PolarHBondContact O-N 2.87Å; L200-T203 HydrophobicContact CB-CG2 3.86Å; L200-T203 PolarHBondContact O-OG1 2.98Å; L200-F243 HydrophobicContact CD1-CD1 4.49Å; L200-F243 HydrophobicContact CD1-CE1 3.63Å; L200-F243 HydrophobicContact CD1-CZ 4.32Å
201	Q	73.4	Confident	75	Confident	161 Å²	161	67.5 Å²	67.5	75%	0.752	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	141.4	175.2	-78.4	-171.1	2.6	0	0	110.7	T203	Q201-T203 VanDerWaalsContact C-N 3.27Å; Q201-T203 PolarHBondContact O-N 3.37Å
202	K	82.3	Confident	73.1	Confident	60 Å²	60	74.9 Å²	74.9	26%	0.261	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	31.6	177.8	-49.9	171.5	-173.3	163.3	0	114.2	N128 L200 K256 D259 Y260	N128-K202 PolarHBondContact OD1-NZ 3.47Å; L200-K202 PolarHBondContact O-N 2.87Å; K202-K256 WeakPolarHBondContact O-CB 3.31Å; K202-K256 PolarHBondContact O-N 2.66Å; K202-D259 HydrophobicContact CB-CB 3.98Å; K202-D259 HydrophobicContact CD-CB 4.3Å; K202-D259 HydrophobicContact CG-CB 4Å; K202-Y260 HydrophobicContact CB-CE2 3.66Å; K202-Y260 WeakPolarHBondContact CB-OH 3.34Å; K202-Y260 HydrophobicContact CD-CE1 3.83Å; K202-Y260 HydrophobicContact CD-CE2 3.9Å; K202-Y260 VanDerWaalsContact CD-CZ 3.44Å; K202-Y260 WeakPolarHBondContact CD-OH 3.49Å; K202-Y260 HydrophobicContact CG-CE2 4.45Å
203	T	85	Confident	71.5	Confident	12 Å²	12	77.1 Å²	77.1	7%	0.074	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	156.8	170.3	61.8	0	0	0	0	111.9	L200 Q201 Y254	L200-T203 HydrophobicContact CB-CG2 3.86Å; L200-T203 PolarHBondContact O-OG1 2.98Å; Q201-T203 VanDerWaalsContact C-N 3.27Å; Q201-T203 PolarHBondContact O-N 3.37Å; T203-Y254 CarbonylContact C-O 3.56Å; T203-Y254 WeakPolarHBondContact CA-O 3.4Å; T203-Y254 VanDerWaalsContact CB-O 3.25Å; T203-Y254 WeakPolarHBondContact CB-O 3.18Å
204	E	86.8	Confident	70.7	Confident	9 Å²	9	75.6 Å²	75.6	4%	0.042	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	157.6	175.3	68.3	-168.1	150.8	0	0	111.9	M225 R238 Y254 K256	E204-M225 HydrophobicContact CG-CE 4.13Å; E204-R238 WeakPolarHBondContact OE1-CG 3.41Å; E204-R238 IonicContact OE1-NE 3.37Å; E204-R238 VanDerWaalsContact OE1-O 3.06Å; E204-R238 IonicContact OE2-CZ 2.7Å; E204-R238 IonicContact OE2-NE 3.93Å; E204-R238 PolarHBondContact OE2-NE 2.81Å; E204-R238 IonicContact OE2-NH1 3.67Å; E204-R238 IonicContact OE2-NH2 2.92Å; E204-R238 PolarHBondContact OE2-NH2 2.98Å; E204-Y254 PolarHBondContact N-O 3.31Å; E204-Y254 PolarHBondContact O-N 3.21Å; E204-K256 HydrophobicContact CB-CB 4.46Å; E204-K256 HydrophobicContact CG-CB 4.29Å
205	C	87.4	Confident	69.7	Low	0 Å²	0	74.9 Å²	74.9	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	134.3	178.3	-92.5	0	0	0	0	110.3	L192 C195 F252	L192-C205 HydrophobicContact CB-CB 4.11Å; L192-C205 HydrophobicContact CD1-CB 4.23Å; L192-C205 PolarHBondContact N-O 2.76Å; L192-C205 VanDerWaalsContact N-O 3.13Å; C195-C205 WeakPolarHBondContact CA-SG 3.26Å; C195-C205 HydrophobicContact CB-CB 3.47Å; C195-C205 VanDerWaalsContact CB-CB 3.47Å; C195-C205 WeakPolarHBondContact CB-SG 3.29Å; C195-C205 WeakPolarHBondContact SG-CB 3.02Å; C195-C205 CovalentContact SG-SG 2.02Å; C195-C205 PolarHBondContact SG-SG 2.85Å; C205-F252 WeakPolarHBondContact CA-O 3.45Å
206	G	86.7	Confident	68.9	Low	0 Å²	0	75.2 Å²	75.2	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128.9	163.2	0	0	0	0	0	110	F252	G206-F252 PolarHBondContact N-O 3.31Å; G206-F252 PolarHBondContact O-N 3.11Å
207	S	86	Confident	68.7	Low	30 Å²	30	73 Å²	73	21%	0.21	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	113.9	172.3	-171.1	0	0	0	0	109.4	V189 K190 T209 G250	V189-S207 WeakPolarHBondContact CA-O 3.25Å; K190-S207 PolarHBondContact N-O 3.07Å; K190-S207 PolarHBondContact O-N 3.32Å; S207-T209 PolarHBondContact O-N 3.27Å; S207-G250 CarbonylContact C-O 3.48Å; S207-G250 WeakPolarHBondContact CA-O 3.37Å
208	H	83.9	Confident	69	Low	4 Å²	4	70.5 Å²	70.5	2%	0.019	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	114.1	168.4	-68.2	-167.7	0	0	0	107.6	I187 L218 P249 G250 F252 Y254	I187-H208 HydrophobicContact CD1-CB 3.87Å; I187-H208 VanDerWaalsContact CD1-CG 3.46Å; I187-H208 WeakPolarHBondContact CD1-ND1 3.49Å; H208-L218 PolarHBondContact CE1-O 3.48Å; H208-P249 HydrophobicContact CB-CB 4.36Å; H208-P249 WeakPolarHBondContact O-CB 3.42Å; H208-G250 PolarHBondContact N-O 3.24Å; H208-G250 PolarHBondContact O-N 2.81Å; H208-F252 HydrophobicContact CB-CD2 4.13Å; H208-F252 HydrophobicContact CB-CE2 4.06Å; H208-F252 AromaticContact CD2-CD2 3.52Å; H208-F252 AromaticContact CD2-CG 3.96Å; H208-F252 AromaticContact CE1-CD1 3.69Å; H208-F252 AromaticContact CE1-CD2 3.41Å; H208-F252 VanDerWaalsContact CE1-CD2 3.41Å; H208-F252 WeakPolarHBondContact CE1-CD2 3.48Å; H208-F252 AromaticContact CE1-CE1 3.93Å; H208-F252 AromaticContact CE1-CE2 3.66Å; H208-F252 AromaticContact CE1-CG 3.48Å; H208-F252 VanDerWaalsContact CE1-CG 3.48Å; H208-F252 WeakPolarHBondContact CE1-CG 3.4Å; H208-F252 AromaticContact CE1-CZ 3.93Å; H208-F252 AromaticContact CG-CD2 3.46Å; H208-F252 VanDerWaalsContact CG-CD2 3.46Å; H208-F252 AromaticContact CG-CE2 3.63Å; H208-F252 AromaticContact ND1-CD2 3.41Å; H208-F252 WeakPolarHBondContact ND1-CD2 3.37Å; H208-F252 AromaticContact ND1-CE2 3.3Å; H208-F252 VanDerWaalsContact ND1-CE2 3.3Å; H208-F252 WeakPolarHBondContact ND1-CE2 3.25Å; H208-F252 AromaticContact ND1-CG 3.97Å; H208-F252 AromaticContact ND1-CZ 3.75Å; H208-F252 AromaticContact NE2-CD2 3.48Å; H208-F252 WeakPolarHBondContact NE2-CD2 3.42Å; H208-F252 AromaticContact NE2-CG 3.47Å; H208-F252 WeakPolarHBondContact NE2-CG 3.07Å; H208-Y254 PolarHBondContact CD2-OH 3.1Å; H208-Y254 AromaticContact NE2-CZ 3.84Å; H208-Y254 PolarHBondContact NE2-OH 2.92Å
209	T	72.4	Confident	69.4	Low	52 Å²	52	63.7 Å²	63.7	32%	0.319	34%	0.335	S	S	.	.			trans	-87.6	139.6	-180	51.9	0	0	0	0	110.1	F188 S207 D211	F188-T209 HydrophobicContact CD1-CG2 4.47Å; F188-T209 PolarHBondContact O-N 2.87Å; F188-T209 PolarHBondContact O-OG1 2.98Å; S207-T209 PolarHBondContact O-N 3.27Å; T209-D211 PolarHBondContact O-N 3.32Å
210	K	62.5	Low	70.3	Confident	139 Å²	139	59.1 Å²	59.1	60%	0.604	32%	0.316	S	S	*	.			trans	-71.8	113	169.5	-163.3	171	-178.4	-177.4	0	107.5	P249	K210-P249 HydrophobicContact CB-CB 4.21Å; K210-P249 HydrophobicContact CB-CG 3.78Å; K210-P249 HydrophobicContact CD-CG 4.46Å; K210-P249 HydrophobicContact CG-CG 3.99Å
211	D	56.8	Low	71.4	Confident	98 Å²	98	58.8 Å²	58.8	52%	0.524	32%	0.316	S	S	.	.			trans	-66	141.2	156.3	-101.1	-27.6	0	0	0	107.7	T209 T213 K214	T209-D211 PolarHBondContact O-N 3.32Å; D211-T213 PolarHBondContact O-N 2.97Å; D211-K214 PolarHBondContact O-N 2.9Å
212	E	43.8	Very low	72.3	Confident	195 Å²	195	51.1 Å²	51.1	91%	0.911	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-12.6	-171.7	-63.5	-174.7	164.3	0	0	113.6
213	T	45.4	Very low	72.7	Confident	87 Å²	87	48.3 Å²	48.3	53%	0.534	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-13.7	-170.8	59.3	0	0	0	0	117.6	D211	D211-T213 PolarHBondContact O-N 2.97Å
214	K	54.7	Low	73.2	Confident	114 Å²	114	47.7 Å²	47.7	50%	0.496	26%	0.264	S	S	.	.			trans	-150.9	143.9	-178.9	-69.1	-170.3	-178.7	117.5	0	118.3	D211 A216	D211-K214 PolarHBondContact O-N 2.9Å; K214-A216 VanDerWaalsContact C-N 3.3Å; K214-A216 PolarHBondContact O-N 3.14Å; K214-A216 VanDerWaalsContact O-N 3.15Å
215	T	51.4	Low	73.5	Confident	129 Å²	129	47.3 Å²	47.3	79%	0.791	26%	0.262	S	S	*	.			trans	-77.5	50	172.9	45.6	0	0	0	0	113.4
216	A	57.7	Low	73.8	Confident	16 Å²	16	47.3 Å²	47.3	13%	0.132	26%	0.262	C	S	.	.			trans	-102.9	111.9	176.5	0	0	0	0	0	110.3	N170 K214	N170-A216 WeakPolarHBondContact ND2-CB 3.5Å; K214-A216 VanDerWaalsContact C-N 3.3Å; K214-A216 PolarHBondContact O-N 3.14Å; K214-A216 VanDerWaalsContact O-N 3.15Å
217	C	66.1	Low	74.2	Confident	48 Å²	48	47.3 Å²	47.3	32%	0.324	26%	0.262	S	S	.	.			trans	-87.4	129	164	-166	0	0	0	0	109.3	C248	C217-C248 WeakPolarHBondContact CA-SG 3.41Å; C217-C248 HydrophobicContact CB-CB 3.62Å; C217-C248 WeakPolarHBondContact CB-SG 3.28Å; C217-C248 WeakPolarHBondContact SG-CB 3.49Å; C217-C248 CovalentContact SG-SG 1.99Å; C217-C248 PolarHBondContact SG-SG 3.31Å
218	L	74.8	Confident	74.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.258	C	S	.	.			trans	-111.4	91.2	169.1	-57.1	-176.7	0	0	0	107.8	V166 N170 R185 I187 H208	V166-L218 HydrophobicContact CG1-CB 4.32Å; N170-L218 HydrophobicContact CB-CD2 4.46Å; R185-L218 HydrophobicContact CB-CD1 4.08Å; R185-L218 HydrophobicContact CB-CD2 3.98Å; I187-L218 HydrophobicContact CB-CD1 4.31Å; I187-L218 HydrophobicContact CD1-CB 3.83Å; I187-L218 HydrophobicContact CD1-CD1 4.32Å; I187-L218 HydrophobicContact CD1-CG 4.14Å; I187-L218 HydrophobicContact CG1-CB 4.38Å; I187-L218 HydrophobicContact CG1-CD1 4.01Å; I187-L218 HydrophobicContact CG1-CG 4.37Å; I187-L218 HydrophobicContact CG2-CD1 3.79Å; I187-L218 HydrophobicContact CG2-CG 4.01Å; H208-L218 PolarHBondContact CE1-O 3.48Å
219	G	72.9	Confident	74.6	Confident	34 Å²	34	47 Å²	47	35%	0.351	26%	0.258	S	S	.	.			trans	-118.4	12.4	-172.7	0	0	0	0	0	114.1	L241	G219-L241 VanDerWaalsContact C-CD2 3.44Å; G219-L241 WeakPolarHBondContact O-CD2 3.45Å
220	D	81.3	Confident	75	Confident	15 Å²	15	49.4 Å²	49.4	8%	0.08	27%	0.265	C	S	.	.			trans	-64.3	136	-172.4	-63.6	-60.6	0	0	0	111.4	F69 W169 G222 S223 L241	F69-D220 HydrophobicContact CD2-CB 3.4Å; F69-D220 VanDerWaalsContact CD2-CB 3.4Å; F69-D220 HydrophobicContact CE2-CB 3.34Å; F69-D220 WeakPolarHBondContact CE2-OD2 3.48Å; W169-D220 PolarHBondContact N-OD2 2.85Å; D220-G222 PolarHBondContact O-N 3.12Å; D220-S223 VanDerWaalsContact O-CB 3.28Å; D220-S223 WeakPolarHBondContact O-CB 3.35Å; D220-S223 PolarHBondContact O-N 2.97Å; D220-S223 VanDerWaalsContact O-N 3.14Å; D220-S223 PolarHBondContact O-OG 3.18Å; D220-L241 WeakPolarHBondContact O-CD2 3.38Å
221	P	88.6	Confident	75.5	Confident	32 Å²	32	49.9 Å²	49.9	21%	0.208	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	137.8	-176.7	-21.1	29.8	0	0	0	112.2	A68 F69 I81 S223	A68-P221 CarbonylContact C-O 3.59Å; A68-P221 VanDerWaalsContact CA-O 3.29Å; A68-P221 WeakPolarHBondContact CA-O 3.5Å; A68-P221 HydrophobicContact CB-CB 4.4Å; A68-P221 VanDerWaalsContact CB-O 3.28Å; A68-P221 WeakPolarHBondContact CB-O 3.38Å; F69-P221 PolarHBondContact N-O 2.92Å; I81-P221 HydrophobicContact CD1-CB 3.48Å; I81-P221 VanDerWaalsContact CD1-CB 3.48Å; P221-S223 PolarHBondContact O-N 3.42Å
222	G	91.5	Very high	76.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	77	1.7	178.9	0	0	0	0	0	115.4	D220 L241	D220-G222 PolarHBondContact O-N 3.12Å; G222-L241 PolarHBondContact N-O 2.86Å
223	S	91.8	Very high	78	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.249	C	C	.	.			trans	-52.1	125.4	176.2	-68.1	0	0	0	0	111.5	D220 P221 L241	D220-S223 VanDerWaalsContact O-CB 3.28Å; D220-S223 WeakPolarHBondContact O-CB 3.35Å; D220-S223 PolarHBondContact O-N 2.97Å; D220-S223 VanDerWaalsContact O-N 3.14Å; D220-S223 PolarHBondContact O-OG 3.18Å; P221-S223 PolarHBondContact O-N 3.42Å; S223-L241 WeakPolarHBondContact O-CB 3.04Å; S223-L241 PolarHBondContact O-N 2.9Å
224	P	94.2	Very high	80.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	129.9	-176.4	28.9	-32.4	0	0	0	111.2	V56 C71 M226 L237	V56-P224 HydrophobicContact CG1-CG 4.2Å; V56-P224 HydrophobicContact CG2-CG 3.83Å; C71-P224 HydrophobicContact CB-CB 4.12Å; P224-M226 HydrophobicContact CB-CG 3.94Å; P224-M226 HydrophobicContact CB-SD 4.29Å; P224-M226 HydrophobicContact CG-CE 4.42Å; P224-M226 HydrophobicContact CG-CG 4.25Å; P224-M226 HydrophobicContact CG-SD 3.93Å; P224-M226 WeakPolarHBondContact O-CE 3.06Å; P224-L237 HydrophobicContact CB-CD1 3.42Å; P224-L237 VanDerWaalsContact CB-CD1 3.42Å
225	M	93.8	Very high	81.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	108.3	164.8	-174.4	169	79.4	0	0	108.6	V166 V189 E204 R238 G239 Y254	V166-M225 HydrophobicContact CG2-CB 4.08Å; V166-M225 HydrophobicContact CG2-CG 4.35Å; V189-M225 HydrophobicContact CB-SD 4.49Å; V189-M225 HydrophobicContact CG1-CG 4.44Å; V189-M225 HydrophobicContact CG1-SD 3.7Å; E204-M225 HydrophobicContact CG-CE 4.13Å; M225-R238 HydrophobicContact CE-CB 3.85Å; M225-R238 HydrophobicContact CE-CG 3.31Å; M225-R238 HydrophobicContact CG-CB 4.5Å; M225-R238 WeakPolarHBondContact O-CB 3.37Å; M225-R238 PolarHBondContact O-N 2.82Å; M225-G239 PolarHBondContact N-O 3.37Å; M225-G239 PolarHBondContact O-N 3.07Å; M225-Y254 HydrophobicContact CB-CD1 3.82Å; M225-Y254 HydrophobicContact CB-CE1 3.69Å; M225-Y254 HydrophobicContact CB-CG 4.48Å; M225-Y254 HydrophobicContact SD-CD2 4.11Å; M225-Y254 HydrophobicContact SD-CE1 4.39Å; M225-Y254 HydrophobicContact SD-CE2 3.96Å; M225-Y254 HydrophobicContact SD-CG 4.36Å
226	M	94.5	Very high	84	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	126.5	-171	-53.9	156	-66.9	0	0	108.4	F53 W55 V56 I148 C164 W165 P224 W235 V236	F53-M226 HydrophobicContact CB-SD 4.38Å; F53-M226 HydrophobicContact CD1-CE 4.26Å; F53-M226 HydrophobicContact CD1-SD 4.19Å; F53-M226 HydrophobicContact CD2-CE 4.23Å; F53-M226 HydrophobicContact CE1-CE 4.41Å; F53-M226 HydrophobicContact CE2-CE 4.37Å; F53-M226 HydrophobicContact CG-CE 4.18Å; F53-M226 HydrophobicContact CG-SD 4.25Å; F53-M226 HydrophobicContact CZ-CE 4.47Å; W55-M226 PolarHBondContact NE1-SD 3.48Å; V56-M226 HydrophobicContact CG2-CE 4.28Å; V56-M226 HydrophobicContact CG2-SD 3.56Å; V56-M226 VanDerWaalsContact CG2-SD 3.56Å; I148-M226 HydrophobicContact CD1-CB 4.04Å; I148-M226 HydrophobicContact CD1-CG 3.8Å; C164-M226 CarbonylContact C-O 3.54Å; C164-M226 VanDerWaalsContact CA-O 3.26Å; C164-M226 WeakPolarHBondContact CA-O 3.5Å; W165-M226 PolarHBondContact N-O 3.14Å; W165-M226 VanDerWaalsContact O-CE 3.31Å; W165-M226 WeakPolarHBondContact O-CE 3.47Å; W165-M226 PolarHBondContact O-N 3.31Å; P224-M226 HydrophobicContact CB-CG 3.94Å; P224-M226 HydrophobicContact CB-SD 4.29Å; P224-M226 HydrophobicContact CG-CE 4.42Å; P224-M226 HydrophobicContact CG-CG 4.25Å; P224-M226 HydrophobicContact CG-SD 3.93Å; P224-M226 WeakPolarHBondContact O-CE 3.06Å; M226-W235 HydrophobicContact CB-CE3 3.9Å; M226-W235 HydrophobicContact CB-CZ3 4.15Å; M226-V236 WeakPolarHBondContact CA-O 3.2Å
227	C	93.4	Very high	85.7	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	154.8	-177.7	-59.1	0	0	0	0	110.9	L161 C164 W235 V236	L161-C227 HydrophobicContact CB-CB 4.02Å; L161-C227 HydrophobicContact CD1-CB 4.19Å; L161-C227 HydrophobicContact CD2-CB 4.29Å; L161-C227 HydrophobicContact CG-CB 4.4Å; C164-C227 HydrophobicContact CB-CB 4.12Å; C164-C227 WeakPolarHBondContact CB-SG 3.31Å; C164-C227 WeakPolarHBondContact SG-CB 3.31Å; C164-C227 CovalentContact SG-SG 2.04Å; C164-C227 PolarHBondContact SG-SG 2.92Å; C227-W235 CarbonylContact O-C 3.57Å; C227-W235 WeakPolarHBondContact O-CA 3.3Å; C227-V236 HydrophobicContact CB-CG2 4.41Å; C227-V236 PolarHBondContact N-O 3.42Å; C227-V236 WeakPolarHBondContact O-CG2 3.34Å; C227-V236 PolarHBondContact O-N 2.69Å
228	Q	91.9	Very high	87	Confident	26 Å²	26	29.7 Å²	29.7	12%	0.121	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	137.4	172.9	-67.5	-178.4	-36.5	0	0	111.1	Q162 N163 Q230 L234 W235	Q162-Q228 HydrophobicContact CG-CB 4.37Å; Q162-Q228 PolarHBondContact N-O 3.1Å; Q162-Q228 PolarHBondContact O-N 2.87Å; N163-Q228 HydrophobicContact CB-CB 4.38Å; N163-Q228 HydrophobicContact CB-CG 4.28Å; N163-Q228 PolarHBondContact ND2-OE1 2.85Å; Q228-Q230 PolarHBondContact O-N 2.86Å; Q228-L234 WeakPolarHBondContact CA-O 3.04Å; Q228-W235 HydrophobicContact CG-CD2 3.69Å; Q228-W235 HydrophobicContact CG-CE3 3.95Å; Q228-W235 HydrophobicContact CG-CG 4.29Å; Q228-W235 HydrophobicContact CG-CH2 3.96Å; Q228-W235 HydrophobicContact CG-CZ2 3.69Å; Q228-W235 HydrophobicContact CG-CZ3 4.08Å; Q228-W235 VanDerWaalsContact NE2-CZ2 3.27Å
229	L	88.1	Confident	88	Confident	3 Å²	3	29.7 Å²	29.7	2%	0.016	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	116.6	165.3	-73.2	171.3	0	0	0	109	L151 P159 L161 Q231 F232 D233 L234 V236 W281	L151-L229 HydrophobicContact CD2-CD2 4.26Å; P159-L229 HydrophobicContact CB-CD2 3.5Å; P159-L229 HydrophobicContact CG-CD2 3.53Å; L161-L229 HydrophobicContact CD2-CD2 3.75Å; L161-L229 HydrophobicContact CD2-CG 4.44Å; L229-Q231 PolarHBondContact O-N 3.05Å; L229-F232 HydrophobicContact CB-CB 4.45Å; L229-F232 PolarHBondContact O-N 3.16Å; L229-F232 VanDerWaalsContact O-N 3.1Å; L229-D233 PolarHBondContact O-N 3.46Å; L229-L234 HydrophobicContact CD1-CB 4.13Å; L229-L234 PolarHBondContact N-O 2.92Å; L229-V236 HydrophobicContact CD1-CG1 3.65Å; L229-V236 HydrophobicContact CD2-CG1 4.33Å; L229-V236 HydrophobicContact CG-CG1 3.77Å; L229-V236 HydrophobicContact CG-CG2 4.36Å; L229-W281 HydrophobicContact CD1-CB 4.44Å
230	Q	79.7	Confident	89	Confident	102 Å²	102	28.1 Å²	28.1	48%	0.477	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-26.1	-174.3	-176	175.7	18.3	0	0	114.2	V160 Q162 Q228	V160-Q230 HydrophobicContact CB-CB 4.5Å; V160-Q230 PolarHBondContact O-N 3.4Å; Q162-Q230 HydrophobicContact CG-CB 4.29Å; Q228-Q230 PolarHBondContact O-N 2.86Å
231	Q	74	Confident	89.5	Confident	149 Å²	149	27.5 Å²	27.5	70%	0.696	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-15.7	-174.4	-64.9	174.7	6.7	0	0	114.6	L229	L229-Q231 PolarHBondContact O-N 3.05Å
232	F	75.1	Confident	89.6	Confident	86 Å²	86	26.5 Å²	26.5	38%	0.377	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132	-0.5	-165.6	-62	-72.3	0	0	0	114.5	L229 L234 W281 I285	L229-F232 HydrophobicContact CB-CB 4.45Å; L229-F232 PolarHBondContact O-N 3.16Å; L229-F232 VanDerWaalsContact O-N 3.1Å; F232-L234 HydrophobicContact CB-CB 4.2Å; F232-L234 HydrophobicContact CB-CD1 3.86Å; F232-L234 HydrophobicContact CB-CG 3.98Å; F232-L234 PolarHBondContact O-N 2.7Å; F232-W281 HydrophobicContact CE2-CZ3 4.49Å; F232-I285 HydrophobicContact CE1-CG1 4.27Å; F232-I285 HydrophobicContact CE2-CD1 3.73Å; F232-I285 HydrophobicContact CE2-CG1 4.24Å; F232-I285 HydrophobicContact CZ-CD1 3.55Å; F232-I285 HydrophobicContact CZ-CG1 3.71Å
233	D	77.6	Confident	89	Confident	118 Å²	118	30.2 Å²	30.2	63%	0.631	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	48	26.6	-172.1	-68.1	-30	0	0	0	113.4	L229	L229-D233 PolarHBondContact O-N 3.46Å
234	L	89.3	Confident	88	Confident	24 Å²	24	31.5 Å²	31.5	13%	0.126	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	134	-180	-77	174	0	0	0	109.9	C30 V32 Q228 L229 F232 L284	C30-L234 WeakPolarHBondContact O-CD2 3.45Å; V32-L234 HydrophobicContact CG2-CD2 4.27Å; Q228-L234 WeakPolarHBondContact CA-O 3.04Å; L229-L234 HydrophobicContact CD1-CB 4.13Å; L229-L234 PolarHBondContact N-O 2.92Å; F232-L234 HydrophobicContact CB-CB 4.2Å; F232-L234 HydrophobicContact CB-CD1 3.86Å; F232-L234 HydrophobicContact CB-CG 3.98Å; F232-L234 PolarHBondContact O-N 2.7Å; L234-L284 HydrophobicContact CD1-CD1 3.87Å
235	W	93.1	Very high	86.6	Confident	6 Å²	6	32 Å²	32	2%	0.023	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	130	176.1	-69.2	84.2	0	0	0	111.6	G31 F53 W55 I148 C149 W165 M226 C227 Q228	G31-W235 VanDerWaalsContact CA-O 3.25Å; G31-W235 WeakPolarHBondContact CA-O 3.26Å; G31-W235 PolarHBondContact O-N 3.41Å; F53-W235 AromaticContact CE1-CH2 3.75Å; F53-W235 HydrophobicContact CE1-CH2 3.75Å; F53-W235 HydrophobicContact CE1-CZ2 4.13Å; F53-W235 HydrophobicContact CE1-CZ3 4Å; F53-W235 HydrophobicContact CZ-CH2 4.39Å; W55-W235 HydrophobicContact CH2-CB 3.46Å; W55-W235 VanDerWaalsContact CH2-CB 3.46Å; W55-W235 AromaticContact CH2-CD1 3.53Å; W55-W235 HydrophobicContact CH2-CD2 4.1Å; W55-W235 AromaticContact CH2-CG 3.4Å; W55-W235 HydrophobicContact CH2-CG 3.4Å; W55-W235 HydrophobicContact CZ2-CB 3.58Å; W55-W235 AromaticContact CZ2-CD2 3.85Å; W55-W235 HydrophobicContact CZ2-CD2 3.85Å; W55-W235 HydrophobicContact CZ2-CE3 4.3Å; W55-W235 AromaticContact CZ2-CG 3.55Å; W55-W235 HydrophobicContact CZ2-CG 3.55Å; W55-W235 HydrophobicContact CZ3-CB 4.25Å; I148-W235 HydrophobicContact CD1-CB 4.4Å; I148-W235 HydrophobicContact CG1-CB 4.27Å; I148-W235 WeakPolarHBondContact CG1-O 3.47Å; C149-W235 WeakPolarHBondContact CB-O 3.39Å; C149-W235 PolarHBondContact N-O 2.88Å; W165-W235 AromaticContact CD1-CH2 3.51Å; W165-W235 AromaticContact CD1-CZ3 3.86Å; W165-W235 HydrophobicContact CG-CH2 4.36Å; M226-W235 HydrophobicContact CB-CE3 3.9Å; M226-W235 HydrophobicContact CB-CZ3 4.15Å; C227-W235 CarbonylContact O-C 3.57Å; C227-W235 WeakPolarHBondContact O-CA 3.3Å; Q228-W235 HydrophobicContact CG-CD2 3.69Å; Q228-W235 HydrophobicContact CG-CE3 3.95Å; Q228-W235 HydrophobicContact CG-CG 4.29Å; Q228-W235 HydrophobicContact CG-CH2 3.96Å; Q228-W235 HydrophobicContact CG-CZ2 3.69Å; Q228-W235 HydrophobicContact CG-CZ3 4.08Å; Q228-W235 VanDerWaalsContact NE2-CZ2 3.27Å
236	V	93.8	Very high	85.1	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	141.9	175.4	-64	0	0	0	0	110.7	C149 L151 L161 M226 C227 L229 R238	C149-V236 HydrophobicContact CB-CG1 3.89Å; C149-V236 CarbonylContact O-C 3.54Å; C149-V236 VanDerWaalsContact O-CA 3.29Å; C149-V236 WeakPolarHBondContact O-CA 3.42Å; L151-V236 HydrophobicContact CD2-CG1 4.06Å; L151-V236 HydrophobicContact CG-CG2 4.49Å; L161-V236 HydrophobicContact CD1-CG2 4.48Å; L161-V236 HydrophobicContact CD2-CG2 3.54Å; M226-V236 WeakPolarHBondContact CA-O 3.2Å; C227-V236 HydrophobicContact CB-CG2 4.41Å; C227-V236 PolarHBondContact N-O 3.42Å; C227-V236 WeakPolarHBondContact O-CG2 3.34Å; C227-V236 PolarHBondContact O-N 2.69Å; L229-V236 HydrophobicContact CD1-CG1 3.65Å; L229-V236 HydrophobicContact CD2-CG1 4.33Å; L229-V236 HydrophobicContact CG-CG1 3.77Å; L229-V236 HydrophobicContact CG-CG2 4.36Å; V236-R238 PolarHBondContact O-N 3.2Å
237	L	95.1	Very high	83.9	Confident	1 Å²	1	46 Å²	46	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	109.2	168.5	-174.1	61	0	0	0	108.5	C71 L73 L79 I148 C149 F150 P224 G239 V240 V257	C71-L237 HydrophobicContact CB-CD1 4.32Å; C71-L237 HydrophobicContact CB-CD2 3.95Å; L73-L237 HydrophobicContact CD2-CD2 4.16Å; L79-L237 HydrophobicContact CD2-CD2 3.67Å; I148-L237 HydrophobicContact CD1-CB 4.05Å; I148-L237 HydrophobicContact CG1-CB 4.47Å; I148-L237 HydrophobicContact CG2-CB 3.79Å; I148-L237 HydrophobicContact CG2-CD2 4.44Å; C149-L237 PolarHBondContact O-N 3.33Å; F150-L237 HydrophobicContact CB-CB 4.36Å; P224-L237 HydrophobicContact CB-CD1 3.42Å; P224-L237 VanDerWaalsContact CB-CD1 3.42Å; L237-G239 WeakPolarHBondContact CD1-O 3.31Å; L237-V240 HydrophobicContact CD1-CG1 4.37Å; L237-V240 HydrophobicContact CD2-CG1 4.21Å; L237-V257 HydrophobicContact CD2-CG1 4.36Å; L237-V257 HydrophobicContact CD2-CG2 4.06Å; L237-V257 HydrophobicContact CG-CG1 4.5Å; L237-V257 HydrophobicContact CG-CG2 3.99Å
238	R	93.6	Very high	82.8	Confident	28 Å²	28	48.7 Å²	48.7	11%	0.106	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-49.5	-179.2	-178.2	49	173.2	156.6	16.9	110.7	L161 D191 E204 M225 V236 V257 E258	L161-R238 HydrophobicContact CD1-CB 4.32Å; L161-R238 VanDerWaalsContact CD1-CD 3.44Å; L161-R238 HydrophobicContact CD1-CG 3.91Å; D191-R238 IonicContact OD2-NE 3.15Å; D191-R238 PolarHBondContact OD2-NE 2.96Å; E204-R238 WeakPolarHBondContact OE1-CG 3.41Å; E204-R238 IonicContact OE1-NE 3.37Å; E204-R238 VanDerWaalsContact OE1-O 3.06Å; E204-R238 IonicContact OE2-CZ 2.7Å; E204-R238 IonicContact OE2-NE 3.93Å; E204-R238 PolarHBondContact OE2-NE 2.81Å; E204-R238 IonicContact OE2-NH1 3.67Å; E204-R238 IonicContact OE2-NH2 2.92Å; E204-R238 PolarHBondContact OE2-NH2 2.98Å; M225-R238 HydrophobicContact CE-CB 3.85Å; M225-R238 HydrophobicContact CE-CG 3.31Å; M225-R238 HydrophobicContact CG-CB 4.5Å; M225-R238 WeakPolarHBondContact O-CB 3.37Å; M225-R238 PolarHBondContact O-N 2.82Å; V236-R238 PolarHBondContact O-N 3.2Å; R238-V257 PolarHBondContact O-N 2.92Å; R238-E258 IonicContact NH1-OE2 2.97Å; R238-E258 PolarHBondContact NH1-OE2 2.72Å
239	G	94.1	Very high	82.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	162.5	-178.5	0	0	0	0	0	112.9	M225 L237 T255	M225-G239 PolarHBondContact N-O 3.37Å; M225-G239 PolarHBondContact O-N 3.07Å; L237-G239 WeakPolarHBondContact CD1-O 3.31Å; G239-T255 VanDerWaalsContact CA-O 3.26Å; G239-T255 WeakPolarHBondContact CA-O 3.19Å
240	V	95	Very high	81.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	134.5	165.6	-67.5	0	0	0	0	109	L79 I81 L237 N242 Y254 T255 V257	L79-V240 HydrophobicContact CD2-CG1 4.26Å; I81-V240 HydrophobicContact CG2-CB 4.21Å; I81-V240 HydrophobicContact CG2-CG2 3.76Å; L237-V240 HydrophobicContact CD1-CG1 4.37Å; L237-V240 HydrophobicContact CD2-CG1 4.21Å; V240-N242 PolarHBondContact O-N 2.04Å; V240-N242 VanDerWaalsContact O-N 3.12Å; V240-Y254 CarbonylContact O-C 3.58Å; V240-Y254 VanDerWaalsContact O-CA 3.29Å; V240-Y254 WeakPolarHBondContact O-CA 3.27Å; V240-T255 PolarHBondContact N-O 3.25Å; V240-T255 VanDerWaalsContact N-O 3.14Å; V240-T255 PolarHBondContact O-N 2.86Å; V240-V257 HydrophobicContact CG1-CG2 4.24Å
241	L	92.1	Very high	82.1	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	116.6	-172.4	-177.6	60.7	0	0	0	110.2	I81 G219 D220 G222 S223 F252 Y254	I81-L241 WeakPolarHBondContact CG2-O 3.47Å; G219-L241 VanDerWaalsContact C-CD2 3.44Å; G219-L241 WeakPolarHBondContact O-CD2 3.45Å; D220-L241 WeakPolarHBondContact O-CD2 3.38Å; G222-L241 PolarHBondContact N-O 2.86Å; S223-L241 WeakPolarHBondContact O-CB 3.04Å; S223-L241 PolarHBondContact O-N 2.9Å; L241-F252 HydrophobicContact CD1-CB 3.72Å; L241-F252 HydrophobicContact CD1-CD1 3.85Å; L241-F252 HydrophobicContact CD1-CG 4.24Å; L241-F252 HydrophobicContact CD2-CD1 4.24Å; L241-Y254 VanDerWaalsContact CA-CD1 3.49Å; L241-Y254 HydrophobicContact CB-CD1 4Å; L241-Y254 HydrophobicContact CB-CE1 3.79Å; L241-Y254 HydrophobicContact CD1-CD1 4.18Å; L241-Y254 HydrophobicContact CD1-CE1 3.83Å; L241-Y254 HydrophobicContact CD1-CE2 4.29Å; L241-Y254 HydrophobicContact CG-CE1 4.38Å
242	N	89.8	Confident	82.7	Confident	11 Å²	11	40.4 Å²	40.4	6%	0.059	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-59.8	-176.3	-177	-9.3	0	0	0	110	M126 N129 V240 L253 T255	M126-N242 PolarHBondContact O-ND2 3.38Å; N129-N242 WeakPolarHBondContact CB-OD1 3.33Å; N129-N242 PolarHBondContact ND2-OD1 3.33Å; V240-N242 PolarHBondContact O-N 2.04Å; V240-N242 VanDerWaalsContact O-N 3.12Å; N242-L253 WeakPolarHBondContact CB-O 3.3Å; N242-L253 PolarHBondContact N-O 2.58Å; N242-T255 PolarHBondContact ND2-OG1 3.42Å
243	F	79.9	Confident	83.4	Confident	79 Å²	79	36.4 Å²	36.4	35%	0.346	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	151.4	174.5	71.1	-85.9	0	0	0	111.9	L200 L253	L200-F243 HydrophobicContact CD1-CD1 4.49Å; L200-F243 HydrophobicContact CD1-CE1 3.63Å; L200-F243 HydrophobicContact CD1-CZ 4.32Å; F243-L253 HydrophobicContact CD1-CB 3.91Å; F243-L253 HydrophobicContact CD1-CD1 4.46Å; F243-L253 HydrophobicContact CE1-CB 3.64Å; F243-L253 HydrophobicContact CE1-CD1 3.46Å; F243-L253 VanDerWaalsContact CE1-CD1 3.46Å; F243-L253 HydrophobicContact CE1-CG 4.15Å; F243-L253 HydrophobicContact CE2-CB 4.35Å; F243-L253 HydrophobicContact CE2-CD1 3.61Å; F243-L253 HydrophobicContact CG-CB 4.39Å; F243-L253 HydrophobicContact CZ-CB 3.95Å; F243-L253 HydrophobicContact CZ-CD1 2.99Å; F243-L253 HydrophobicContact CZ-CG 4.05Å; F243-L253 PolarHBondContact N-O 2.71Å; F243-L253 PolarHBondContact O-N 2.82Å; F243-L253 VanDerWaalsContact O-N 3.08Å
244	G	70.3	Confident	84.1	Confident	27 Å²	27	30.8 Å²	30.8	28%	0.278	17%	0.172	S	C	.	.			trans	-77.4	160	-173.7	0	0	0	0	0	114.5	F252	G244-F252 VanDerWaalsContact CA-CD1 3.44Å
245	G	63.3	Low	84.3	Confident	11 Å²	11	29.7 Å²	29.7	11%	0.113	17%	0.167	C	C	.	.			trans	-73	160.9	167.1	0	0	0	0	0	112.7	T247 L251	G245-T247 PolarHBondContact O-N 2.86Å; G245-T247 VanDerWaalsContact O-N 3.15Å; G245-L251 WeakPolarHBondContact CA-O 3.4Å; G245-L251 PolarHBondContact N-O 3.46Å
246	E	62.3	Low	84.3	Confident	200 Å²	200	31.6 Å²	31.6	94%	0.935	18%	0.175	S	C	*	.	S	Bend	trans	-61.9	-19.2	174.3	-61.1	-179.7	169.6	0	0	112.9
247	T	70.7	Confident	84.4	Confident	94 Å²	94	31.6 Å²	31.6	58%	0.577	18%	0.175	S	C	*	.	S	Bend	trans	-134.7	151.2	-178	56	0	0	0	0	111.6	G245 G250	G245-T247 PolarHBondContact O-N 2.86Å; G245-T247 VanDerWaalsContact O-N 3.15Å; T247-G250 WeakPolarHBondContact O-CA 3.47Å
248	C	70.4	Confident	84.2	Confident	56 Å²	56	32.1 Å²	32.1	38%	0.378	18%	0.178	S	C	.	.	S	Bend	trans	-137.8	128	174.5	-157.2	0	0	0	0	112.9	C217 F252	C217-C248 WeakPolarHBondContact CA-SG 3.41Å; C217-C248 HydrophobicContact CB-CB 3.62Å; C217-C248 WeakPolarHBondContact CB-SG 3.28Å; C217-C248 WeakPolarHBondContact SG-CB 3.49Å; C217-C248 CovalentContact SG-SG 1.99Å; C217-C248 PolarHBondContact SG-SG 3.31Å; C248-F252 HydrophobicContact CB-CZ 4.13Å
249	P	77.8	Confident	84.1	Confident	42 Å²	42	32.6 Å²	32.6	27%	0.273	18%	0.182	S	C	.	.	S	Bend	cis	-61.7	149.4	-5.7	-22	36.2	0	0	0	112.2	H208 K210	H208-P249 HydrophobicContact CB-CB 4.36Å; H208-P249 WeakPolarHBondContact O-CB 3.42Å; K210-P249 HydrophobicContact CB-CB 4.21Å; K210-P249 HydrophobicContact CB-CG 3.78Å; K210-P249 HydrophobicContact CD-CG 4.46Å; K210-P249 HydrophobicContact CG-CG 3.99Å
250	G	80.9	Confident	84.2	Confident	10 Å²	10	32.7 Å²	32.7	10%	0.103	18%	0.183	C	C	.	.	S	Bend	trans	-178.6	-159.8	-170.1	0	0	0	0	0	113.1	S207 H208 T247 F252	S207-G250 CarbonylContact C-O 3.48Å; S207-G250 WeakPolarHBondContact CA-O 3.37Å; H208-G250 PolarHBondContact N-O 3.24Å; H208-G250 PolarHBondContact O-N 2.81Å; T247-G250 WeakPolarHBondContact O-CA 3.47Å; G250-F252 WeakPolarHBondContact O-CD2 3.48Å
251	L	85.8	Confident	84.1	Confident	48 Å²	48	32.9 Å²	32.9	25%	0.251	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	124	-176.5	-68.9	166.3	0	0	0	111.2	L192 P196 L197 G245	L192-L251 HydrophobicContact CD1-CD2 3.28Å; P196-L251 HydrophobicContact CG-CD1 3.42Å; P196-L251 VanDerWaalsContact CG-CD1 3.42Å; P196-L251 HydrophobicContact CG-CD2 4.39Å; L197-L251 HydrophobicContact CD1-CB 4.02Å; L197-L251 HydrophobicContact CG-CB 4.48Å; G245-L251 WeakPolarHBondContact CA-O 3.4Å; G245-L251 PolarHBondContact N-O 3.46Å
252	F	87.1	Confident	84.1	Confident	6 Å²	6	38.8 Å²	38.8	3%	0.026	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	145.6	-178.7	-71.7	-105.7	0	0	0	110.3	C205 G206 H208 L241 G244 C248 G250 Y254	C205-F252 WeakPolarHBondContact CA-O 3.45Å; G206-F252 PolarHBondContact N-O 3.31Å; G206-F252 PolarHBondContact O-N 3.11Å; H208-F252 HydrophobicContact CB-CD2 4.13Å; H208-F252 HydrophobicContact CB-CE2 4.06Å; H208-F252 AromaticContact CD2-CD2 3.52Å; H208-F252 AromaticContact CD2-CG 3.96Å; H208-F252 AromaticContact CE1-CD1 3.69Å; H208-F252 AromaticContact CE1-CD2 3.41Å; H208-F252 VanDerWaalsContact CE1-CD2 3.41Å; H208-F252 WeakPolarHBondContact CE1-CD2 3.48Å; H208-F252 AromaticContact CE1-CE1 3.93Å; H208-F252 AromaticContact CE1-CE2 3.66Å; H208-F252 AromaticContact CE1-CG 3.48Å; H208-F252 VanDerWaalsContact CE1-CG 3.48Å; H208-F252 WeakPolarHBondContact CE1-CG 3.4Å; H208-F252 AromaticContact CE1-CZ 3.93Å; H208-F252 AromaticContact CG-CD2 3.46Å; H208-F252 VanDerWaalsContact CG-CD2 3.46Å; H208-F252 AromaticContact CG-CE2 3.63Å; H208-F252 AromaticContact ND1-CD2 3.41Å; H208-F252 WeakPolarHBondContact ND1-CD2 3.37Å; H208-F252 AromaticContact ND1-CE2 3.3Å; H208-F252 VanDerWaalsContact ND1-CE2 3.3Å; H208-F252 WeakPolarHBondContact ND1-CE2 3.25Å; H208-F252 AromaticContact ND1-CG 3.97Å; H208-F252 AromaticContact ND1-CZ 3.75Å; H208-F252 AromaticContact NE2-CD2 3.48Å; H208-F252 WeakPolarHBondContact NE2-CD2 3.42Å; H208-F252 AromaticContact NE2-CG 3.47Å; H208-F252 WeakPolarHBondContact NE2-CG 3.07Å; L241-F252 HydrophobicContact CD1-CB 3.72Å; L241-F252 HydrophobicContact CD1-CD1 3.85Å; L241-F252 HydrophobicContact CD1-CG 4.24Å; L241-F252 HydrophobicContact CD2-CD1 4.24Å; G244-F252 VanDerWaalsContact CA-CD1 3.44Å; C248-F252 HydrophobicContact CB-CZ 4.13Å; G250-F252 WeakPolarHBondContact O-CD2 3.48Å; F252-Y254 HydrophobicContact CB-CE2 3.76Å; F252-Y254 WeakPolarHBondContact O-CD2 3.19Å
253	L	89.6	Confident	84.3	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.4	178.9	-87.9	165.8	0	0	0	110.8	C195 L197 N242 F243	C195-L253 WeakPolarHBondContact SG-CD2 3.41Å; L197-L253 HydrophobicContact CB-CD1 3.82Å; L197-L253 HydrophobicContact CB-CG 4.39Å; L197-L253 HydrophobicContact CD1-CD1 3.74Å; L197-L253 HydrophobicContact CD1-CG 3.81Å; L197-L253 HydrophobicContact CG-CD1 4.43Å; N242-L253 WeakPolarHBondContact CB-O 3.3Å; N242-L253 PolarHBondContact N-O 2.58Å; F243-L253 HydrophobicContact CD1-CB 3.91Å; F243-L253 HydrophobicContact CD1-CD1 4.46Å; F243-L253 HydrophobicContact CE1-CB 3.64Å; F243-L253 HydrophobicContact CE1-CD1 3.46Å; F243-L253 VanDerWaalsContact CE1-CD1 3.46Å; F243-L253 HydrophobicContact CE1-CG 4.15Å; F243-L253 HydrophobicContact CE2-CB 4.35Å; F243-L253 HydrophobicContact CE2-CD1 3.61Å; F243-L253 HydrophobicContact CG-CB 4.39Å; F243-L253 HydrophobicContact CZ-CB 3.95Å; F243-L253 HydrophobicContact CZ-CD1 2.99Å; F243-L253 HydrophobicContact CZ-CG 4.05Å; F243-L253 PolarHBondContact N-O 2.71Å; F243-L253 PolarHBondContact O-N 2.82Å; F243-L253 VanDerWaalsContact O-N 3.08Å
254	Y	92.3	Very high	85	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142.4	179.6	-62.6	-97.8	0	0	0	110.1	V166 T203 E204 H208 M225 V240 L241 F252 K256	V166-Y254 HydrophobicContact CG2-CE1 4.18Å; V166-Y254 WeakPolarHBondContact CG2-OH 3.34Å; T203-Y254 CarbonylContact C-O 3.56Å; T203-Y254 WeakPolarHBondContact CA-O 3.4Å; T203-Y254 VanDerWaalsContact CB-O 3.25Å; T203-Y254 WeakPolarHBondContact CB-O 3.18Å; E204-Y254 PolarHBondContact N-O 3.31Å; E204-Y254 PolarHBondContact O-N 3.21Å; H208-Y254 PolarHBondContact CD2-OH 3.1Å; H208-Y254 AromaticContact NE2-CZ 3.84Å; H208-Y254 PolarHBondContact NE2-OH 2.92Å; M225-Y254 HydrophobicContact CB-CD1 3.82Å; M225-Y254 HydrophobicContact CB-CE1 3.69Å; M225-Y254 HydrophobicContact CB-CG 4.48Å; M225-Y254 HydrophobicContact SD-CD2 4.11Å; M225-Y254 HydrophobicContact SD-CE1 4.39Å; M225-Y254 HydrophobicContact SD-CE2 3.96Å; M225-Y254 HydrophobicContact SD-CG 4.36Å; V240-Y254 CarbonylContact O-C 3.58Å; V240-Y254 VanDerWaalsContact O-CA 3.29Å; V240-Y254 WeakPolarHBondContact O-CA 3.27Å; L241-Y254 VanDerWaalsContact CA-CD1 3.49Å; L241-Y254 HydrophobicContact CB-CD1 4Å; L241-Y254 HydrophobicContact CB-CE1 3.79Å; L241-Y254 HydrophobicContact CD1-CD1 4.18Å; L241-Y254 HydrophobicContact CD1-CE1 3.83Å; L241-Y254 HydrophobicContact CD1-CE2 4.29Å; L241-Y254 HydrophobicContact CG-CE1 4.38Å; F252-Y254 HydrophobicContact CB-CE2 3.76Å; F252-Y254 WeakPolarHBondContact O-CD2 3.19Å; Y254-K256 PolarHBondContact O-N 3.19Å
255	T	94.1	Very high	86	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	118	163.8	-60.2	0	0	0	0	108.1	N129 I130 G239 V240 N242 V257 Y260	N129-T255 PolarHBondContact O-OG1 2.97Å; I130-T255 HydrophobicContact CB-CG2 4.18Å; G239-T255 VanDerWaalsContact CA-O 3.26Å; G239-T255 WeakPolarHBondContact CA-O 3.19Å; V240-T255 PolarHBondContact N-O 3.25Å; V240-T255 VanDerWaalsContact N-O 3.14Å; V240-T255 PolarHBondContact O-N 2.86Å; N242-T255 PolarHBondContact ND2-OG1 3.42Å; T255-V257 PolarHBondContact O-N 2.95Å; T255-Y260 HydrophobicContact CG2-CD2 3.84Å; T255-Y260 HydrophobicContact CG2-CE2 3.26Å
256	K	93.1	Very high	87.4	Confident	45 Å²	45	37 Å²	37	20%	0.196	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	103.5	-173.7	-176.7	-179	178.4	-166.6	0	110.3	K202 E204 Y254 E258 D259 Y260	K202-K256 WeakPolarHBondContact O-CB 3.31Å; K202-K256 PolarHBondContact O-N 2.66Å; E204-K256 HydrophobicContact CB-CB 4.46Å; E204-K256 HydrophobicContact CG-CB 4.29Å; Y254-K256 PolarHBondContact O-N 3.19Å; K256-E258 VanDerWaalsContact C-N 3.27Å; K256-E258 WeakPolarHBondContact CE-OE2 3.37Å; K256-E258 HydrophobicContact CG-CB 4.42Å; K256-E258 IonicContact NZ-OE2 3.89Å; K256-E258 PolarHBondContact NZ-OE2 3.13Å; K256-E258 VanDerWaalsContact NZ-OE2 3.15Å; K256-E258 PolarHBondContact O-N 3.03Å; K256-D259 PolarHBondContact O-N 3.39Å; K256-D259 VanDerWaalsContact O-N 3.11Å; K256-Y260 VanDerWaalsContact O-CD2 3.27Å; K256-Y260 WeakPolarHBondContact O-CD2 3.28Å
257	V	94.4	Very high	88.9	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-62.3	-34.5	-168.5	171.8	0	0	0	0	112.6	L79 F150 L237 R238 V240 T255 D259 Y260 S261 I264	L79-V257 HydrophobicContact CD2-CG1 3.98Å; L79-V257 HydrophobicContact CD2-CG2 3.83Å; F150-V257 HydrophobicContact CB-CG1 3.89Å; F150-V257 HydrophobicContact CD2-CG1 4.38Å; F150-V257 HydrophobicContact CG-CG1 4.34Å; L237-V257 HydrophobicContact CD2-CG1 4.36Å; L237-V257 HydrophobicContact CD2-CG2 4.06Å; L237-V257 HydrophobicContact CG-CG1 4.5Å; L237-V257 HydrophobicContact CG-CG2 3.99Å; R238-V257 PolarHBondContact O-N 2.92Å; V240-V257 HydrophobicContact CG1-CG2 4.24Å; T255-V257 PolarHBondContact O-N 2.95Å; V257-D259 PolarHBondContact O-N 3.46Å; V257-Y260 CarbonylContact O-C 3.48Å; V257-Y260 PolarHBondContact O-N 3.1Å; V257-S261 PolarHBondContact O-N 3.31Å; V257-I264 HydrophobicContact CG1-CD1 3.88Å
258	E	91.8	Very high	89.9	Confident	13 Å²	13	24.6 Å²	24.6	6%	0.061	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-53.1	-39.5	176.4	-176.1	-173.4	-172.6	0	0	112.8	L151 R238 K256 Y260 S261	L151-E258 HydrophobicContact CB-CB 4.22Å; L151-E258 HydrophobicContact CB-CG 3.99Å; L151-E258 WeakPolarHBondContact O-CA 3.13Å; R238-E258 IonicContact NH1-OE2 2.97Å; R238-E258 PolarHBondContact NH1-OE2 2.72Å; K256-E258 VanDerWaalsContact C-N 3.27Å; K256-E258 WeakPolarHBondContact CE-OE2 3.37Å; K256-E258 HydrophobicContact CG-CB 4.42Å; K256-E258 IonicContact NZ-OE2 3.89Å; K256-E258 PolarHBondContact NZ-OE2 3.13Å; K256-E258 VanDerWaalsContact NZ-OE2 3.15Å; K256-E258 PolarHBondContact O-N 3.03Å; E258-Y260 PolarHBondContact O-N 2.91Å; E258-S261 WeakPolarHBondContact O-CB 3.46Å; E258-S261 PolarHBondContact O-N 2.9Å; E258-S261 PolarHBondContact O-OG 3.29Å
259	D	92.1	Very high	90.7	Very high	37 Å²	37	27 Å²	27	20%	0.198	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-71.2	-19.2	-178.3	-76.4	-19.7	0	0	0	112.8	R153 K202 K256 V257	R153-D259 IonicContact NE-OD1 3.52Å; K202-D259 HydrophobicContact CB-CB 3.98Å; K202-D259 HydrophobicContact CD-CB 4.3Å; K202-D259 HydrophobicContact CG-CB 4Å; K256-D259 PolarHBondContact O-N 3.39Å; K256-D259 VanDerWaalsContact O-N 3.11Å; V257-D259 PolarHBondContact O-N 3.46Å
260	Y	94.6	Very high	91.2	Very high	3 Å²	3	33.4 Å²	33.4	1%	0.012	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-102.3	3.6	178.1	-61.1	-90.4	0	0	0	113	H118 N128 I130 K202 T255 K256 V257 E258 K262 W263 I264	H118-Y260 AromaticContact CD2-CD1 3.65Å; H118-Y260 AromaticContact CD2-CE1 3.68Å; H118-Y260 AromaticContact NE2-CD1 3.85Å; H118-Y260 AromaticContact NE2-CE1 3.74Å; N128-Y260 VanDerWaalsContact CA-OH 3.31Å; N128-Y260 WeakPolarHBondContact CA-OH 3.43Å; N128-Y260 HydrophobicContact CB-CE1 4.2Å; N128-Y260 PolarHBondContact OD1-OH 3Å; I130-Y260 HydrophobicContact CD1-CD1 4.29Å; I130-Y260 HydrophobicContact CD1-CD2 4.05Å; I130-Y260 HydrophobicContact CD1-CG 3.74Å; I130-Y260 HydrophobicContact CG2-CD1 3.71Å; I130-Y260 HydrophobicContact CG2-CE1 3.82Å; I130-Y260 HydrophobicContact CG2-CG 4.22Å; K202-Y260 HydrophobicContact CB-CE2 3.66Å; K202-Y260 WeakPolarHBondContact CB-OH 3.34Å; K202-Y260 HydrophobicContact CD-CE1 3.83Å; K202-Y260 HydrophobicContact CD-CE2 3.9Å; K202-Y260 VanDerWaalsContact CD-CZ 3.44Å; K202-Y260 WeakPolarHBondContact CD-OH 3.49Å; K202-Y260 HydrophobicContact CG-CE2 4.45Å; T255-Y260 HydrophobicContact CG2-CD2 3.84Å; T255-Y260 HydrophobicContact CG2-CE2 3.26Å; K256-Y260 VanDerWaalsContact O-CD2 3.27Å; K256-Y260 WeakPolarHBondContact O-CD2 3.28Å; V257-Y260 CarbonylContact O-C 3.48Å; V257-Y260 PolarHBondContact O-N 3.1Å; E258-Y260 PolarHBondContact O-N 2.91Å; Y260-K262 PolarHBondContact O-N 3.49Å; Y260-K262 VanDerWaalsContact O-N 3.11Å; Y260-W263 WeakPolarHBondContact O-CA 3.38Å; Y260-W263 WeakPolarHBondContact O-CB 3.33Å; Y260-W263 PolarHBondContact O-N 3.04Å; Y260-I264 WeakPolarHBondContact O-CG1 3.09Å; Y260-I264 PolarHBondContact O-N 2.91Å
261	S	92.8	Very high	91.5	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-53.1	-41.2	-175	81.5	0	0	0	0	113.1	L151 G152 R153 V257 E258 T265	L151-S261 VanDerWaalsContact O-CB 3.31Å; L151-S261 WeakPolarHBondContact O-CB 3.36Å; G152-S261 WeakPolarHBondContact CA-OG 3.44Å; R153-S261 PolarHBondContact N-OG 3.15Å; V257-S261 PolarHBondContact O-N 3.31Å; E258-S261 WeakPolarHBondContact O-CB 3.46Å; E258-S261 PolarHBondContact O-N 2.9Å; E258-S261 PolarHBondContact O-OG 3.29Å; S261-T265 VanDerWaalsContact O-CB 3.3Å; S261-T265 WeakPolarHBondContact O-CB 3.34Å; S261-T265 PolarHBondContact O-N 3.46Å; S261-T265 VanDerWaalsContact O-N 3.07Å; S261-T265 PolarHBondContact O-OG1 2.6Å
262	K	92.1	Very high	91	Very high	126 Å²	126	33.3 Å²	33.3	55%	0.548	16%	0.163	S	C	.	.	H	α-helix	trans	-67.5	-40	176.6	-67.8	-177.8	-176.9	174.5	0	112.3	Y260 S266	Y260-K262 PolarHBondContact O-N 3.49Å; Y260-K262 VanDerWaalsContact O-N 3.11Å; K262-S266 VanDerWaalsContact O-CB 3.23Å; K262-S266 WeakPolarHBondContact O-CB 3.48Å; K262-S266 PolarHBondContact O-N 3.45Å
263	W	95	Very high	89.9	Confident	30 Å²	30	36 Å²	36	11%	0.114	18%	0.18	C	C	.	.	H	α-helix	trans	-65.6	-50.2	178.3	176.5	90.8	0	0	0	110.3	I116 H118 E119 I130 L132 Y260 T265 S266 K267	I116-W263 HydrophobicContact CG2-CH2 4.49Å; I116-W263 HydrophobicContact CG2-CZ2 4.09Å; H118-W263 VanDerWaalsContact CA-CZ2 3.46Å; H118-W263 HydrophobicContact CB-CH2 4.44Å; H118-W263 HydrophobicContact CB-CZ2 3.88Å; H118-W263 AromaticContact CD2-CD1 3.55Å; H118-W263 AromaticContact CD2-CD2 3.71Å; H118-W263 AromaticContact CD2-CE2 3.6Å; H118-W263 AromaticContact CD2-CG 3.73Å; H118-W263 AromaticContact CD2-NE1 3.44Å; H118-W263 PolarHBondContact CD2-NE1 3.36Å; H118-W263 AromaticContact CG-NE1 3.9Å; H118-W263 AromaticContact NE2-CD1 3.75Å; E119-W263 PolarHBondContact OE2-NE1 3.19Å; I130-W263 HydrophobicContact CD1-CZ3 4.37Å; I130-W263 HydrophobicContact CG1-CZ3 4.24Å; I130-W263 HydrophobicContact CG2-CE3 4.33Å; I130-W263 HydrophobicContact CG2-CH2 4.37Å; I130-W263 HydrophobicContact CG2-CZ3 4.07Å; L132-W263 HydrophobicContact CB-CH2 4.15Å; L132-W263 HydrophobicContact CB-CZ3 4.25Å; Y260-W263 WeakPolarHBondContact O-CA 3.38Å; Y260-W263 WeakPolarHBondContact O-CB 3.33Å; Y260-W263 PolarHBondContact O-N 3.04Å; W263-T265 VanDerWaalsContact C-N 3.34Å; W263-T265 PolarHBondContact O-N 2.99Å; W263-S266 PolarHBondContact O-N 3Å; W263-K267 HydrophobicContact CD2-CG 3.99Å; W263-K267 HydrophobicContact CG-CG 4.3Å; W263-K267 HydrophobicContact CZ2-CG 3.92Å; W263-K267 WeakPolarHBondContact O-CB 3.41Å; W263-K267 VanDerWaalsContact O-CG 3.28Å; W263-K267 WeakPolarHBondContact O-CG 3.41Å; W263-K267 PolarHBondContact O-N 2.83Å
264	I	94.8	Very high	87.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-52.5	-53.7	176.6	-64.9	170	0	0	0	110.1	L73 L79 I130 L132 F150 V257 Y260 K267 A268 L278	L73-I264 HydrophobicContact CD1-CG2 3.71Å; L79-I264 HydrophobicContact CD1-CD1 3.95Å; L79-I264 HydrophobicContact CD1-CG1 4.03Å; L79-I264 HydrophobicContact CD2-CD1 3.98Å; I130-I264 HydrophobicContact CD1-CD1 4.27Å; I130-I264 HydrophobicContact CD1-CG1 4.43Å; L132-I264 HydrophobicContact CD1-CG2 4.3Å; F150-I264 HydrophobicContact CZ-CG2 4.12Å; V257-I264 HydrophobicContact CG1-CD1 3.88Å; Y260-I264 WeakPolarHBondContact O-CG1 3.09Å; Y260-I264 PolarHBondContact O-N 2.91Å; I264-K267 PolarHBondContact O-N 2.78Å; I264-A268 WeakPolarHBondContact O-CB 3.41Å; I264-A268 PolarHBondContact O-N 3.35Å; I264-L278 HydrophobicContact CG2-CD1 4.25Å
265	T	91.3	Very high	86	Confident	25 Å²	25	42.1 Å²	42.1	15%	0.153	22%	0.219	C	C	.	.	H	α-helix	trans	-56.5	-53.7	179.3	-59.1	0	0	0	0	111	S261 W263 K267 A268 E269 L275	S261-T265 VanDerWaalsContact O-CB 3.3Å; S261-T265 WeakPolarHBondContact O-CB 3.34Å; S261-T265 PolarHBondContact O-N 3.46Å; S261-T265 VanDerWaalsContact O-N 3.07Å; S261-T265 PolarHBondContact O-OG1 2.6Å; W263-T265 VanDerWaalsContact C-N 3.34Å; W263-T265 PolarHBondContact O-N 2.99Å; T265-K267 VanDerWaalsContact C-N 3.34Å; T265-K267 PolarHBondContact O-N 3.02Å; T265-A268 PolarHBondContact O-N 3.2Å; T265-E269 WeakPolarHBondContact O-CG 3.2Å; T265-E269 PolarHBondContact O-N 3Å; T265-L275 HydrophobicContact CG2-CD1 3.17Å
266	S	92.4	Very high	83.9	Confident	37 Å²	37	46.5 Å²	46.5	26%	0.259	25%	0.249	S	C	.	.	H	α-helix	trans	-67.2	-31.7	-175.7	-174	0	0	0	0	113.8	K262 W263 R270	K262-S266 VanDerWaalsContact O-CB 3.23Å; K262-S266 WeakPolarHBondContact O-CB 3.48Å; K262-S266 PolarHBondContact O-N 3.45Å; W263-S266 PolarHBondContact O-N 3Å; S266-R270 WeakPolarHBondContact O-CG 3.33Å; S266-R270 PolarHBondContact O-N 2.9Å; S266-R270 PolarHBondContact O-NE 2.94Å; S266-R270 PolarHBondContact OG-NE 2.92Å; S266-R270 PolarHBondContact OG-NH2 3.48Å
267	K	94.6	Very high	81.6	Confident	33 Å²	33	45 Å²	45	14%	0.143	25%	0.245	C	C	.	.	H	α-helix	trans	-73.6	-44.7	176.3	-71.4	-56.8	-168.9	164.9	0	111.7	I116 E119 L132 W263 I264 T265 E269 R270 A271	I116-K267 HydrophobicContact CD1-CB 4.26Å; I116-K267 HydrophobicContact CG2-CB 4.25Å; I116-K267 HydrophobicContact CG2-CD 3.86Å; I116-K267 HydrophobicContact CG2-CG 4.01Å; E119-K267 VanDerWaalsContact CD-CE 3.46Å; E119-K267 WeakPolarHBondContact OE1-CE 3.47Å; E119-K267 IonicContact OE1-NZ 2.6Å; E119-K267 PolarHBondContact OE1-NZ 2.97Å; E119-K267 WeakPolarHBondContact OE2-CE 3.48Å; E119-K267 IonicContact OE2-NZ 3.56Å; L132-K267 HydrophobicContact CD2-CB 4.25Å; W263-K267 HydrophobicContact CD2-CG 3.99Å; W263-K267 HydrophobicContact CG-CG 4.3Å; W263-K267 HydrophobicContact CZ2-CG 3.92Å; W263-K267 WeakPolarHBondContact O-CB 3.41Å; W263-K267 VanDerWaalsContact O-CG 3.28Å; W263-K267 WeakPolarHBondContact O-CG 3.41Å; W263-K267 PolarHBondContact O-N 2.83Å; I264-K267 PolarHBondContact O-N 2.78Å; T265-K267 VanDerWaalsContact C-N 3.34Å; T265-K267 PolarHBondContact O-N 3.02Å; K267-E269 PolarHBondContact O-N 2.94Å; K267-R270 PolarHBondContact O-N 3.22Å; K267-A271 WeakPolarHBondContact O-CB 3.26Å; K267-A271 PolarHBondContact O-N 3.08Å
268	A	90.9	Very high	79.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.1	-44.8	176.6	0	0	0	0	0	112	W77 L132 I264 T265 R270 A271 G272 L275 L278	W77-A268 HydrophobicContact CD2-CB 4.23Å; W77-A268 HydrophobicContact CZ2-CB 3.99Å; W77-A268 WeakPolarHBondContact CZ2-O 3.3Å; L132-A268 HydrophobicContact CD2-CB 4.02Å; I264-A268 WeakPolarHBondContact O-CB 3.41Å; I264-A268 PolarHBondContact O-N 3.35Å; T265-A268 PolarHBondContact O-N 3.2Å; A268-R270 VanDerWaalsContact C-N 3.31Å; A268-R270 PolarHBondContact O-N 2.82Å; A268-A271 PolarHBondContact O-N 3.22Å; A268-G272 PolarHBondContact O-N 2.85Å; A268-G272 VanDerWaalsContact O-N 3.16Å; A268-L275 HydrophobicContact CB-CD2 3.68Å; A268-L278 HydrophobicContact CB-CD1 4.03Å
269	E	88	Confident	77.6	Confident	106 Å²	106	46.5 Å²	46.5	50%	0.495	25%	0.252	S	S	.	.	H	α-helix	trans	-59.7	-37.4	177	-75.8	172.8	168.2	0	0	113.5	T265 K267 L275	T265-E269 WeakPolarHBondContact O-CG 3.2Å; T265-E269 PolarHBondContact O-N 3Å; K267-E269 PolarHBondContact O-N 2.94Å; E269-L275 HydrophobicContact CG-CD1 3.5Å; E269-L275 VanDerWaalsContact CG-CD1 3.5Å; E269-L275 HydrophobicContact CG-CD2 4.39Å; E269-L275 HydrophobicContact CG-CG 3.55Å; E269-L275 WeakPolarHBondContact OE1-CD1 3.26Å
270	R	88.3	Confident	75.5	Confident	176 Å²	176	47.1 Å²	47.1	66%	0.664	25%	0.253	S	S	*	.	H	α-helix	trans	-78.2	-28.7	-177.5	-78.3	-173.4	-98.9	-179.6	-9.4	113.5	S266 K267 A268	S266-R270 WeakPolarHBondContact O-CG 3.33Å; S266-R270 PolarHBondContact O-N 2.9Å; S266-R270 PolarHBondContact O-NE 2.94Å; S266-R270 PolarHBondContact OG-NE 2.92Å; S266-R270 PolarHBondContact OG-NH2 3.48Å; K267-R270 PolarHBondContact O-N 3.22Å; A268-R270 VanDerWaalsContact C-N 3.31Å; A268-R270 PolarHBondContact O-N 2.82Å
271	A	86.4	Confident	73.5	Confident	36 Å²	36	48.4 Å²	48.4	30%	0.298	26%	0.258	S	S	.	.	H	α-helix	trans	-108.5	-4	-169.1	0	0	0	0	0	114.7	W77 I116 K134 K267 A268	W77-A271 HydrophobicContact CH2-CB 3.83Å; W77-A271 HydrophobicContact CZ2-CB 4.38Å; I116-A271 HydrophobicContact CD1-CB 3.68Å; K134-A271 PolarHBondContact NZ-O 2.92Å; K267-A271 WeakPolarHBondContact O-CB 3.26Å; K267-A271 PolarHBondContact O-N 3.08Å; A268-A271 PolarHBondContact O-N 3.22Å
272	G	75.7	Confident	71.6	Confident	21 Å²	21	51.7 Å²	51.7	22%	0.216	27%	0.273	C	S	.	.	S	Bend	trans	-166.1	-173.5	-176.7	0	0	0	0	0	114.7	A268	A268-G272 PolarHBondContact O-N 2.85Å; A268-G272 VanDerWaalsContact O-N 3.16Å
273	P	63.6	Low	69.5	Low	61 Å²	61	53.1 Å²	53.1	40%	0.396	28%	0.28	S	S	.	.	S	Bend	trans	-56.1	144.1	-179.2	20.4	-29.8	0	0	0	111.8	F76	F76-P273 HydrophobicContact CD2-CG 4.02Å; F76-P273 HydrophobicContact CE2-CG 4.07Å
274	P	48.6	Very low	67.4	Low	100 Å²	100	55.2 Å²	55.2	65%	0.649	29%	0.292	S	S	*	.			trans	-68.3	157.1	-169.9	26.2	-33.3	0	0	0	113.6	S276	P274-S276 VanDerWaalsContact C-N 3.26Å; P274-S276 PolarHBondContact O-N 2.88Å
275	L	52.1	Low	65.2	Low	31 Å²	31	57.6 Å²	57.6	16%	0.162	31%	0.305	C	S	.	.	S	Bend	trans	-69.1	39.1	-167	-56.8	-173.5	0	0	0	117.7	T265 A268 E269 S277 L278	T265-L275 HydrophobicContact CG2-CD1 3.17Å; A268-L275 HydrophobicContact CB-CD2 3.68Å; E269-L275 HydrophobicContact CG-CD1 3.5Å; E269-L275 VanDerWaalsContact CG-CD1 3.5Å; E269-L275 HydrophobicContact CG-CD2 4.39Å; E269-L275 HydrophobicContact CG-CG 3.55Å; E269-L275 WeakPolarHBondContact OE1-CD1 3.26Å; L275-S277 PolarHBondContact O-N 2.02Å; L275-S277 VanDerWaalsContact O-N 3.14Å; L275-L278 HydrophobicContact CB-CB 4.3Å; L275-L278 HydrophobicContact CD1-CD1 4.19Å; L275-L278 HydrophobicContact CD2-CB 3.99Å; L275-L278 HydrophobicContact CD2-CD1 3.26Å; L275-L278 HydrophobicContact CD2-CG 3.55Å; L275-L278 HydrophobicContact CG-CD1 4.3Å
276	S	48.6	Very low	62.7	Low	93 Å²	93	60.3 Å²	60.3	65%	0.65	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-9.6	163.3	46.9	0	0	0	0	112.6	P274 H279	P274-S276 VanDerWaalsContact C-N 3.26Å; P274-S276 PolarHBondContact O-N 2.88Å; S276-H279 PolarHBondContact O-CE1 2.85Å
277	S	45.6	Very low	60.1	Low	14 Å²	14	67.2 Å²	67.2	10%	0.098	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114	-2.7	-177.1	55.1	0	0	0	0	115.9	S74 E75 L275	S74-S277 WeakPolarHBondContact CB-OG 2.89Å; E75-S277 WeakPolarHBondContact OE2-CB 3.05Å; L275-S277 PolarHBondContact O-N 2.02Å; L275-S277 VanDerWaalsContact O-N 3.14Å
278	L	48.9	Very low	57.3	Low	11 Å²	11	70.4 Å²	70.4	6%	0.058	38%	0.377	C	S	.	.	S	Bend	trans	-100.9	88.3	169.5	-66.8	-171.9	0	0	0	109.5	L73 F150 I264 A268 L275 H280	L73-L278 HydrophobicContact CB-CD2 3.63Å; L73-L278 WeakPolarHBondContact O-CD2 3.46Å; F150-L278 HydrophobicContact CE1-CB 4.36Å; F150-L278 HydrophobicContact CE1-CD2 4.14Å; F150-L278 HydrophobicContact CZ-CD1 4.44Å; I264-L278 HydrophobicContact CG2-CD1 4.25Å; A268-L278 HydrophobicContact CB-CD1 4.03Å; L275-L278 HydrophobicContact CB-CB 4.3Å; L275-L278 HydrophobicContact CD1-CD1 4.19Å; L275-L278 HydrophobicContact CD2-CB 3.99Å; L275-L278 HydrophobicContact CD2-CD1 3.26Å; L275-L278 HydrophobicContact CD2-CG 3.55Å; L275-L278 HydrophobicContact CG-CD1 4.3Å; L278-H280 PolarHBondContact O-N 2.89Å
279	H	53.1	Low	54.6	Low	34 Å²	34	80.3 Å²	80.3	16%	0.157	41%	0.414	C	S	.	.			trans	-76.3	109.5	-175.5	-65.2	-72.9	0	0	0	111	T28 C30 S276 W281	T28-H279 PolarHBondContact O-CD2 2.96Å; T28-H279 PolarHBondContact O-NE2 2.89Å; T28-H279 PolarHBondContact OG1-NE2 2.88Å; C30-H279 HydrophobicContact CB-CB 4.45Å; C30-H279 VanDerWaalsContact SG-CB 3.54Å; S276-H279 PolarHBondContact O-CE1 2.85Å; H279-W281 PolarHBondContact O-N 3.04Å
280	H	48.8	Very low	52	Low	49 Å²	49	83.5 Å²	83.5	23%	0.227	43%	0.429	C	S	.	.	B	Isolated β-bridge	trans	-68.3	123	155.1	-80.7	64.8	0	0	0	107.6	L278 E282 K283	L278-H280 PolarHBondContact O-N 2.89Å; H280-E282 PolarHBondContact O-N 3.29Å; H280-K283 PolarHBondContact O-N 3.14Å
281	W	52.8	Low	49.1	Very low	30 Å²	30	77.7 Å²	77.7	11%	0.114	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-27.2	176.2	70.4	-83.3	0	0	0	113.4	L151 L155 P159 L229 F232 H279 K283 L284 I285	L151-W281 HydrophobicContact CD2-CG 4.34Å; L155-W281 HydrophobicContact CD1-CZ2 3.6Å; L155-W281 VanDerWaalsContact CD1-NE1 3.31Å; L155-W281 HydrophobicContact CD2-CH2 4.09Å; L155-W281 HydrophobicContact CD2-CZ2 3.09Å; L155-W281 HydrophobicContact CG-CZ2 3.86Å; P159-W281 HydrophobicContact CG-CZ2 4.24Å; L229-W281 HydrophobicContact CD1-CB 4.44Å; F232-W281 HydrophobicContact CE2-CZ3 4.49Å; H279-W281 PolarHBondContact O-N 3.04Å; W281-K283 PolarHBondContact O-N 3.36Å; W281-L284 WeakPolarHBondContact O-CB 3.44Å; W281-L284 PolarHBondContact O-N 2.99Å; W281-I285 HydrophobicContact CE3-CD1 3.41Å; W281-I285 VanDerWaalsContact CE3-CD1 3.41Å; W281-I285 HydrophobicContact CE3-CG1 4.22Å; W281-I285 HydrophobicContact CH2-CD1 4.22Å; W281-I285 HydrophobicContact CZ3-CD1 3.09Å; W281-I285 HydrophobicContact CZ3-CG1 4.31Å
282	E	51.7	Low	46.6	Very low	73 Å²	73	82.3 Å²	82.3	34%	0.341	45%	0.451	S	S	.	.	H	α-helix	trans	-55.2	-32.7	176.5	-63.7	173.3	-157.7	0	0	113.6	L155 H280 L284 I285 S286	L155-E282 HydrophobicContact CD2-CG 3.8Å; L155-E282 WeakPolarHBondContact CD2-OE1 2.81Å; H280-E282 PolarHBondContact O-N 3.29Å; E282-L284 VanDerWaalsContact C-N 3.32Å; E282-L284 PolarHBondContact O-N 3.35Å; E282-I285 PolarHBondContact O-N 3.32Å; E282-S286 PolarHBondContact O-OG 2.87Å
283	K	48.7	Very low	44.6	Very low	156 Å²	156	89.1 Å²	89.1	68%	0.678	48%	0.482	S	S	*	.	H	α-helix	trans	-72.9	-23.3	177.5	-76.1	-174	179.1	177.3	0	113.1	H280 W281	H280-K283 PolarHBondContact O-N 3.14Å; W281-K283 PolarHBondContact O-N 3.36Å
284	L	51.2	Low	43	Very low	73 Å²	73	91.2 Å²	91.2	38%	0.382	51%	0.505	S	S	.	.	H	α-helix	trans	-75.6	-27.9	178.1	-64.8	168.6	0	0	0	111.9	L234 W281 E282	L234-L284 HydrophobicContact CD1-CD1 3.87Å; W281-L284 WeakPolarHBondContact O-CB 3.44Å; W281-L284 PolarHBondContact O-N 2.99Å; E282-L284 VanDerWaalsContact C-N 3.32Å; E282-L284 PolarHBondContact O-N 3.35Å
285	I	48.3	Very low	42	Very low	50 Å²	50	90.6 Å²	90.6	26%	0.256	51%	0.508	S	S	.	.	H	α-helix	trans	-77.6	-32.1	179.2	-64.2	-175.2	0	0	0	112.5	F232 W281 E282 F287 S288	F232-I285 HydrophobicContact CE1-CG1 4.27Å; F232-I285 HydrophobicContact CE2-CD1 3.73Å; F232-I285 HydrophobicContact CE2-CG1 4.24Å; F232-I285 HydrophobicContact CZ-CD1 3.55Å; F232-I285 HydrophobicContact CZ-CG1 3.71Å; W281-I285 HydrophobicContact CE3-CD1 3.41Å; W281-I285 VanDerWaalsContact CE3-CD1 3.41Å; W281-I285 HydrophobicContact CE3-CG1 4.22Å; W281-I285 HydrophobicContact CH2-CD1 4.22Å; W281-I285 HydrophobicContact CZ3-CD1 3.09Å; W281-I285 HydrophobicContact CZ3-CG1 4.31Å; E282-I285 PolarHBondContact O-N 3.32Å; I285-F287 PolarHBondContact O-N 2.95Å; I285-S288 PolarHBondContact O-N 3.41Å; I285-S288 VanDerWaalsContact O-N 3.1Å
286	S	38.8	Very low	40.7	Very low	83 Å²	83	97.9 Å²	97.9	58%	0.58	54%	0.543	S	S	*	.	H	α-helix	trans	-61.6	-26.7	-179.7	-60.4	0	0	0	0	112.3	E282	E282-S286 PolarHBondContact O-OG 2.87Å
287	F	37.2	Very low	39.6	Very low	182 Å²	182	99.5 Å²	99.5	80%	0.798	55%	0.55	S	S	*	.	H	α-helix	trans	-79.1	-24.8	176.5	-89.9	-86.2	0	0	0	114.3	I285	I285-F287 PolarHBondContact O-N 2.95Å
288	S	36.4	Very low	38.9	Very low	99 Å²	99	107.5 Å²	107.5	69%	0.692	59%	0.586	S	S	*	*	H	α-helix	trans	-76	-22.9	-177.7	175.4	0	0	0	0	113.3	I285 H290	I285-S288 PolarHBondContact O-N 3.41Å; I285-S288 VanDerWaalsContact O-N 3.1Å; S288-H290 VanDerWaalsContact C-N 3.32Å; S288-H290 PolarHBondContact O-N 3.17Å
289	R	34.8	Very low	37.8	Very low	208 Å²	208	114.4 Å²	114.4	79%	0.785	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-2	-179.7	-77.2	-174.6	175.5	178.5	-0.6	115.1
290	H	32.8	Very low	36.5	Very low	173 Å²	173	117.5 Å²	117.5	80%	0.801	65%	0.648	S	S	*	*			trans	-122.3	59.4	177.7	-70.1	-15.6	0	0	0	111.4	S288	S288-H290 VanDerWaalsContact C-N 3.32Å; S288-H290 PolarHBondContact O-N 3.17Å
291	G	27.3	Very low	35.4	Very low	54 Å²	54	122.9 Å²	122.9	56%	0.557	68%	0.678	S	S	*	*			trans	-77	149	155.8	0	0	0	0	0	110.4	N293	G291-N293 PolarHBondContact O-N 3.15Å
292	P	34	Very low	34	Very low	133 Å²	133	126.6 Å²	126.6	86%	0.864	71%	0.709	S	S	*	*			trans	-66.2	133.5	-169.3	26.5	-32.6	0	0	0	111.8	A294	P292-A294 PolarHBondContact O-N 2.94Å; P292-A294 VanDerWaalsContact O-N 3.16Å
293	N	33.7	Very low	32.8	Very low	165 Å²	165	132.7 Å²	132.7	88%	0.882	74%	0.737	S	S	*	*			trans	-48.5	114.4	174.6	-66.1	-38.9	0	0	0	111.8	G291	G291-N293 PolarHBondContact O-N 3.15Å
294	A	29.5	Very low	31.6	Very low	105 Å²	105	133.7 Å²	133.7	87%	0.868	75%	0.749	S	S	*	*			trans	-94.5	107.1	154.1	0	0	0	0	0	107.5	P292	P292-A294 PolarHBondContact O-N 2.94Å; P292-A294 VanDerWaalsContact O-N 3.16Å
295	A	27.1	Very low	30.3	Very low	87 Å²	87	133.5 Å²	133.5	72%	0.719	77%	0.765	S	S	*	*			trans	-79.4	148.4	176.9	0	0	0	0	0	111.8
296	M	24.7	Very low	29.2	Very low	183 Å²	183	139.9 Å²	139.9	90%	0.901	79%	0.793	S	S	*	*			trans	65.7	136.8	159.9	-87.7	170.2	163.4	0	0	116.6
297	T	26.2	Very low	28.5	Very low	128 Å²	128	142.2 Å²	142.2	79%	0.785	80%	0.804	S	S	*	*			cis	-146.7	143.1	43.3	30.4	0	0	0	0	112.8
298	Q	30.1	Very low	27.9	Very low	182 Å²	182	137.3 Å²	137.3	85%	0.85	80%	0.804	S	S	*	*			trans	-62.3	138.3	159.7	-69.4	-172.9	-19	0	0	109.7
299	N	26.1	Very low	27.3	Very low	156 Å²	156	137.3 Å²	137.3	83%	0.834	80%	0.804	S	S	*	*			trans	-132.7	111	147.6	-96.2	-5.1	0	0	0	107.8
300	S	25.8	Very low	26.7	Very low	98 Å²	98	138.4 Å²	138.4	69%	0.685	81%	0.81	S	S	*	*			trans	-68.5	125.7	158.3	47.7	0	0	0	0	108.7
301	D	25.6	Very low	26.4	Very low	163 Å²	163	137.1 Å²	137.1	87%	0.872	81%	0.808	S	S	*	*			trans	-141.3	128.4	147.8	-90.8	-35.7	0	0	0	109
302	S	24.4	Very low	26.3	Very low	108 Å²	108	142.9 Å²	142.9	76%	0.755	82%	0.821	S	S	*	*			trans	-103.2	131.6	-179.8	-48.7	0	0	0	0	106.7
303	E	25.3	Very low	25.9	Very low	201 Å²	201	139.8 Å²	139.8	94%	0.939	81%	0.812	S	S	*	*			trans	-152.2	145	153.9	-117.2	178.6	-174.5	0	0	112.3
304	L	25.1	Very low	25.4	Very low	176 Å²	176	141.5 Å²	141.5	92%	0.921	82%	0.815	S	S	*	*			trans	-94	159.5	-160.2	-113.2	87.6	0	0	0	113.6
305	G	23.5	Very low	25.1	Very low	69 Å²	69	140 Å²	140	71%	0.711	81%	0.809	S	S	*	*			trans	104.1	137.2	152.4	0	0	0	0	0	114.1
306	H	25.3	Very low	25	Very low	185 Å²	185	147.8 Å²	147.8	86%	0.856	82%	0.82	S	S	*	*			cis	-160.7	142.9	19.1	-117.3	-42.1	0	0	0	110.4
307	V	23.8	Very low	24.9	Very low	132 Å²	132	144.8 Å²	144.8	80%	0.8	81%	0.813	S	S	*	*			trans	-2.1	137.1	149.4	-176.3	0	0	0	0	119.3
308	G	24.9	Very low	24.8	Very low	78 Å²	78	145.8 Å²	145.8	80%	0.804	81%	0.811	S	S	*	*			trans	-179	78	157.6	0	0	0	0	0	114
309	S	23.2	Very low	24.4	Very low	99 Å²	99	142.6 Å²	142.6	69%	0.692	81%	0.805	S	S	*	*			trans	-81.7	139.6	169.4	55	0	0	0	0	111.5
310	Y	23.1	Very low	24.4	Very low	231 Å²	231	143.7 Å²	143.7	91%	0.906	80%	0.804	S	S	*	*			trans	-150.1	131.7	145.4	-101.1	-79.3	0	0	0	112.9
311	L	25.9	Very low	24.3	Very low	147 Å²	147	143.8 Å²	143.8	77%	0.77	81%	0.805	S	S	*	*			trans	-49	171.8	166.1	-67.8	152	0	0	0	112.8
312	Q	25.1	Very low	24.2	Very low	175 Å²	175	148.2 Å²	148.2	82%	0.818	81%	0.809	S	S	*	*			cis	171.6	155.4	-5.4	170	173	7.1	0	0	105.2
313	G	24.6	Very low	24.2	Very low	67 Å²	67	151.1 Å²	151.1	69%	0.691	82%	0.816	S	S	*	*			trans	126.1	106.5	156.1	0	0	0	0	0	114.4
314	Q	24.6	Very low	24.1	Very low	202 Å²	202	145.2 Å²	145.2	94%	0.944	80%	0.801	S	S	*	*				99.1	104.5	74.9	-113.9	179.6	-10.3	0	0	113.5
315	G	22.9	Very low	24.1	Very low	72 Å²	72	143 Å²	143	74%	0.742	80%	0.795	S	S	*	*				61	125.6	129.3	0	0	0	0	0	121.8
316	R	24.3	Very low	24.1	Very low	251 Å²	251	145.3 Å²	145.3	95%	0.947	80%	0.8	S	S	*	*				173.9	139.2	102.2	-101.6	175.9	154.7	164.6	-6.4	113.9
317	T	22.2	Very low	24.1	Very low	121 Å²	121	141.6 Å²	141.6	74%	0.742	80%	0.795	S	S	*	*			trans	-64.1	141	164	-40.3	0	0	0	0	112.4
318	I	25.8	Very low	24.3	Very low	148 Å²	148	146.7 Å²	146.7	76%	0.759	80%	0.8	S	S	*	*			trans	-141.1	122.1	149	-60.5	-175.9	0	0	0	109.8
319	T	21.3	Very low	24.3	Very low	115 Å²	115	151 Å²	151	71%	0.706	81%	0.805	S	S	*	*			trans	-90	138.9	166.1	-43.3	0	0	0	0	108.4
320	H	26.3	Very low	24.4	Very low	179 Å²	179	153.4 Å²	153.4	83%	0.829	81%	0.81	S	S	*	*			trans	-136	112	157	-93.1	-71.9	0	0	0	110.9
321	S	22.9	Very low	24.7	Very low	100 Å²	100	151 Å²	151	70%	0.699	81%	0.812	S	S	*	*			trans	-69	147.8	159.1	52.6	0	0	0	0	111.7
322	R	24.3	Very low	24.6	Very low	256 Å²	256	150.4 Å²	150.4	97%	0.966	81%	0.809	S	S	*	*			trans	-162.4	136.4	131.2	-110.1	175.3	-171.1	-168.7	2.4	112.7
323	L	22.8	Very low	24.7	Very low	170 Å²	170	148.8 Å²	148.8	89%	0.89	81%	0.811	S	S	*	*			trans	-90.7	153.6	176.1	-140.8	88.1	0	0	0	109.6
324	A	24.8	Very low	24.7	Very low	77 Å²	77	156 Å²	156	64%	0.636	82%	0.818	S	S	*	*				133.6	112.2	127.1	0	0	0	0	0	117.4
325	T	23.6	Very low	24.9	Very low	129 Å²	129	154.9 Å²	154.9	79%	0.791	81%	0.812	S	S	*	*				86.3	124.5	121.2	53.6	0	0	0	0	124.9
326	S	24	Very low	25	Very low	117 Å²	117	161.5 Å²	161.5	82%	0.818	82%	0.821	S	S	*	*			trans	71.3	140.4	143.5	79.9	0	0	0	0	118.1
327	S	25.1	Very low	25	Very low	107 Å²	107	152.7 Å²	152.7	75%	0.748	81%	0.808	S	S	*	*			cis	-152.2	137.1	37.5	49.4	0	0	0	0	111.2
328	R	27.7	Very low	25.1	Very low	239 Å²	239	153.6 Å²	153.6	90%	0.902	81%	0.813	S	S	*	*				43.2	113	103	-90.1	-175.8	171.6	168	-2.7	116
329	D	25.6	Very low	25.1	Very low	169 Å²	169	156 Å²	156	90%	0.904	82%	0.818	S	S	*	*				-157.4	131.5	119	-103.6	-17.8	0	0	0	111.9
330	D	25	Very low	25.5	Very low	150 Å²	150	159.7 Å²	159.7	80%	0.802	83%	0.827	S	S	*	*			trans	-73.7	154.4	173.1	-105.6	-37.2	0	0	0	110.7
331	L	29.3	Very low	25.3	Very low	181 Å²	181	157.3 Å²	157.3	95%	0.948	83%	0.831	S	S	*	*			trans	-164	117.9	132.8	-99.6	172.4	0	0	0	110.3
332	D	25	Very low	25.4	Very low	134 Å²	134	156.3 Å²	156.3	72%	0.717	84%	0.836	S	S	*	*			trans	-96.2	137.1	-178.1	178	15.6	0	0	0	110.4	R334	D332-R334 PolarHBondContact OD1-N 2.99Å
333	V	27.4	Very low	25.4	Very low	141 Å²	141	156 Å²	156	86%	0.855	84%	0.835	S	S	*	*			trans	-146.5	88.8	156	-174.9	0	0	0	0	111.1
334	R	24.6	Very low	25.5	Very low	218 Å²	218	153.2 Å²	153.2	82%	0.823	83%	0.83	S	S	*	*				45.1	113.2	119.8	-157	166.6	-170.5	160.7	3.3	121	D332	D332-R334 PolarHBondContact OD1-N 2.99Å
335	E	27.4	Very low	26	Very low	178 Å²	178	154.6 Å²	154.6	83%	0.832	83%	0.832	S	S	*	*			trans	-54.1	146.1	160.2	-164.7	178.5	-151.6	0	0	116.3
336	K	26.6	Very low	26.7	Very low	211 Å²	211	158 Å²	158	92%	0.917	84%	0.839	S	S	*	*			trans	-144.8	114.1	152.6	-89.4	-168	178.9	179.8	0	109.7
337	G	23.3	Very low	26.9	Very low	67 Å²	67	156.3 Å²	156.3	69%	0.691	83%	0.833	S	S	*	*			trans	-99.1	155.1	165.3	0	0	0	0	0	112.4
338	V	24.6	Very low	27	Very low	139 Å²	139	156.2 Å²	156.2	84%	0.842	83%	0.832	S	S	*	*			trans	-151.6	115.4	152.5	176.6	0	0	0	0	110.7
339	K	25.5	Very low	27	Very low	200 Å²	200	150.3 Å²	150.3	87%	0.87	82%	0.822	S	S	*	*			trans	41.9	138.3	141.5	-72.2	-178.2	172.4	-179.3	0	125.2
340	E	29	Very low	27.1	Very low	191 Å²	191	149.9 Å²	149.9	89%	0.893	81%	0.814	S	S	*	*			trans	-58.8	154.2	173.3	-61.4	166.6	127.5	0	0	117.2
341	S	23.4	Very low	27.5	Very low	130 Å²	130	144.9 Å²	144.9	91%	0.909	79%	0.79	S	S	*	*			trans	-173.5	132.8	133.6	176.1	0	0	0	0	111.7
342	G	23.6	Very low	27.5	Very low	78 Å²	78	142.7 Å²	142.7	80%	0.804	78%	0.779	S	S	*	*			trans	124.5	115.9	148.7	0	0	0	0	0	118
343	R	25.1	Very low	28.1	Very low	249 Å²	249	144.3 Å²	144.3	94%	0.94	78%	0.776	S	S	*	*			trans	-75.2	145.2	176.7	-94.7	177.2	172.1	173.6	-3.1	114.6
344	S	25.6	Very low	28.5	Very low	112 Å²	112	144.9 Å²	144.9	78%	0.783	76%	0.764	S	S	*	*			trans	79.3	152.7	143.8	-154.4	0	0	0	0	119.5
345	P	34.8	Very low	29	Very low	106 Å²	106	139.9 Å²	139.9	69%	0.688	75%	0.753	S	S	*	*			cis	-117.2	161.2	-7.1	35.7	-19.7	0	0	0	115	A347	P345-A347 PolarHBondContact O-N 3.14Å
346	E	39.1	Very low	29.6	Very low	201 Å²	201	138.6 Å²	138.6	94%	0.939	74%	0.742	S	S	*	*			trans	-7.9	90.6	148.7	-124.9	155.4	-173.6	0	0	115.2
347	A	27.1	Very low	30.6	Very low	82 Å²	82	134 Å²	134	68%	0.678	72%	0.72	S	S	*	*			trans	-91.4	112.5	166	0	0	0	0	0	107.5	P345 V349	P345-A347 PolarHBondContact O-N 3.14Å; A347-V349 PolarHBondContact O-N 3.15Å
348	S	27.7	Very low	30.9	Very low	104 Å²	104	134.1 Å²	134.1	73%	0.727	72%	0.721	S	S	*	*			trans	-49.9	105.6	164.3	51.5	0	0	0	0	109	Q350	S348-Q350 VanDerWaalsContact C-N 3.35Å; S348-Q350 PolarHBondContact O-N 2.82Å
349	V	27	Very low	31.2	Very low	115 Å²	115	130.4 Å²	130.4	70%	0.697	71%	0.71	S	S	*	*			trans	-70.5	97.2	172.8	179.9	0	0	0	0	106.4	N124 A347	N124-V349 PolarHBondContact OD1-O 3.22Å; A347-V349 PolarHBondContact O-N 3.15Å
350	Q	27.5	Very low	31.3	Very low	160 Å²	160	130.5 Å²	130.5	75%	0.748	71%	0.714	S	S	*	*			trans	-61.3	134.2	167.4	-66.7	-176.9	-16.8	0	0	107.7	S348 L352	S348-Q350 VanDerWaalsContact C-N 3.35Å; S348-Q350 PolarHBondContact O-N 2.82Å; Q350-L352 PolarHBondContact O-N 1.99Å
351	P	33.7	Very low	31.3	Very low	46 Å²	46	128.1 Å²	128.1	30%	0.299	71%	0.712	S	S	.	*			trans	-59.5	127.3	173.2	23.2	-30.9	0	0	0	108.8	N123 M126 Y353	N123-P351 VanDerWaalsContact ND2-CD 3.31Å; N123-P351 WeakPolarHBondContact ND2-CD 2.9Å; N123-P351 WeakPolarHBondContact ND2-CG 3.28Å; M126-P351 HydrophobicContact CE-CB 3.34Å; M126-P351 HydrophobicContact CE-CG 3.58Å; P351-Y353 VanDerWaalsContact C-N 3.31Å; P351-Y353 PolarHBondContact O-N 3.36Å
352	L	29.3	Very low	31.5	Very low	135 Å²	135	125.3 Å²	125.3	71%	0.707	70%	0.704	S	S	*	*			trans	-68.1	89.6	-177.2	-157.6	83.9	0	0	0	108.6	Q350 Y354	Q350-L352 PolarHBondContact O-N 1.99Å; L352-Y354 HydrophobicContact CD2-CD2 4.36Å; L352-Y354 HydrophobicContact CD2-CE1 4.33Å; L352-Y354 HydrophobicContact CD2-CE2 3.74Å; L352-Y354 PolarHBondContact O-N 3.15Å
353	Y	37.3	Very low	31.7	Very low	168 Å²	168	131 Å²	131	66%	0.659	71%	0.709	S	S	*	*			trans	-70.4	107.6	164.9	-177.2	-98	0	0	0	106.7	P351 D355	P351-Y353 VanDerWaalsContact C-N 3.31Å; P351-Y353 PolarHBondContact O-N 3.36Å; Y353-D355 PolarHBondContact O-N 3.28Å; Y353-D355 VanDerWaalsContact O-N 3.17Å
354	Y	35.3	Very low	31.7	Very low	153 Å²	153	122.7 Å²	122.7	60%	0.6	70%	0.701	S	S	*	*			trans	-63.4	118.7	171.9	-84.9	-86.4	0	0	0	108	L352 Y356	L352-Y354 HydrophobicContact CD2-CD2 4.36Å; L352-Y354 HydrophobicContact CD2-CE1 4.33Å; L352-Y354 HydrophobicContact CD2-CE2 3.74Å; L352-Y354 PolarHBondContact O-N 3.15Å; Y354-Y356 WeakPolarHBondContact O-CD2 3.47Å; Y354-Y356 PolarHBondContact O-N 3.48Å
355	D	35.4	Very low	31.7	Very low	112 Å²	112	128.6 Å²	128.6	60%	0.599	71%	0.706	S	S	*	*			trans	-69.8	90.2	163.8	-173.5	1.9	0	0	0	107.4	Y353 Y357	Y353-D355 PolarHBondContact O-N 3.28Å; Y353-D355 VanDerWaalsContact O-N 3.17Å; D355-Y357 PolarHBondContact O-N 3.34Å; D355-Y357 PolarHBondContact OD1-N 2.77Å; D355-Y357 VanDerWaalsContact OD1-N 3.15Å
356	Y	40.8	Very low	31.3	Very low	152 Å²	152	130.8 Å²	130.8	60%	0.596	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	1.5	178	-73.5	-85.9	0	0	0	112.8	Y354	Y354-Y356 WeakPolarHBondContact O-CD2 3.47Å; Y354-Y356 PolarHBondContact O-N 3.48Å
357	Y	46.9	Very low	30.8	Very low	115 Å²	115	126.8 Å²	126.8	45%	0.451	71%	0.705	S	S	.	*	T	Hydrogen-bonded Turn	trans	-132.1	20.9	-167.5	-52.6	-64.6	0	0	0	115.1	P171 D355 G359	P171-Y357 HydrophobicContact CB-CE1 4.3Å; P171-Y357 HydrophobicContact CG-CD1 4.3Å; P171-Y357 HydrophobicContact CG-CE1 3.32Å; P171-Y357 WeakPolarHBondContact CG-OH 3.21Å; D355-Y357 PolarHBondContact O-N 3.34Å; D355-Y357 PolarHBondContact OD1-N 2.77Å; D355-Y357 VanDerWaalsContact OD1-N 3.15Å; Y357-G359 VanDerWaalsContact C-N 3.34Å; Y357-G359 PolarHBondContact O-N 2.82Å
358	G	29.4	Very low	30.8	Very low	69 Å²	69	127.7 Å²	127.7	71%	0.711	71%	0.712	S	S	*	*			trans	-61.6	86.5	175.3	0	0	0	0	0	113.5
359	G	30.7	Very low	30.8	Very low	60 Å²	60	126.3 Å²	126.3	62%	0.619	72%	0.715	S	S	*	*			trans	-93.6	136	159.9	0	0	0	0	0	109.7	Y357 V361	Y357-G359 VanDerWaalsContact C-N 3.34Å; Y357-G359 PolarHBondContact O-N 2.82Å; G359-V361 PolarHBondContact O-N 3.24Å
360	E	29.3	Very low	30.8	Very low	202 Å²	202	128.6 Å²	128.6	94%	0.944	72%	0.718	S	S	*	*			trans	-52.7	126.5	-177.3	-65.8	-178.7	158	0	0	112.6	G362	E360-G362 PolarHBondContact O-N 3.4Å
361	V	28.6	Very low	30.7	Very low	141 Å²	141	130.6 Å²	130.6	86%	0.855	72%	0.724	S	S	*	*			trans	-77.9	102.2	175.7	177.6	0	0	0	0	109.1	G359	G359-V361 PolarHBondContact O-N 3.24Å
362	G	26.8	Very low	30.4	Very low	71 Å²	71	138.6 Å²	138.6	73%	0.732	75%	0.749	S	S	*	*			trans	-79.8	122.4	161	0	0	0	0	0	110.7	E360	E360-G362 PolarHBondContact O-N 3.4Å
363	E	28	Very low	30.2	Very low	197 Å²	197	140.3 Å²	140.3	92%	0.921	76%	0.758	S	S	*	*			trans	-47.8	139.1	176.2	-65.5	175.2	125.2	0	0	114
364	G	26.2	Very low	29.7	Very low	75 Å²	75	141.3 Å²	141.3	77%	0.773	77%	0.768	S	S	*	*			trans	172.4	58	172.6	0	0	0	0	0	119.6
365	R	24.9	Very low	29.3	Very low	236 Å²	236	142.8 Å²	142.8	89%	0.891	78%	0.78	S	S	*	*			trans	38.9	129.7	135.5	-115.6	-174.8	-167.8	178	4.9	122
366	I	25.6	Very low	28.9	Very low	152 Å²	152	143.2 Å²	143.2	78%	0.779	79%	0.789	S	S	*	*			trans	119.5	113.7	135.7	-61.9	160.8	0	0	0	116
367	S	29.4	Very low	28.4	Very low	117 Å²	117	140.9 Å²	140.9	82%	0.818	80%	0.801	S	S	*	*			trans	-57.7	143.4	168.5	-51	0	0	0	0	114
368	A	27	Very low	27.5	Very low	101 Å²	101	144.3 Å²	144.3	84%	0.835	82%	0.821	S	S	*	*			trans	-146.2	108.6	146.1	0	0	0	0	0	108.6
369	G	27.5	Very low	27.6	Very low	76 Å²	76	148.3 Å²	148.3	78%	0.784	83%	0.825	S	S	*	*			trans	-75.1	145.3	173.8	0	0	0	0	0	111.1
370	Q	26.7	Very low	27.7	Very low	163 Å²	163	152.6 Å²	152.6	76%	0.762	83%	0.832	S	S	*	*			trans	-139.4	99.1	164.3	-159.9	134.3	-30.2	0	0	110
371	K	26.2	Very low	27.7	Very low	202 Å²	202	149.9 Å²	149.9	88%	0.878	82%	0.823	S	S	*	*			trans	-67.1	126.8	162	-70.7	179.3	176.1	179.9	0	108.9
372	R	26.2	Very low	27.7	Very low	214 Å²	214	148.3 Å²	148.3	81%	0.808	81%	0.814	S	S	*	*			trans	-149.3	100.1	147.5	-70.1	-164	-173.2	-168.4	2.5	107.9
373	L	25.9	Very low	27.9	Very low	171 Å²	171	149.6 Å²	149.6	90%	0.895	81%	0.811	S	S	*	*				61.6	97.4	96.1	-100.5	134.5	0	0	0	113.2
374	H	27.3	Very low	28	Very low	188 Å²	188	149.1 Å²	149.1	87%	0.87	81%	0.806	S	S	*	*			trans	-55.3	139.9	161.7	-83.2	-74.6	0	0	0	111.8
375	Q	25.7	Very low	28.3	Very low	185 Å²	185	153.9 Å²	153.9	86%	0.864	81%	0.811	S	S	*	*			trans	-149.4	134.6	150.1	-145	164.4	1.1	0	0	109.9
376	P	27.8	Very low	28.6	Very low	120 Å²	120	149.5 Å²	149.5	78%	0.779	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-88.6	144.5	-169.9	34.9	-31.8	0	0	0	111.2
377	A	29.6	Very low	29	Very low	104 Å²	104	147.6 Å²	147.6	86%	0.86	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-101.2	131.2	169.3	0	0	0	0	0	109.8
378	E	29.5	Very low	29.2	Very low	186 Å²	186	150.3 Å²	150.3	87%	0.869	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-71.2	150.7	-166.4	-63	176.8	146	0	0	114.4
379	I	31.4	Very low	29.6	Very low	154 Å²	154	154.2 Å²	154.2	79%	0.79	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-82.9	121.9	174.7	-64.9	166	0	0	0	108.7
380	I	31.2	Very low	29.8	Very low	149 Å²	149	156.3 Å²	156.3	76%	0.764	80%	0.797	S	S	*	*			trans	-105.2	111.5	166.1	-61.5	179.4	0	0	0	108.6	V382	I380-V382 HydrophobicContact CG2-CG2 3.95Å
381	L	29.3	Very low	30.2	Very low	146 Å²	146	154 Å²	154	76%	0.764	80%	0.799	S	S	*	*			trans	-92.6	108.3	175.3	-148.3	102.8	0	0	0	108.6
382	V	30.2	Very low	30.6	Very low	108 Å²	108	150.1 Å²	150.1	66%	0.655	80%	0.797	S	S	*	*			trans	-102	111.7	172.3	-177.2	0	0	0	0	109	I380 F384	I380-V382 HydrophobicContact CG2-CG2 3.95Å; V382-F384 HydrophobicContact CG1-CD2 4.06Å; V382-F384 HydrophobicContact CG1-CE2 3.8Å
383	S	29.8	Very low	31.1	Very low	97 Å²	97	151.6 Å²	151.6	68%	0.678	82%	0.818	S	S	*	*			trans	-92.8	121.1	175	-53	0	0	0	0	109.2
384	F	30.6	Very low	31.4	Very low	187 Å²	187	150.6 Å²	150.6	82%	0.82	81%	0.814	S	S	*	*			trans	-97.1	110.7	171.5	-88.7	-81.9	0	0	0	110.5	V382	V382-F384 HydrophobicContact CG1-CD2 4.06Å; V382-F384 HydrophobicContact CG1-CE2 3.8Å
385	M	32	Very low	31.6	Very low	176 Å²	176	148.6 Å²	148.6	87%	0.867	81%	0.811	S	S	*	*			trans	-88.8	114.5	163.9	-77.2	-72.1	-140.9	0	0	108.7
386	L	32.6	Very low	31.9	Very low	143 Å²	143	146.6 Å²	146.6	75%	0.749	81%	0.808	S	S	*	*			trans	-95.4	105.8	170.4	-85.1	163.9	0	0	0	109.7	F388	L386-F388 HydrophobicContact CB-CE2 4.46Å
387	V	32.8	Very low	32.2	Very low	113 Å²	113	148.2 Å²	148.2	69%	0.685	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-91.2	117	167.2	175.8	0	0	0	0	107.6	F389	V387-F389 HydrophobicContact CG1-CD2 3.97Å; V387-F389 HydrophobicContact CG1-CE2 4.04Å
388	F	34.5	Very low	32.3	Very low	174 Å²	174	150.9 Å²	150.9	76%	0.763	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-97	117	169.9	-85	-83.6	0	0	0	109.9	L386	L386-F388 HydrophobicContact CB-CE2 4.46Å
389	F	34.5	Very low	32.5	Very low	183 Å²	183	148.6 Å²	148.6	80%	0.803	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-97	120.8	159.2	-89.5	-85.6	0	0	0	108.5	V387	V387-F389 HydrophobicContact CG1-CD2 3.97Å; V387-F389 HydrophobicContact CG1-CE2 4.04Å
390	C	31.4	Very low	32.6	Very low	120 Å²	120	148.2 Å²	148.2	81%	0.811	80%	0.804	S	S	*	*			trans	-118.1	106.8	159.2	-79.2	0	0	0	0	108.3
391	S	34.9	Very low	32.7	Very low	115 Å²	115	148.2 Å²	148.2	80%	0.804	81%	0.807	S	S	*	*			trans	-90.9	122.6	160.1	-53.5	0	0	0	0	107.3
392	S	34.6	Very low	33	Very low	119 Å²	119	148.3 Å²	148.3	83%	0.832	81%	0.81	S	S	*	*			trans	-110.8	137.5	167.7	-79.2	0	0	0	0	110.1
393	I	37.9	Very low	33.2	Very low	245 Å²	245	152 Å²	152	100%	1.256	82%	0.824	S	S	*	*			trans	-55.4	0	158.1	-73.3	161.7	0	0	0	110.6

Retrieved 393 of 393 residues in 109.6 ms (Link to these results)

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