A0A913KPM2_SCHMA Loading...

Egg protein CP391S-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0A913KPM2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 280 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	39.6	Very low	237 Å²	237	180.2 Å²	180.2	100%	1.167	84%	0.841	S	S	*	*				0	120.3	0	-102.2	-174.9	170.8	0	0	106.5
2	R	38.3	Very low	39.7	Very low	222 Å²	222	173.4 Å²	173.4	84%	0.838	83%	0.829	S	S	*	*			cis	-145.3	133.4	23.7	-74.6	168	168	169.7	-5.2	107.1	T4	R2-T4 PolarHBondContact O-N 2.95Å
3	Y	40.4	Very low	40	Very low	226 Å²	226	175.3 Å²	175.3	89%	0.886	83%	0.832	S	S	*	*			trans	-66.8	119.7	162.4	-84.7	-95.3	0	0	0	107.4	I5	Y3-I5 VanDerWaalsContact C-N 3.28Å; Y3-I5 PolarHBondContact O-N 3.34Å
4	T	39	Very low	40.1	Very low	143 Å²	143	173.9 Å²	173.9	88%	0.877	82%	0.824	S	S	*	*			trans	-73.8	88.6	173.4	-25	0	0	0	0	107.3	R2 L6	R2-T4 PolarHBondContact O-N 2.95Å; T4-L6 PolarHBondContact O-N 2.94Å; T4-L6 VanDerWaalsContact O-N 3.17Å
5	I	41.3	Very low	40.2	Very low	144 Å²	144	173.2 Å²	173.2	74%	0.738	83%	0.826	S	S	*	*			trans	-60.9	117	174.1	-66.3	168.5	0	0	0	107.3	Y3 R7	Y3-I5 VanDerWaalsContact C-N 3.28Å; Y3-I5 PolarHBondContact O-N 3.34Å; I5-R7 PolarHBondContact O-N 3.17Å
6	L	39.3	Very low	40.6	Very low	141 Å²	141	169.5 Å²	169.5	74%	0.738	81%	0.811	S	S	*	*			trans	-57.7	99.8	175.4	-146.1	83.4	0	0	0	108.4	T4 S8	T4-L6 PolarHBondContact O-N 2.94Å; T4-L6 VanDerWaalsContact O-N 3.17Å; L6-S8 PolarHBondContact O-N 3.12Å; L6-S8 VanDerWaalsContact O-N 3.12Å
7	R	43	Very low	41	Very low	248 Å²	248	168.8 Å²	168.8	94%	0.936	81%	0.811	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	27.2	-171	-142	-177.8	-172.1	-166	1.8	113.2	I5	I5-R7 PolarHBondContact O-N 3.17Å
8	S	42.3	Very low	40.9	Very low	93 Å²	93	167.4 Å²	167.4	65%	0.65	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	7.2	-172.8	72.5	0	0	0	0	115.3	L6	L6-S8 PolarHBondContact O-N 3.12Å; L6-S8 VanDerWaalsContact O-N 3.12Å
9	L	41.3	Very low	41	Very low	135 Å²	135	168.6 Å²	168.6	71%	0.707	80%	0.802	S	S	*	*	S	Bend	trans	-116.4	6.9	-172.4	-88.9	158	0	0	0	116.1
10	W	39	Very low	41.1	Very low	236 Å²	236	164.1 Å²	164.1	89%	0.894	79%	0.787	S	S	*	*	S	Bend	trans	-122.5	109.6	176.7	-83.5	63.1	0	0	0	110.3
11	L	36.5	Very low	41.3	Very low	157 Å²	157	166.9 Å²	166.9	82%	0.822	79%	0.792	S	S	*	*	S	Bend	trans	126.8	64.4	155	-65	154.1	0	0	0	114.8
12	S	41	Very low	41.5	Very low	99 Å²	99	165.8 Å²	165.8	69%	0.692	77%	0.774	S	S	*	*			trans	-152.7	41.9	139.6	67.8	0	0	0	0	113.2	H14	S12-H14 PolarHBondContact O-N 2.96Å
13	F	44.2	Very low	41.8	Very low	198 Å²	198	164 Å²	164	87%	0.868	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	27.1	161.4	-84.4	-79.3	0	0	0	112.9
14	H	40.5	Very low	42.2	Very low	155 Å²	155	160.1 Å²	160.1	72%	0.718	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	16.7	176.2	-72.4	-44.7	0	0	0	114	S12 I16	S12-H14 PolarHBondContact O-N 2.96Å; H14-I16 PolarHBondContact O-N 3.06Å
15	L	41.5	Very low	42.7	Very low	164 Å²	164	159.2 Å²	159.2	86%	0.859	75%	0.747	S	S	*	*			trans	-80.6	56.6	148.7	-78.3	160.7	0	0	0	108.9	I17	L15-I17 VanDerWaalsContact C-N 3.25Å; L15-I17 PolarHBondContact O-N 2.68Å
16	I	47.2	Very low	43.6	Very low	114 Å²	114	155.8 Å²	155.8	59%	0.585	74%	0.735	S	S	*	*			trans	-59.6	102.4	156.5	-68	168.9	0	0	0	104.1	H14 I18	H14-I16 PolarHBondContact O-N 3.06Å; I16-I18 PolarHBondContact O-N 2.92Å
17	I	47.8	Very low	45.3	Very low	157 Å²	157	151 Å²	151	81%	0.805	71%	0.709	S	S	*	*			trans	11	65.7	140	-47.1	173.1	0	0	0	112.7	L15	L15-I17 VanDerWaalsContact C-N 3.25Å; L15-I17 PolarHBondContact O-N 2.68Å
18	I	39.3	Very low	47.2	Very low	144 Å²	144	142.6 Å²	142.6	74%	0.738	68%	0.68	S	S	*	*			trans	-100.6	68.4	149.1	-54.6	168.1	0	0	0	101.8	I16 P20	I16-I18 PolarHBondContact O-N 2.92Å; I18-P20 HydrophobicContact CG2-CB 4.28Å; I18-P20 WeakPolarHBondContact O-CD 3.11Å
19	W	43.1	Very low	49.2	Very low	191 Å²	191	138.2 Å²	138.2	72%	0.723	65%	0.649	S	S	*	*			trans	-75.9	94.2	149	-145.8	20.7	0	0	0	101.5	Y21 Y23	W19-Y21 PolarHBondContact O-N 3.24Å; W19-Y23 AromaticContact CH2-CE2 3.62Å; W19-Y23 HydrophobicContact CH2-CE2 3.62Å; W19-Y23 AromaticContact CZ2-CE2 3.78Å; W19-Y23 HydrophobicContact CZ2-CE2 3.78Å; W19-Y23 HydrophobicContact CZ3-CE2 4.08Å
20	P	42.1	Very low	51.3	Low	78 Å²	78	133.6 Å²	133.6	51%	0.506	63%	0.628	S	S	.	*			trans	-59.1	139.7	-177.8	28.7	-27.1	0	0	0	104.7	I18 R22	I18-P20 HydrophobicContact CG2-CB 4.28Å; I18-P20 WeakPolarHBondContact O-CD 3.11Å; P20-R22 PolarHBondContact O-N 2.59Å
21	Y	44.7	Very low	53.6	Low	223 Å²	223	129.2 Å²	129.2	88%	0.875	62%	0.617	S	S	*	*	S	Bend	trans	-55.8	56.5	173	-76.5	-101.6	0	0	0	111.9	W19 F24	W19-Y21 PolarHBondContact O-N 3.24Å; Y21-F24 WeakPolarHBondContact O-CD2 3.49Å
22	R	40.2	Very low	56	Low	214 Å²	214	124.8 Å²	124.8	81%	0.808	59%	0.594	S	S	*	*			trans	-101.6	6.3	173.8	-128.5	-176.5	-174.6	-176.8	0.7	111.2	P20 F24	P20-R22 PolarHBondContact O-N 2.59Å; R22-F24 PolarHBondContact O-N 3.38Å
23	Y	45.1	Very low	58.1	Low	184 Å²	184	123.8 Å²	123.8	72%	0.722	59%	0.586	S	S	*	*			trans	-65.5	52.9	140.8	-90	-86.2	0	0	0	109.6	W19 N25	W19-Y23 AromaticContact CH2-CE2 3.62Å; W19-Y23 HydrophobicContact CH2-CE2 3.62Å; W19-Y23 AromaticContact CZ2-CE2 3.78Å; W19-Y23 HydrophobicContact CZ2-CE2 3.78Å; W19-Y23 HydrophobicContact CZ3-CE2 4.08Å; Y23-N25 PolarHBondContact O-N 2.89Å
24	F	47.1	Very low	60.2	Low	144 Å²	144	120.3 Å²	120.3	63%	0.632	58%	0.576	S	S	*	*			trans	-62.2	125.7	146.8	-85	-90.7	0	0	0	103.8	Y21 R22 C26	Y21-F24 WeakPolarHBondContact O-CD2 3.49Å; R22-F24 PolarHBondContact O-N 3.38Å; F24-C26 PolarHBondContact O-N 2.64Å
25	N	50.1	Low	62.4	Low	124 Å²	124	113.7 Å²	113.7	66%	0.663	55%	0.546	S	S	*	.			trans	-51.6	84.3	178.6	-81	-38.8	0	0	0	111.1	Y23 H27	Y23-N25 PolarHBondContact O-N 2.89Å; N25-H27 PolarHBondContact O-N 3.18Å; N25-H27 PolarHBondContact O-ND1 2.88Å
26	C	61	Low	64.6	Low	73 Å²	73	108.3 Å²	108.3	49%	0.493	52%	0.518	S	S	.	.			trans	-72.1	85.1	164.9	-65.4	0	0	0	0	104.8	F24 E28 E31	F24-C26 PolarHBondContact O-N 2.64Å; C26-E28 PolarHBondContact O-N 2.88Å; C26-E31 HydrophobicContact CB-CG 4.32Å; C26-E31 VanDerWaalsContact CB-OE1 3.3Å; C26-E31 WeakPolarHBondContact CB-OE1 3.2Å
27	H	73.5	Confident	66.5	Low	41 Å²	41	107.6 Å²	107.6	19%	0.19	52%	0.523	C	S	.	.			trans	-56.1	139	163.5	-65.5	75.3	0	0	0	106.1	N25 I29 C30 F193	N25-H27 PolarHBondContact O-N 3.18Å; N25-H27 PolarHBondContact O-ND1 2.88Å; H27-I29 PolarHBondContact O-N 2.91Å; H27-C30 WeakPolarHBondContact O-CA 3.46Å; H27-C30 WeakPolarHBondContact O-CB 3.06Å; H27-C30 PolarHBondContact O-N 2.85Å; H27-F193 HydrophobicContact CB-CD1 4.27Å; H27-F193 HydrophobicContact CB-CG 4.49Å; H27-F193 AromaticContact CD2-CD1 3.19Å; H27-F193 WeakPolarHBondContact CD2-CD1 3.3Å; H27-F193 AromaticContact CD2-CE1 3.5Å; H27-F193 AromaticContact CG-CD1 3.68Å; H27-F193 AromaticContact NE2-CD1 3.54Å; H27-F193 AromaticContact NE2-CE1 3.98Å
28	E	83.2	Confident	68.5	Low	71 Å²	71	101.8 Å²	101.8	33%	0.332	49%	0.491	S	S	.	.	H	α-helix	trans	-51.9	-35	-179.2	-165.5	-172.6	160.8	0	0	112.3	C26 C30 E31 N32 L35 Y54 K224	C26-E28 PolarHBondContact O-N 2.88Å; E28-C30 VanDerWaalsContact C-N 3.25Å; E28-C30 PolarHBondContact O-N 2.04Å; E28-E31 PolarHBondContact O-N 2.74Å; E28-N32 PolarHBondContact O-N 3.43Å; E28-L35 HydrophobicContact CB-CD1 4.06Å; E28-L35 HydrophobicContact CG-CD1 3.54Å; E28-L35 WeakPolarHBondContact OE1-CD1 3.48Å; E28-Y54 HydrophobicContact CB-CE2 4.34Å; E28-K224 IonicContact OE2-NZ 2.76Å; E28-K224 PolarHBondContact OE2-NZ 2.83Å
29	I	84.5	Confident	71.2	Confident	1 Å²	1	99 Å²	99	1%	0.005	48%	0.475	C	S	.	.	H	α-helix	trans	-55.6	-34.3	171.1	-85.4	172.2	0	0	0	113.8	H27 E31 N32 L35 L36 Y54 F193 T200 H202	H27-I29 PolarHBondContact O-N 2.91Å; I29-E31 VanDerWaalsContact C-N 3.29Å; I29-N32 CarbonylContact O-C 3.52Å; I29-L35 HydrophobicContact CG1-CB 3.72Å; I29-L35 HydrophobicContact CG1-CD1 4.5Å; I29-L36 HydrophobicContact CD1-CD2 3.97Å; I29-L36 HydrophobicContact CG1-CD2 4.24Å; I29-L36 HydrophobicContact CG2-CD2 3.48Å; I29-L36 VanDerWaalsContact CG2-CD2 3.48Å; I29-L36 HydrophobicContact CG2-CG 3.98Å; I29-Y54 HydrophobicContact CD1-CD1 3.28Å; I29-Y54 HydrophobicContact CD1-CD2 4.41Å; I29-Y54 HydrophobicContact CD1-CE1 3.23Å; I29-Y54 HydrophobicContact CD1-CE2 4.38Å; I29-Y54 HydrophobicContact CD1-CG 3.89Å; I29-Y54 HydrophobicContact CG1-CD1 4.05Å; I29-Y54 HydrophobicContact CG1-CD2 4.34Å; I29-Y54 HydrophobicContact CG1-CE1 3.83Å; I29-Y54 HydrophobicContact CG1-CE2 4.14Å; I29-Y54 HydrophobicContact CG1-CG 4.28Å; I29-F193 HydrophobicContact CB-CD2 4.45Å; I29-F193 HydrophobicContact CD1-CD2 3.78Å; I29-F193 HydrophobicContact CD1-CE2 3.33Å; I29-F193 HydrophobicContact CD1-CZ 4.13Å; I29-F193 HydrophobicContact CG2-CD2 4.08Å; I29-T200 HydrophobicContact CG2-CG2 4Å; I29-H202 HydrophobicContact CD1-CB 4.31Å
30	C	86	Confident	73.6	Confident	38 Å²	38	92.5 Å²	92.5	26%	0.257	45%	0.454	S	S	.	.	H	α-helix	trans	-69.9	-29.3	177.8	-59	0	0	0	0	111.9	H27 E28 C195	H27-C30 WeakPolarHBondContact O-CA 3.46Å; H27-C30 WeakPolarHBondContact O-CB 3.06Å; H27-C30 PolarHBondContact O-N 2.85Å; E28-C30 VanDerWaalsContact C-N 3.25Å; E28-C30 PolarHBondContact O-N 2.04Å; C30-C195 WeakPolarHBondContact CA-SG 3.4Å; C30-C195 HydrophobicContact CB-CB 3.72Å; C30-C195 WeakPolarHBondContact CB-SG 3.4Å; C30-C195 WeakPolarHBondContact SG-CA 3.31Å; C30-C195 WeakPolarHBondContact SG-CB 3.38Å; C30-C195 CovalentContact SG-SG 2.04Å; C30-C195 PolarHBondContact SG-SG 3.07Å
31	E	87.1	Confident	76.2	Confident	144 Å²	144	92.7 Å²	92.7	67%	0.673	45%	0.45	S	S	*	.	H	α-helix	trans	-90.6	-30.2	178.2	-63	-178.4	175.8	0	0	111.8	C26 E28 I29	C26-E31 HydrophobicContact CB-CG 4.32Å; C26-E31 VanDerWaalsContact CB-OE1 3.3Å; C26-E31 WeakPolarHBondContact CB-OE1 3.2Å; E28-E31 PolarHBondContact O-N 2.74Å; I29-E31 VanDerWaalsContact C-N 3.29Å
32	N	87.4	Confident	78.7	Confident	63 Å²	63	82.5 Å²	82.5	34%	0.337	41%	0.411	S	S	.	.			trans	-129.6	86.3	179.2	-175.1	5.9	0	0	0	111.1	E28 I29 N34 L35	E28-N32 PolarHBondContact O-N 3.43Å; I29-N32 CarbonylContact O-C 3.52Å; N32-N34 PolarHBondContact O-N 2.83Å; N32-N34 VanDerWaalsContact O-N 3.09Å; N32-N34 WeakPolarHBondContact OD1-CB 3.42Å; N32-N34 PolarHBondContact OD1-N 3.32Å; N32-L35 HydrophobicContact CB-CD1 4Å; N32-L35 HydrophobicContact CB-CG 4.15Å; N32-L35 WeakPolarHBondContact O-CB 3.5Å; N32-L35 WeakPolarHBondContact O-CG 3.19Å; N32-L35 PolarHBondContact O-N 2.85Å
33	P	85	Confident	81.3	Confident	79 Å²	79	75.2 Å²	75.2	51%	0.513	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-59.4	-20.7	179.2	-26.5	35.7	0	0	0	114.7	L35 L36	P33-L35 PolarHBondContact O-N 2.82Å; P33-L35 VanDerWaalsContact O-N 3.17Å; P33-L36 HydrophobicContact CB-CD1 4.45Å; P33-L36 VanDerWaalsContact O-CB 3.23Å; P33-L36 WeakPolarHBondContact O-CB 3.23Å; P33-L36 VanDerWaalsContact O-CG 3.3Å; P33-L36 WeakPolarHBondContact O-CG 3.06Å; P33-L36 PolarHBondContact O-N 3.06Å
34	N	88.3	Confident	83.7	Confident	124 Å²	124	69.9 Å²	69.9	66%	0.663	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-63.5	-20.1	176.6	-61.8	-33.4	0	0	0	112.4	N32 L36 S37 Y38	N32-N34 PolarHBondContact O-N 2.83Å; N32-N34 VanDerWaalsContact O-N 3.09Å; N32-N34 WeakPolarHBondContact OD1-CB 3.42Å; N32-N34 PolarHBondContact OD1-N 3.32Å; N34-L36 PolarHBondContact O-N 3.38Å; N34-S37 PolarHBondContact O-N 3.28Å; N34-S37 PolarHBondContact O-OG 2.76Å; N34-Y38 PolarHBondContact O-N 3.12Å
35	L	86.4	Confident	86	Confident	17 Å²	17	66.4 Å²	66.4	9%	0.089	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-66.2	-17.3	173.5	-65.3	175.4	0	0	0	112.9	E28 I29 N32 P33 S37 Y38 Y54	E28-L35 HydrophobicContact CB-CD1 4.06Å; E28-L35 HydrophobicContact CG-CD1 3.54Å; E28-L35 WeakPolarHBondContact OE1-CD1 3.48Å; I29-L35 HydrophobicContact CG1-CB 3.72Å; I29-L35 HydrophobicContact CG1-CD1 4.5Å; N32-L35 HydrophobicContact CB-CD1 4Å; N32-L35 HydrophobicContact CB-CG 4.15Å; N32-L35 WeakPolarHBondContact O-CB 3.5Å; N32-L35 WeakPolarHBondContact O-CG 3.19Å; N32-L35 PolarHBondContact O-N 2.85Å; P33-L35 PolarHBondContact O-N 2.82Å; P33-L35 VanDerWaalsContact O-N 3.17Å; L35-S37 VanDerWaalsContact C-N 3.33Å; L35-Y38 WeakPolarHBondContact O-CB 3.5Å; L35-Y38 PolarHBondContact O-N 3.06Å; L35-Y54 HydrophobicContact CB-CD2 3.98Å; L35-Y54 HydrophobicContact CB-CE2 4.47Å; L35-Y54 HydrophobicContact CB-CG 4.45Å; L35-Y54 HydrophobicContact CD1-CD2 4.01Å; L35-Y54 HydrophobicContact CD1-CE2 3.85Å; L35-Y54 HydrophobicContact CD2-CD2 4.27Å; L35-Y54 HydrophobicContact CG-CD2 4.31Å
36	L	86.6	Confident	88.2	Confident	51 Å²	51	67.8 Å²	67.8	27%	0.267	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-70.2	-29.9	177.8	-66.2	170.5	0	0	0	113.8	I29 P33 N34 T200 H202	I29-L36 HydrophobicContact CD1-CD2 3.97Å; I29-L36 HydrophobicContact CG1-CD2 4.24Å; I29-L36 HydrophobicContact CG2-CD2 3.48Å; I29-L36 VanDerWaalsContact CG2-CD2 3.48Å; I29-L36 HydrophobicContact CG2-CG 3.98Å; P33-L36 HydrophobicContact CB-CD1 4.45Å; P33-L36 VanDerWaalsContact O-CB 3.23Å; P33-L36 WeakPolarHBondContact O-CB 3.23Å; P33-L36 VanDerWaalsContact O-CG 3.3Å; P33-L36 WeakPolarHBondContact O-CG 3.06Å; P33-L36 PolarHBondContact O-N 3.06Å; N34-L36 PolarHBondContact O-N 3.38Å; L36-T200 HydrophobicContact CD1-CG2 3.31Å; L36-T200 HydrophobicContact CD2-CG2 3.52Å; L36-T200 HydrophobicContact CG-CG2 3.97Å; L36-H202 HydrophobicContact CD2-CB 3.9Å; L36-H202 PolarHBondContact O-CD2 3.37Å
37	S	87.9	Confident	89.9	Confident	99 Å²	99	66.6 Å²	66.6	69%	0.692	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-110.9	15.9	177.8	63.3	0	0	0	0	111.4	N34 L35 E39	N34-S37 PolarHBondContact O-N 3.28Å; N34-S37 PolarHBondContact O-OG 2.76Å; L35-S37 VanDerWaalsContact C-N 3.33Å; S37-E39 PolarHBondContact O-N 3.4Å; S37-E39 VanDerWaalsContact O-N 3.16Å
38	Y	90.2	Very high	91.1	Very high	35 Å²	35	66.3 Å²	66.3	14%	0.137	35%	0.352	C	S	.	.			trans	-70.4	113.4	-177.1	171.7	-93.1	0	0	0	109.8	N34 L35 N40 L52 H53 K253	N34-Y38 PolarHBondContact O-N 3.12Å; L35-Y38 WeakPolarHBondContact O-CB 3.5Å; L35-Y38 PolarHBondContact O-N 3.06Å; Y38-N40 WeakPolarHBondContact CE2-ND2 3.23Å; Y38-N40 PolarHBondContact OH-ND2 2.98Å; Y38-N40 VanDerWaalsContact OH-ND2 3.08Å; Y38-L52 HydrophobicContact CE1-CB 4.37Å; Y38-H53 WeakPolarHBondContact O-CA 3.3Å; Y38-K253 PolarHBondContact OH-NZ 2.89Å
39	E	95.4	Very high	91.8	Very high	86 Å²	86	63.5 Å²	63.5	40%	0.402	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	130.6	173.4	179.8	174.6	-147.6	0	0	108.8	S37 I41 R49 L52 H53	S37-E39 PolarHBondContact O-N 3.4Å; S37-E39 VanDerWaalsContact O-N 3.16Å; E39-I41 HydrophobicContact CG-CG1 4.47Å; E39-R49 IonicContact OE1-CZ 2.71Å; E39-R49 VanDerWaalsContact OE1-CZ 3.3Å; E39-R49 IonicContact OE1-NH1 3.15Å; E39-R49 PolarHBondContact OE1-NH1 3.12Å; E39-R49 VanDerWaalsContact OE1-NH1 3.13Å; E39-R49 IonicContact OE1-NH2 2.62Å; E39-R49 PolarHBondContact OE1-NH2 2.85Å; E39-R49 IonicContact OE2-NH2 3.64Å; E39-L52 CarbonylContact C-O 3.59Å; E39-L52 VanDerWaalsContact CA-O 3.3Å; E39-L52 WeakPolarHBondContact CA-O 3.45Å; E39-H53 IonicContact OE1-CE1 3.61Å; E39-H53 PolarHBondContact OE1-CE1 2.94Å; E39-H53 IonicContact OE1-NE2 2.74Å
40	N	94.9	Very high	92.4	Very high	53 Å²	53	63.5 Å²	63.5	28%	0.283	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	115.7	165.6	-76.2	-77.5	0	0	0	109.6	Y38 I42 S51 L52 V251	Y38-N40 WeakPolarHBondContact CE2-ND2 3.23Å; Y38-N40 PolarHBondContact OH-ND2 2.98Å; Y38-N40 VanDerWaalsContact OH-ND2 3.08Å; N40-I42 PolarHBondContact O-N 2.93Å; N40-S51 CarbonylContact O-C 3.53Å; N40-S51 WeakPolarHBondContact O-CA 3.37Å; N40-L52 PolarHBondContact N-O 2.95Å; N40-L52 PolarHBondContact O-N 2.84Å; N40-V251 HydrophobicContact CB-CG1 3.85Å
41	I	96.3	Very high	93	Very high	83 Å²	83	61.7 Å²	61.7	43%	0.426	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	112.1	172.3	-55.9	171.3	0	0	0	107.5	E39 E44 R49	E39-I41 HydrophobicContact CG-CG1 4.47Å; I41-E44 HydrophobicContact CG2-CB 3.78Å; I41-R49 VanDerWaalsContact CD1-NH2 3.29Å
42	I	95.7	Very high	93.4	Very high	8 Å²	8	54.9 Å²	54.9	4%	0.041	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-42.3	178.9	-68.8	173	0	0	0	110	N40 Y50 L52 K250 V251 D269	N40-I42 PolarHBondContact O-N 2.93Å; I42-Y50 HydrophobicContact CB-CD1 3.87Å; I42-Y50 HydrophobicContact CD1-CD1 3.66Å; I42-Y50 HydrophobicContact CD1-CE1 3.42Å; I42-Y50 VanDerWaalsContact CD1-CE1 3.42Å; I42-Y50 HydrophobicContact CG1-CD1 4.32Å; I42-Y50 HydrophobicContact CG2-CD1 4.03Å; I42-Y50 PolarHBondContact N-O 3.1Å; I42-L52 HydrophobicContact CD1-CD1 3.68Å; I42-L52 HydrophobicContact CD1-CD2 3.96Å; I42-L52 HydrophobicContact CD1-CG 3.45Å; I42-L52 VanDerWaalsContact CD1-CG 3.45Å; I42-L52 HydrophobicContact CG1-CD1 4.44Å; I42-L52 HydrophobicContact CG1-CG 4.23Å; I42-K250 HydrophobicContact CG2-CB 4.5Å; I42-K250 HydrophobicContact CG2-CD 4.04Å; I42-K250 WeakPolarHBondContact O-CD 3.48Å; I42-K250 PolarHBondContact O-NZ 3Å; I42-V251 HydrophobicContact CG1-CG1 3.97Å; I42-V251 HydrophobicContact CG1-CG2 4.48Å; I42-D269 HydrophobicContact CG2-CB 4.17Å; I42-D269 WeakPolarHBondContact CG2-O 3.37Å
43	F	94.9	Very high	93.8	Very high	62 Å²	62	52.4 Å²	52.4	27%	0.272	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	139	-180	-175.3	-73.5	0	0	0	108.5	N45 Y48 R49 Y50	F43-N45 HydrophobicContact CE1-CB 3.96Å; F43-N45 WeakPolarHBondContact CE1-ND2 3.3Å; F43-N45 HydrophobicContact CZ-CB 4.42Å; F43-Y48 AromaticContact CD1-CD1 3.52Å; F43-Y48 HydrophobicContact CD1-CD1 3.52Å; F43-Y48 HydrophobicContact CD1-CE1 4.06Å; F43-Y48 AromaticContact CE1-CD1 3.89Å; F43-Y48 HydrophobicContact CE1-CD1 3.89Å; F43-Y48 HydrophobicContact CG-CD1 4.4Å; F43-R49 CarbonylContact O-C 3.6Å; F43-R49 WeakPolarHBondContact O-CA 3.3Å; F43-Y50 PolarHBondContact N-O 3.41Å; F43-Y50 PolarHBondContact O-N 3.45Å
44	E	95.7	Very high	94.1	Very high	71 Å²	71	48.7 Å²	48.7	33%	0.332	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	132.9	171.6	-167.4	167.8	140.8	0	0	110.4	I41 Y48 R49 K209 W210	I41-E44 HydrophobicContact CG2-CB 3.78Å; E44-Y48 WeakPolarHBondContact CA-O 3.37Å; E44-R49 HydrophobicContact CB-CG 4.38Å; E44-R49 HydrophobicContact CG-CB 4.22Å; E44-R49 HydrophobicContact CG-CG 4.06Å; E44-R49 VanDerWaalsContact OE2-CD 3.31Å; E44-R49 WeakPolarHBondContact OE2-CD 3.26Å; E44-R49 IonicContact OE2-CZ 2.58Å; E44-R49 IonicContact OE2-NE 3.3Å; E44-R49 PolarHBondContact OE2-NE 2.74Å; E44-K209 WeakPolarHBondContact OE1-CE 3.37Å; E44-K209 IonicContact OE1-NZ 3.96Å; E44-K209 PolarHBondContact OE1-NZ 3.46Å; E44-W210 HydrophobicContact CG-CZ2 4.06Å
45	N	95.9	Very high	94.4	Very high	71 Å²	71	42.9 Å²	42.9	38%	0.38	23%	0.225	S	C	.	.			trans	-138.4	-166.3	165.3	70.7	18.3	0	0	0	108.9	F43 S47 Y48 W210	F43-N45 HydrophobicContact CE1-CB 3.96Å; F43-N45 WeakPolarHBondContact CE1-ND2 3.3Å; F43-N45 HydrophobicContact CZ-CB 4.42Å; N45-S47 VanDerWaalsContact C-N 3.26Å; N45-S47 PolarHBondContact O-N 3.07Å; N45-S47 PolarHBondContact OD1-N 3.17Å; N45-Y48 PolarHBondContact N-O 3.09Å; N45-Y48 WeakPolarHBondContact OD1-CA 3.43Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.15Å; N45-Y48 PolarHBondContact OD1-N 3.35Å; N45-Y48 PolarHBondContact OD1-O 3.19Å; N45-W210 VanDerWaalsContact O-CH2 3.23Å; N45-W210 WeakPolarHBondContact O-CH2 3.42Å
46	D	96.2	Very high	94.8	Very high	153 Å²	153	42 Å²	42	82%	0.818	22%	0.221	S	C	*	.	S	Bend	trans	-67.4	-22.1	-175.3	-63.2	-25.4	0	0	0	114.7	L62	D46-L62 VanDerWaalsContact O-CD1 3.25Å; D46-L62 WeakPolarHBondContact O-CD1 2.94Å
47	S	97	Very high	95.3	Very high	49 Å²	49	39.6 Å²	39.6	34%	0.343	21%	0.209	S	C	.	.	S	Bend	trans	-126.6	-5.4	-172.9	65.9	0	0	0	0	115.3	N45 L62	N45-S47 VanDerWaalsContact C-N 3.26Å; N45-S47 PolarHBondContact O-N 3.07Å; N45-S47 PolarHBondContact OD1-N 3.17Å; S47-L62 PolarHBondContact O-N 3.37Å
48	Y	97.8	Very high	95.8	Very high	34 Å²	34	34.9 Å²	34.9	13%	0.133	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	135.5	-175.9	-173.8	-86.2	0	0	0	111.1	F43 E44 N45 R59 I60 R61 D269	F43-Y48 AromaticContact CD1-CD1 3.52Å; F43-Y48 HydrophobicContact CD1-CD1 3.52Å; F43-Y48 HydrophobicContact CD1-CE1 4.06Å; F43-Y48 AromaticContact CE1-CD1 3.89Å; F43-Y48 HydrophobicContact CE1-CD1 3.89Å; F43-Y48 HydrophobicContact CG-CD1 4.4Å; E44-Y48 WeakPolarHBondContact CA-O 3.37Å; N45-Y48 PolarHBondContact N-O 3.09Å; N45-Y48 WeakPolarHBondContact OD1-CA 3.43Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.15Å; N45-Y48 PolarHBondContact OD1-N 3.35Å; N45-Y48 PolarHBondContact OD1-O 3.19Å; Y48-R59 HydrophobicContact CE2-CG 3.9Å; Y48-R59 WeakPolarHBondContact OH-CD 2.97Å; Y48-R59 PolarHBondContact OH-NE 3.16Å; Y48-I60 WeakPolarHBondContact CA-O 3.44Å; Y48-R61 HydrophobicContact CD2-CG 3.73Å; Y48-R61 HydrophobicContact CE2-CG 3.88Å; Y48-D269 VanDerWaalsContact CE1-OD1 3.3Å; Y48-D269 WeakPolarHBondContact CE1-OD1 3.18Å; Y48-D269 VanDerWaalsContact OH-CG 3.29Å; Y48-D269 PolarHBondContact OH-OD1 2.67Å; Y48-D269 VanDerWaalsContact OH-OD1 3.14Å; Y48-D269 PolarHBondContact OH-OD2 2.67Å
49	R	98	Very high	96.2	Very high	13 Å²	13	33.3 Å²	33.3	5%	0.049	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	134.9	172	-175.6	-178.4	-165.9	-123	3.9	110.2	E39 I41 F43 E44 R59 I60 W210	E39-R49 IonicContact OE1-CZ 2.71Å; E39-R49 VanDerWaalsContact OE1-CZ 3.3Å; E39-R49 IonicContact OE1-NH1 3.15Å; E39-R49 PolarHBondContact OE1-NH1 3.12Å; E39-R49 VanDerWaalsContact OE1-NH1 3.13Å; E39-R49 IonicContact OE1-NH2 2.62Å; E39-R49 PolarHBondContact OE1-NH2 2.85Å; E39-R49 IonicContact OE2-NH2 3.64Å; I41-R49 VanDerWaalsContact CD1-NH2 3.29Å; F43-R49 CarbonylContact O-C 3.6Å; F43-R49 WeakPolarHBondContact O-CA 3.3Å; E44-R49 HydrophobicContact CB-CG 4.38Å; E44-R49 HydrophobicContact CG-CB 4.22Å; E44-R49 HydrophobicContact CG-CG 4.06Å; E44-R49 VanDerWaalsContact OE2-CD 3.31Å; E44-R49 WeakPolarHBondContact OE2-CD 3.26Å; E44-R49 IonicContact OE2-CZ 2.58Å; E44-R49 IonicContact OE2-NE 3.3Å; E44-R49 PolarHBondContact OE2-NE 2.74Å; R49-R59 CarbonylContact O-C 3.57Å; R49-R59 WeakPolarHBondContact O-CA 3.26Å; R49-I60 HydrophobicContact CB-CB 4.18Å; R49-I60 PolarHBondContact N-O 3.5Å; R49-I60 PolarHBondContact O-N 2.84Å; R49-W210 HydrophobicContact CB-CH2 3.98Å; R49-W210 HydrophobicContact CB-CZ2 3.62Å; R49-W210 HydrophobicContact CG-CZ2 4.41Å
50	Y	97.9	Very high	96.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	126.7	170.1	-175.4	-120.8	0	0	0	110.1	I42 F43 S57 M58 R59 K266 D269	I42-Y50 HydrophobicContact CB-CD1 3.87Å; I42-Y50 HydrophobicContact CD1-CD1 3.66Å; I42-Y50 HydrophobicContact CD1-CE1 3.42Å; I42-Y50 VanDerWaalsContact CD1-CE1 3.42Å; I42-Y50 HydrophobicContact CG1-CD1 4.32Å; I42-Y50 HydrophobicContact CG2-CD1 4.03Å; I42-Y50 PolarHBondContact N-O 3.1Å; F43-Y50 PolarHBondContact N-O 3.41Å; F43-Y50 PolarHBondContact O-N 3.45Å; Y50-S57 WeakPolarHBondContact OH-CB 3.28Å; Y50-S57 PolarHBondContact OH-OG 3.38Å; Y50-M58 WeakPolarHBondContact CA-O 3.49Å; Y50-R59 HydrophobicContact CD2-CB 4.01Å; Y50-K266 WeakPolarHBondContact OH-CE 3.34Å; Y50-D269 HydrophobicContact CD1-CB 3.67Å; Y50-D269 HydrophobicContact CE1-CB 4.28Å; Y50-D269 HydrophobicContact CG-CB 4.37Å
51	S	97.8	Very high	96.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	149.9	-175.6	55.5	0	0	0	0	111.8	N40 H53 S57 M58	N40-S51 CarbonylContact O-C 3.53Å; N40-S51 WeakPolarHBondContact O-CA 3.37Å; S51-H53 PolarHBondContact OG-NE2 3.34Å; S51-S57 CarbonylContact O-C 3.59Å; S51-S57 VanDerWaalsContact O-CA 3.27Å; S51-S57 WeakPolarHBondContact O-CA 3.34Å; S51-S57 WeakPolarHBondContact O-CB 3.34Å; S51-M58 PolarHBondContact N-O 3.03Å; S51-M58 PolarHBondContact O-N 3.34Å; S51-M58 PolarHBondContact OG-O 3.45Å
52	L	96.3	Very high	96.5	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	135.9	172	-61.9	178.2	0	0	0	110.2	Y38 E39 N40 I42 V251 I255	Y38-L52 HydrophobicContact CE1-CB 4.37Å; E39-L52 CarbonylContact C-O 3.59Å; E39-L52 VanDerWaalsContact CA-O 3.3Å; E39-L52 WeakPolarHBondContact CA-O 3.45Å; N40-L52 PolarHBondContact N-O 2.95Å; N40-L52 PolarHBondContact O-N 2.84Å; I42-L52 HydrophobicContact CD1-CD1 3.68Å; I42-L52 HydrophobicContact CD1-CD2 3.96Å; I42-L52 HydrophobicContact CD1-CG 3.45Å; I42-L52 VanDerWaalsContact CD1-CG 3.45Å; I42-L52 HydrophobicContact CG1-CD1 4.44Å; I42-L52 HydrophobicContact CG1-CG 4.23Å; L52-V251 HydrophobicContact CD1-CG2 4.25Å; L52-I255 HydrophobicContact CD1-CG2 3.77Å; L52-I255 HydrophobicContact CD2-CD1 4.22Å
53	H	95.6	Very high	96.5	Very high	11 Å²	11	32.8 Å²	32.8	5%	0.051	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	177.6	176.4	-60.1	-88.8	0	0	0	109.2	Y38 E39 S51 N55 Y56 I204	Y38-H53 WeakPolarHBondContact O-CA 3.3Å; E39-H53 IonicContact OE1-CE1 3.61Å; E39-H53 PolarHBondContact OE1-CE1 2.94Å; E39-H53 IonicContact OE1-NE2 2.74Å; S51-H53 PolarHBondContact OG-NE2 3.34Å; H53-N55 PolarHBondContact O-N 3.41Å; H53-Y56 CarbonylContact C-O 3.56Å; H53-Y56 WeakPolarHBondContact CA-O 2.88Å; H53-Y56 WeakPolarHBondContact CB-O 3.14Å; H53-Y56 PolarHBondContact N-O 3.12Å; H53-I204 HydrophobicContact CB-CD1 3.67Å; H53-I204 HydrophobicContact CB-CG1 4.25Å; H53-I204 HydrophobicContact CB-CG2 4.11Å; H53-I204 VanDerWaalsContact CG-CG2 3.5Å
54	Y	92.4	Very high	96.5	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	122.6	175.2	176.7	-96.8	0	0	0	110.5	E28 I29 L35 Y56 Y91 F193 K224	E28-Y54 HydrophobicContact CB-CE2 4.34Å; I29-Y54 HydrophobicContact CD1-CD1 3.28Å; I29-Y54 HydrophobicContact CD1-CD2 4.41Å; I29-Y54 HydrophobicContact CD1-CE1 3.23Å; I29-Y54 HydrophobicContact CD1-CE2 4.38Å; I29-Y54 HydrophobicContact CD1-CG 3.89Å; I29-Y54 HydrophobicContact CG1-CD1 4.05Å; I29-Y54 HydrophobicContact CG1-CD2 4.34Å; I29-Y54 HydrophobicContact CG1-CE1 3.83Å; I29-Y54 HydrophobicContact CG1-CE2 4.14Å; I29-Y54 HydrophobicContact CG1-CG 4.28Å; L35-Y54 HydrophobicContact CB-CD2 3.98Å; L35-Y54 HydrophobicContact CB-CE2 4.47Å; L35-Y54 HydrophobicContact CB-CG 4.45Å; L35-Y54 HydrophobicContact CD1-CD2 4.01Å; L35-Y54 HydrophobicContact CD1-CE2 3.85Å; L35-Y54 HydrophobicContact CD2-CD2 4.27Å; L35-Y54 HydrophobicContact CG-CD2 4.31Å; Y54-Y56 PolarHBondContact O-N 3.25Å; Y54-Y56 VanDerWaalsContact O-N 3.09Å; Y54-Y91 HydrophobicContact CD1-CD1 4.31Å; Y54-Y91 HydrophobicContact CD1-CE1 4.06Å; Y54-Y91 HydrophobicContact CE1-CD1 4.26Å; Y54-Y91 HydrophobicContact CE1-CE1 4.43Å; Y54-F193 HydrophobicContact CE1-CE2 4.41Å; Y54-F193 HydrophobicContact CE1-CZ 4.14Å; Y54-K224 PolarHBondContact OH-NZ 2.81Å
55	N	93.1	Very high	96.3	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	0.5	-174.7	-75.9	11	0	0	0	117.1	H53 Y91 D92 I222 K224	H53-N55 PolarHBondContact O-N 3.41Å; N55-Y91 HydrophobicContact CB-CD1 3.64Å; N55-Y91 HydrophobicContact CB-CE1 4.09Å; N55-Y91 HydrophobicContact CB-CG 4.46Å; N55-D92 PolarHBondContact ND2-OD2 2.96Å; N55-I222 CarbonylContact C-O 3.44Å; N55-I222 PolarHBondContact O-N 2.85Å; N55-K224 WeakPolarHBondContact OD1-CE 3.35Å
56	Y	96.4	Very high	95.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	149.1	-176	-78.9	-88.6	0	0	0	111.3	H53 Y54 F90 Y91 I189 I204 E220 V221	H53-Y56 CarbonylContact C-O 3.56Å; H53-Y56 WeakPolarHBondContact CA-O 2.88Å; H53-Y56 WeakPolarHBondContact CB-O 3.14Å; H53-Y56 PolarHBondContact N-O 3.12Å; Y54-Y56 PolarHBondContact O-N 3.25Å; Y54-Y56 VanDerWaalsContact O-N 3.09Å; Y56-F90 WeakPolarHBondContact OH-CA 3.1Å; Y56-F90 WeakPolarHBondContact OH-CD2 3.33Å; Y56-Y91 HydrophobicContact CD2-CD1 4.32Å; Y56-Y91 AromaticContact CD2-CE1 3.96Å; Y56-Y91 HydrophobicContact CD2-CE1 3.96Å; Y56-Y91 HydrophobicContact CD2-CE2 4.15Å; Y56-Y91 AromaticContact CD2-CZ 3.85Å; Y56-Y91 AromaticContact CE2-CD1 3.97Å; Y56-Y91 HydrophobicContact CE2-CD1 3.97Å; Y56-Y91 AromaticContact CE2-CD2 3.57Å; Y56-Y91 HydrophobicContact CE2-CD2 3.57Å; Y56-Y91 AromaticContact CE2-CE1 3.93Å; Y56-Y91 HydrophobicContact CE2-CE1 3.93Å; Y56-Y91 AromaticContact CE2-CE2 3.51Å; Y56-Y91 HydrophobicContact CE2-CE2 3.51Å; Y56-Y91 AromaticContact CE2-CG 3.78Å; Y56-Y91 HydrophobicContact CE2-CG 3.78Å; Y56-Y91 AromaticContact CE2-CZ 3.69Å; Y56-Y91 PolarHBondContact OH-N 3.47Å; Y56-I189 HydrophobicContact CD1-CD1 3.92Å; Y56-I189 HydrophobicContact CD2-CD1 4.01Å; Y56-I189 HydrophobicContact CE1-CD1 3.98Å; Y56-I189 HydrophobicContact CE2-CD1 4.09Å; Y56-I189 HydrophobicContact CG-CD1 3.94Å; Y56-I204 HydrophobicContact CD2-CD1 4.12Å; Y56-I204 HydrophobicContact CG-CD1 4.16Å; Y56-E220 CarbonylContact C-O 3.38Å; Y56-E220 VanDerWaalsContact CA-O 3.26Å; Y56-E220 WeakPolarHBondContact CA-O 3.43Å; Y56-E220 WeakPolarHBondContact CD1-O 3.5Å; Y56-V221 HydrophobicContact CD1-CG2 4.43Å; Y56-V221 HydrophobicContact CE1-CB 4.46Å; Y56-V221 HydrophobicContact CE1-CG2 3.65Å
57	S	96.7	Very high	94.8	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	152.9	155.3	67	0	0	0	0	109.2	Y50 S51 Y219 E220	Y50-S57 WeakPolarHBondContact OH-CB 3.28Å; Y50-S57 PolarHBondContact OH-OG 3.38Å; S51-S57 CarbonylContact O-C 3.59Å; S51-S57 VanDerWaalsContact O-CA 3.27Å; S51-S57 WeakPolarHBondContact O-CA 3.34Å; S51-S57 WeakPolarHBondContact O-CB 3.34Å; S57-Y219 VanDerWaalsContact O-CA 3.31Å; S57-Y219 WeakPolarHBondContact O-CA 3.32Å; S57-E220 PolarHBondContact N-O 2.82Å; S57-E220 PolarHBondContact O-N 3.39Å
58	M	98.4	Very high	93.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	124	174.5	179.6	-157.9	-69.3	0	0	108.7	Y50 S51 I60 I204 P205 V217 E218 Y219	Y50-M58 WeakPolarHBondContact CA-O 3.49Å; S51-M58 PolarHBondContact N-O 3.03Å; S51-M58 PolarHBondContact O-N 3.34Å; S51-M58 PolarHBondContact OG-O 3.45Å; M58-I60 HydrophobicContact CG-CG1 4.12Å; M58-I60 HydrophobicContact SD-CD1 3.75Å; M58-I60 HydrophobicContact SD-CG1 3.92Å; M58-I204 HydrophobicContact CE-CG2 3.48Å; M58-I204 VanDerWaalsContact CE-CG2 3.48Å; M58-P205 VanDerWaalsContact CE-O 3.3Å; M58-P205 WeakPolarHBondContact CE-O 3.48Å; M58-V217 HydrophobicContact CG-CG1 3.87Å; M58-V217 HydrophobicContact SD-CG1 4.42Å; M58-E218 WeakPolarHBondContact CA-O 3.3Å; M58-Y219 HydrophobicContact CB-CD1 4.29Å; M58-Y219 HydrophobicContact CB-CE1 4.35Å; M58-Y219 HydrophobicContact CE-CD1 4.35Å; M58-Y219 HydrophobicContact CE-CE1 3.38Å; M58-Y219 HydrophobicContact CG-CD1 4.39Å; M58-Y219 HydrophobicContact CG-CE1 4.15Å
59	R	98.1	Very high	92.8	Very high	1 Å²	1	33.3 Å²	33.3	0%	0.004	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.7	170.3	-174.9	178	-66.7	100.3	3	109.4	Y48 R49 Y50 R61 V217 E218 D269	Y48-R59 HydrophobicContact CE2-CG 3.9Å; Y48-R59 WeakPolarHBondContact OH-CD 2.97Å; Y48-R59 PolarHBondContact OH-NE 3.16Å; R49-R59 CarbonylContact O-C 3.57Å; R49-R59 WeakPolarHBondContact O-CA 3.26Å; Y50-R59 HydrophobicContact CD2-CB 4.01Å; R59-R61 HydrophobicContact CG-CG 4.21Å; R59-V217 CarbonylContact O-C 3.54Å; R59-V217 WeakPolarHBondContact O-CA 3.16Å; R59-E218 HydrophobicContact CB-CB 4.42Å; R59-E218 PolarHBondContact N-O 2.8Å; R59-E218 PolarHBondContact O-N 2.86Å; R59-D269 IonicContact NH2-OD2 2.79Å
60	I	98.4	Very high	92	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	132.7	175.2	-51.6	-177.9	0	0	0	108.1	Y48 R49 M58 V206 W210 T215 L216 V217	Y48-I60 WeakPolarHBondContact CA-O 3.44Å; R49-I60 HydrophobicContact CB-CB 4.18Å; R49-I60 PolarHBondContact N-O 3.5Å; R49-I60 PolarHBondContact O-N 2.84Å; M58-I60 HydrophobicContact CG-CG1 4.12Å; M58-I60 HydrophobicContact SD-CD1 3.75Å; M58-I60 HydrophobicContact SD-CG1 3.92Å; I60-V206 HydrophobicContact CD1-CG1 4.24Å; I60-W210 HydrophobicContact CB-CD2 4.33Å; I60-W210 HydrophobicContact CB-CE3 4.2Å; I60-W210 HydrophobicContact CD1-CB 3.96Å; I60-W210 HydrophobicContact CD1-CD2 4.12Å; I60-W210 HydrophobicContact CD1-CG 3.68Å; I60-W210 HydrophobicContact CG2-CB 3.92Å; I60-W210 HydrophobicContact CG2-CD2 3.72Å; I60-W210 HydrophobicContact CG2-CE3 3.39Å; I60-W210 HydrophobicContact CG2-CG 3.95Å; I60-W210 HydrophobicContact CG2-CZ3 4.14Å; I60-T215 HydrophobicContact CG2-CG2 3.66Å; I60-L216 CarbonylContact C-O 3.55Å; I60-L216 WeakPolarHBondContact CA-O 3.31Å; I60-V217 HydrophobicContact CG1-CG1 4.29Å; I60-V217 HydrophobicContact CG1-CG2 4.13Å; I60-V217 HydrophobicContact CG2-CG2 4.2Å
61	R	97.7	Very high	91.1	Very high	59 Å²	59	42.3 Å²	42.3	22%	0.223	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	127.9	177	-60.8	-175.3	-83.9	155.6	-14.7	109.6	Y48 R59 Q64 L216 E218	Y48-R61 HydrophobicContact CD2-CG 3.73Å; Y48-R61 HydrophobicContact CE2-CG 3.88Å; R59-R61 HydrophobicContact CG-CG 4.21Å; R61-Q64 HydrophobicContact CB-CG 3.64Å; R61-L216 PolarHBondContact N-O 2.93Å; R61-L216 PolarHBondContact O-N 2.64Å; R61-E218 IonicContact CZ-OE2 3.07Å; R61-E218 IonicContact NE-OE2 2.64Å; R61-E218 PolarHBondContact NE-OE2 2.8Å; R61-E218 IonicContact NH2-OE1 3.19Å; R61-E218 PolarHBondContact NH2-OE1 2.82Å; R61-E218 VanDerWaalsContact NH2-OE1 3.15Å; R61-E218 IonicContact NH2-OE2 3.37Å; R61-E218 PolarHBondContact NH2-OE2 3.12Å
62	L	96.9	Very high	90.7	Very high	7 Å²	7	44.9 Å²	44.9	4%	0.037	25%	0.253	C	S	.	.	S	Bend	trans	-87.5	166.8	172	-61.1	-174.1	0	0	0	111.7	D46 S47 Q64 W210 K212 G214 T215	D46-L62 VanDerWaalsContact O-CD1 3.25Å; D46-L62 WeakPolarHBondContact O-CD1 2.94Å; S47-L62 PolarHBondContact O-N 3.37Å; L62-Q64 PolarHBondContact O-N 3.45Å; L62-Q64 PolarHBondContact O-NE2 3.37Å; L62-W210 HydrophobicContact CD1-CE3 4.21Å; L62-W210 HydrophobicContact CD1-CZ3 4.01Å; L62-W210 HydrophobicContact CD2-CE3 3.77Å; L62-W210 HydrophobicContact CD2-CZ3 4.22Å; L62-W210 HydrophobicContact CG-CE3 3.83Å; L62-W210 HydrophobicContact CG-CZ3 3.75Å; L62-K212 HydrophobicContact CD2-CD 4.47Å; L62-K212 HydrophobicContact CD2-CG 4.25Å; L62-G214 CarbonylContact C-O 3.57Å; L62-T215 HydrophobicContact CD2-CG2 3.82Å; L62-T215 WeakPolarHBondContact CD2-OG1 3.2Å
63	H	94.9	Very high	90.5	Very high	154 Å²	154	47.9 Å²	47.9	71%	0.713	27%	0.265	S	S	*	.	S	Bend	trans	57.5	33.1	174.2	-45.8	-61.8	0	0	0	113.1	G214	H63-G214 PolarHBondContact N-O 3Å; H63-G214 VanDerWaalsContact N-O 3.08Å
64	Q	95.5	Very high	90.4	Very high	58 Å²	58	52 Å²	52	27%	0.271	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-89.3	135.9	175.9	-55.7	-58.2	-78.8	0	0	109.3	R61 L62 Y172 G214 L216	R61-Q64 HydrophobicContact CB-CG 3.64Å; L62-Q64 PolarHBondContact O-N 3.45Å; L62-Q64 PolarHBondContact O-NE2 3.37Å; Q64-Y172 HydrophobicContact CB-CE2 4.29Å; Q64-Y172 WeakPolarHBondContact O-CE2 3.12Å; Q64-Y172 PolarHBondContact O-OH 2.98Å; Q64-G214 PolarHBondContact N-O 2.8Å; Q64-L216 HydrophobicContact CB-CB 3.99Å; Q64-L216 HydrophobicContact CG-CB 3.74Å; Q64-L216 HydrophobicContact CG-CD2 4.34Å
65	S	90.8	Very high	90.5	Very high	107 Å²	107	56.3 Å²	56.3	75%	0.748	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-65.2	155.6	168	-56.2	0	0	0	0	110.7	P67 Y172	S65-P67 VanDerWaalsContact O-CD 3.32Å; S65-P67 WeakPolarHBondContact O-CD 3.43Å; S65-Y172 VanDerWaalsContact C-OH 3.27Å
66	Q	82.2	Confident	90.5	Very high	97 Å²	97	57.2 Å²	57.2	45%	0.453	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-56.4	121.6	174.1	-174.3	177.1	30.5	0	0	109.5	A68 Y172 D174	Q66-A68 PolarHBondContact O-N 3.3Å; Q66-Y172 VanDerWaalsContact CA-CE1 3.4Å; Q66-Y172 VanDerWaalsContact CA-CZ 3.5Å; Q66-Y172 HydrophobicContact CB-CD1 4.42Å; Q66-Y172 HydrophobicContact CB-CE1 3.65Å; Q66-Y172 HydrophobicContact CG-CD1 4.15Å; Q66-Y172 HydrophobicContact CG-CE1 3.83Å; Q66-Y172 PolarHBondContact N-OH 2.94Å; Q66-D174 VanDerWaalsContact CD-OD1 3.27Å; Q66-D174 WeakPolarHBondContact CG-OD1 3.34Å; Q66-D174 PolarHBondContact NE2-OD1 2.92Å
67	P	79.2	Confident	90.2	Very high	36 Å²	36	66.4 Å²	66.4	23%	0.234	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-67.4	130.2	177.6	-16.2	29.6	0	0	0	109.3	S65 F69 L216	S65-P67 VanDerWaalsContact O-CD 3.32Å; S65-P67 WeakPolarHBondContact O-CD 3.43Å; P67-F69 VanDerWaalsContact C-N 3.26Å; P67-F69 HydrophobicContact CB-CD1 4.17Å; P67-F69 HydrophobicContact CB-CD2 3.99Å; P67-F69 HydrophobicContact CB-CE1 3.72Å; P67-F69 HydrophobicContact CB-CE2 3.53Å; P67-F69 HydrophobicContact CB-CG 4.31Å; P67-F69 HydrophobicContact CB-CZ 3.39Å; P67-F69 HydrophobicContact CG-CE1 4.27Å; P67-F69 HydrophobicContact CG-CE2 3.66Å; P67-F69 HydrophobicContact CG-CZ 3.5Å; P67-F69 VanDerWaalsContact O-CD2 3.27Å; P67-F69 WeakPolarHBondContact O-CD2 3.18Å; P67-F69 PolarHBondContact O-N 2.02Å; P67-L216 HydrophobicContact CG-CD1 3.91Å
68	A	75.6	Confident	90	Very high	108 Å²	108	71.3 Å²	71.3	89%	0.893	37%	0.374	S	S	*	.			trans	-74.6	81.6	173.9	0	0	0	0	0	109.3	Q66	Q66-A68 PolarHBondContact O-N 3.3Å
69	F	77.7	Confident	89.6	Confident	45 Å²	45	73.3 Å²	73.3	20%	0.197	39%	0.388	C	S	.	.			trans	-75.3	-46.2	-178	-64.9	-67.3	0	0	0	112.1	P67 L139 T160 V162 T170	P67-F69 VanDerWaalsContact C-N 3.26Å; P67-F69 HydrophobicContact CB-CD1 4.17Å; P67-F69 HydrophobicContact CB-CD2 3.99Å; P67-F69 HydrophobicContact CB-CE1 3.72Å; P67-F69 HydrophobicContact CB-CE2 3.53Å; P67-F69 HydrophobicContact CB-CG 4.31Å; P67-F69 HydrophobicContact CB-CZ 3.39Å; P67-F69 HydrophobicContact CG-CE1 4.27Å; P67-F69 HydrophobicContact CG-CE2 3.66Å; P67-F69 HydrophobicContact CG-CZ 3.5Å; P67-F69 VanDerWaalsContact O-CD2 3.27Å; P67-F69 WeakPolarHBondContact O-CD2 3.18Å; P67-F69 PolarHBondContact O-N 2.02Å; F69-L139 HydrophobicContact CB-CD2 4Å; F69-L139 HydrophobicContact CD1-CD2 4.4Å; F69-L139 WeakPolarHBondContact O-CD2 3.46Å; F69-T160 HydrophobicContact CD2-CG2 3.94Å; F69-T160 HydrophobicContact CE2-CG2 3.94Å; F69-V162 HydrophobicContact CD1-CB 4.38Å; F69-V162 HydrophobicContact CD1-CG1 4.08Å; F69-V162 HydrophobicContact CD1-CG2 3.82Å; F69-V162 HydrophobicContact CD2-CG2 3.61Å; F69-V162 HydrophobicContact CE1-CB 4.12Å; F69-V162 HydrophobicContact CE1-CG1 4.16Å; F69-V162 HydrophobicContact CE1-CG2 3.73Å; F69-V162 HydrophobicContact CE2-CG2 3.5Å; F69-V162 VanDerWaalsContact CE2-CG2 3.5Å; F69-V162 HydrophobicContact CG-CG2 3.75Å; F69-V162 HydrophobicContact CZ-CB 4.22Å; F69-V162 HydrophobicContact CZ-CG2 3.54Å; F69-T170 HydrophobicContact CZ-CG2 3.93Å
70	T	80.5	Confident	89.4	Confident	32 Å²	32	77 Å²	77	20%	0.196	40%	0.402	C	S	.	.			trans	-173.9	157.1	-175.2	179.6	0	0	0	0	110.5	S72 Y73 S134 L139 A141	T70-S72 PolarHBondContact OG1-N 2.91Å; T70-S72 VanDerWaalsContact OG1-N 3.13Å; T70-S72 PolarHBondContact OG1-OG 3.35Å; T70-Y73 HydrophobicContact CG2-CD2 4.46Å; T70-Y73 HydrophobicContact CG2-CE1 4.24Å; T70-Y73 HydrophobicContact CG2-CE2 3.81Å; T70-Y73 WeakPolarHBondContact O-CE2 3.48Å; T70-S134 VanDerWaalsContact CG2-OG 3.23Å; T70-S134 WeakPolarHBondContact CG2-OG 3.32Å; T70-S134 PolarHBondContact OG1-OG 3.2Å; T70-L139 HydrophobicContact CG2-CD1 4.14Å; T70-A141 HydrophobicContact CG2-CB 4.38Å
71	D	79	Confident	89.2	Confident	169 Å²	169	80 Å²	80	90%	0.904	42%	0.415	S	S	*	.	S	Bend	trans	-101.7	-9	172.2	-61.9	-41.9	0	0	0	112.7	Y73	D71-Y73 PolarHBondContact O-N 2.97Å; D71-Y73 VanDerWaalsContact O-N 3.09Å
72	S	88.5	Confident	89.1	Confident	54 Å²	54	77.3 Å²	77.3	38%	0.378	41%	0.406	S	S	.	.			trans	-88.7	59.8	-171.6	62.1	0	0	0	0	113.6	T70 S134 E136	T70-S72 PolarHBondContact OG1-N 2.91Å; T70-S72 VanDerWaalsContact OG1-N 3.13Å; T70-S72 PolarHBondContact OG1-OG 3.35Å; S72-S134 WeakPolarHBondContact O-CB 3.29Å; S72-S134 PolarHBondContact O-OG 3.42Å; S72-S134 VanDerWaalsContact O-OG 3.07Å; S72-S134 PolarHBondContact OG-OG 3.36Å; S72-E136 WeakPolarHBondContact CB-OE1 3.07Å; S72-E136 PolarHBondContact OG-OE1 3.06Å
73	Y	92.8	Very high	89	Confident	66 Å²	66	84 Å²	84	26%	0.259	44%	0.435	S	S	.	.			trans	-88.8	136.1	177.8	-73.9	-75.6	0	0	0	113	T70 D71 M132 A141 K143	T70-Y73 HydrophobicContact CG2-CD2 4.46Å; T70-Y73 HydrophobicContact CG2-CE1 4.24Å; T70-Y73 HydrophobicContact CG2-CE2 3.81Å; T70-Y73 WeakPolarHBondContact O-CE2 3.48Å; D71-Y73 PolarHBondContact O-N 2.97Å; D71-Y73 VanDerWaalsContact O-N 3.09Å; Y73-M132 HydrophobicContact CD1-CB 3.92Å; Y73-M132 HydrophobicContact CG-CB 4.25Å; Y73-A141 HydrophobicContact CE1-CB 3.98Å; Y73-K143 HydrophobicContact CD1-CB 4.46Å; Y73-K143 HydrophobicContact CE1-CB 3.98Å
74	Q	94.2	Very high	89.1	Confident	96 Å²	96	77.5 Å²	77.5	45%	0.449	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	136.6	165.8	57	170.9	11.9	0	0	110.8	Y80 M132 V133	Q74-Y80 PolarHBondContact NE2-OH 3.39Å; Q74-Y80 VanDerWaalsContact NE2-OH 3.12Å; Q74-M132 CarbonylContact O-C 3.52Å; Q74-M132 WeakPolarHBondContact O-CA 3.48Å; Q74-V133 VanDerWaalsContact CG-O 3.24Å; Q74-V133 WeakPolarHBondContact CG-O 3.04Å; Q74-V133 PolarHBondContact N-O 3.16Å; Q74-V133 PolarHBondContact O-N 3.42Å
75	K	94.1	Very high	89.2	Confident	93 Å²	93	80.4 Å²	80.4	40%	0.404	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	136.4	176.2	-173.6	167.3	179.5	162.6	0	110.7	Y77 E130	K75-Y77 HydrophobicContact CD-CE1 4.32Å; K75-Y77 HydrophobicContact CG-CE1 4.47Å; K75-E130 HydrophobicContact CD-CG 4.3Å; K75-E130 WeakPolarHBondContact CD-OE1 3.48Å; K75-E130 VanDerWaalsContact CE-CD 3.4Å; K75-E130 WeakPolarHBondContact CE-OE1 3.42Å; K75-E130 WeakPolarHBondContact CE-OE2 3.29Å; K75-E130 IonicContact NZ-OE1 3.4Å; K75-E130 PolarHBondContact NZ-OE1 3.14Å; K75-E130 IonicContact NZ-OE2 3.9Å; K75-E130 PolarHBondContact NZ-OE2 2.95Å
76	I	93.4	Very high	89.5	Confident	20 Å²	20	76.5 Å²	76.5	10%	0.103	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	147.6	173.4	65.2	166.6	0	0	0	110.2	Y80 I100 T131 V133	I76-Y80 HydrophobicContact CD1-CG 4.44Å; I76-Y80 HydrophobicContact CG2-CD1 4.19Å; I76-Y80 HydrophobicContact CG2-CD2 4.23Å; I76-Y80 HydrophobicContact CG2-CG 3.92Å; I76-I100 HydrophobicContact CD1-CB 4.31Å; I76-I100 HydrophobicContact CD1-CG2 3.84Å; I76-T131 HydrophobicContact CD1-CG2 3.67Å; I76-T131 HydrophobicContact CG1-CG2 3.76Å; I76-T131 WeakPolarHBondContact CG1-O 3.49Å; I76-T131 PolarHBondContact N-O 3.45Å; I76-V133 HydrophobicContact CD1-CG2 3.79Å; I76-V133 HydrophobicContact CG1-CG2 4.14Å; I76-V133 HydrophobicContact CG2-CG2 4.05Å
77	Y	90.3	Very high	90.1	Very high	193 Å²	193	76.4 Å²	76.4	76%	0.757	40%	0.397	S	S	*	.	S	Bend	trans	-111.2	-17.3	-175.6	-60.5	-81.6	0	0	0	113.8	K75	K75-Y77 HydrophobicContact CD-CE1 4.32Å; K75-Y77 HydrophobicContact CG-CE1 4.47Å
78	T	90.9	Very high	90.9	Very high	102 Å²	102	75 Å²	75	63%	0.626	39%	0.387	S	S	*	.	S	Bend	trans	-142	178.3	-179.9	64.6	0	0	0	0	109.1	Y80	T78-Y80 PolarHBondContact O-N 3.35Å
79	S	91.6	Very high	91.8	Very high	43 Å²	43	76.8 Å²	76.8	30%	0.301	37%	0.371	S	S	.	.			trans	-50.8	125.8	173.3	-68.9	0	0	0	0	111.5	I100 Y101	S79-I100 VanDerWaalsContact CA-O 3.31Å; S79-I100 WeakPolarHBondContact CA-O 3.41Å; S79-Y101 WeakPolarHBondContact OG-CD1 3.06Å
80	Y	93.1	Very high	92.7	Very high	77 Å²	77	74.7 Å²	74.7	30%	0.302	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	121.3	-173.8	-178	-112.2	0	0	0	110.4	Q74 I76 T78 V82 I100 V133	Q74-Y80 PolarHBondContact NE2-OH 3.39Å; Q74-Y80 VanDerWaalsContact NE2-OH 3.12Å; I76-Y80 HydrophobicContact CD1-CG 4.44Å; I76-Y80 HydrophobicContact CG2-CD1 4.19Å; I76-Y80 HydrophobicContact CG2-CD2 4.23Å; I76-Y80 HydrophobicContact CG2-CG 3.92Å; T78-Y80 PolarHBondContact O-N 3.35Å; Y80-V82 HydrophobicContact CD1-CB 4.09Å; Y80-V82 HydrophobicContact CE1-CB 3.69Å; Y80-V82 HydrophobicContact CE1-CG2 4.07Å; Y80-I100 HydrophobicContact CD1-CD1 4.35Å; Y80-I100 PolarHBondContact N-O 3.17Å; Y80-I100 PolarHBondContact O-N 2.92Å; Y80-V133 HydrophobicContact CD1-CG2 4.49Å; Y80-V133 HydrophobicContact CE1-CG1 4.39Å
81	F	94.5	Very high	93.2	Very high	63 Å²	63	73.3 Å²	73.3	28%	0.276	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.3	174.3	-70.5	-94.4	0	0	0	109.3	E97 V98 C99 Y113	F81-E97 HydrophobicContact CB-CG 4.5Å; F81-E97 HydrophobicContact CD1-CG 4.38Å; F81-E97 WeakPolarHBondContact CD1-OE1 3.16Å; F81-V98 WeakPolarHBondContact CA-O 3.36Å; F81-C99 HydrophobicContact CD1-CB 3.76Å; F81-C99 HydrophobicContact CE1-CB 3.6Å; F81-C99 HydrophobicContact CG-CB 4.46Å; F81-C99 HydrophobicContact CZ-CB 4.16Å; F81-C99 VanDerWaalsContact CZ-SG 3.52Å; F81-Y113 HydrophobicContact CE1-CE1 4.29Å; F81-Y113 HydrophobicContact CZ-CD1 4.33Å; F81-Y113 AromaticContact CZ-CE1 3.78Å; F81-Y113 HydrophobicContact CZ-CE1 3.78Å
82	V	94.9	Very high	93.7	Very high	4 Å²	4	69.2 Å²	69.2	2%	0.024	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	136.9	-178.5	64.6	0	0	0	0	110.3	Y80 P84 V98 I100 N135 L140	Y80-V82 HydrophobicContact CD1-CB 4.09Å; Y80-V82 HydrophobicContact CE1-CB 3.69Å; Y80-V82 HydrophobicContact CE1-CG2 4.07Å; V82-P84 WeakPolarHBondContact O-CD 3.23Å; V82-V98 HydrophobicContact CG1-CB 3.92Å; V82-V98 HydrophobicContact CG1-CG1 4.4Å; V82-V98 PolarHBondContact N-O 3.28Å; V82-V98 PolarHBondContact O-N 3.48Å; V82-I100 HydrophobicContact CG1-CD1 4.02Å; V82-N135 HydrophobicContact CG2-CB 4Å; V82-N135 WeakPolarHBondContact CG2-ND2 3.3Å; V82-L140 HydrophobicContact CG1-CD1 4.01Å; V82-L140 HydrophobicContact CG1-CD2 4Å; V82-L140 HydrophobicContact CG2-CD1 4.47Å
83	K	96.3	Very high	93.9	Very high	147 Å²	147	67.8 Å²	67.8	64%	0.639	32%	0.321	S	S	*	.			trans	-91.8	116.5	164.8	-66.5	-176.7	-179.1	178.3	0	107.5	E97 N135	K83-E97 HydrophobicContact CG-CG 4.38Å; K83-N135 PolarHBondContact O-ND2 2.8Å
84	P	96.7	Very high	93.9	Very high	17 Å²	17	67.8 Å²	67.8	11%	0.11	33%	0.325	C	S	.	.			trans	-55.6	143.3	174.4	-25.5	36.5	0	0	0	110.6	V82 F86 F88 V98 N135 L140	V82-P84 WeakPolarHBondContact O-CD 3.23Å; P84-F86 HydrophobicContact CB-CD1 4.31Å; P84-F86 HydrophobicContact CB-CD2 4.3Å; P84-F86 HydrophobicContact CB-CE1 4.02Å; P84-F86 HydrophobicContact CB-CE2 4.07Å; P84-F86 HydrophobicContact CB-CG 4.43Å; P84-F86 HydrophobicContact CB-CZ 3.93Å; P84-F86 PolarHBondContact O-N 3.08Å; P84-F86 VanDerWaalsContact O-N 3.15Å; P84-F88 HydrophobicContact CG-CE1 3.97Å; P84-V98 HydrophobicContact CG-CG2 3.83Å; P84-N135 WeakPolarHBondContact CA-OD1 3.48Å; P84-L140 HydrophobicContact CG-CD2 4.31Å
85	K	96.7	Very high	94	Very high	120 Å²	120	63.5 Å²	63.5	52%	0.522	31%	0.305	S	S	.	.	S	Bend	trans	-70.9	-1.9	177.1	-65.7	-179	-176.3	161.5	0	113.1	N135 E136 E137	K85-N135 WeakPolarHBondContact CD-O 3.29Å; K85-N135 WeakPolarHBondContact CE-O 3.45Å; K85-N135 PolarHBondContact N-OD1 3.18Å; K85-N135 PolarHBondContact NZ-O 3.34Å; K85-E136 IonicContact NZ-OE2 3.01Å; K85-E136 PolarHBondContact NZ-OE2 2.88Å; K85-E137 HydrophobicContact CB-CG 4.43Å; K85-E137 HydrophobicContact CD-CG 4.34Å
86	F	97	Very high	94.1	Very high	25 Å²	25	64.2 Å²	64.2	11%	0.11	31%	0.309	C	S	.	.	S	Bend	trans	-128.5	161.3	178.3	52.4	-89.1	0	0	0	110.8	P84 F88 E136 E137 L140 I163 P165	P84-F86 HydrophobicContact CB-CD1 4.31Å; P84-F86 HydrophobicContact CB-CD2 4.3Å; P84-F86 HydrophobicContact CB-CE1 4.02Å; P84-F86 HydrophobicContact CB-CE2 4.07Å; P84-F86 HydrophobicContact CB-CG 4.43Å; P84-F86 HydrophobicContact CB-CZ 3.93Å; P84-F86 PolarHBondContact O-N 3.08Å; P84-F86 VanDerWaalsContact O-N 3.15Å; F86-F88 HydrophobicContact CD2-CB 4.1Å; F86-F88 HydrophobicContact CD2-CD1 4.1Å; F86-F88 HydrophobicContact CD2-CG 4.45Å; F86-F88 HydrophobicContact CE2-CB 4.14Å; F86-F88 AromaticContact CE2-CD1 3.75Å; F86-F88 HydrophobicContact CE2-CD1 3.75Å; F86-F88 HydrophobicContact CE2-CG 4.1Å; F86-E136 WeakPolarHBondContact CD1-O 3.49Å; F86-E136 WeakPolarHBondContact CE1-O 3.24Å; F86-E137 WeakPolarHBondContact CD1-O 3.32Å; F86-L140 HydrophobicContact CE1-CB 4.31Å; F86-L140 HydrophobicContact CZ-CB 3.99Å; F86-I163 HydrophobicContact CE2-CG2 4.43Å; F86-I163 WeakPolarHBondContact CZ-O 2.96Å; F86-P165 HydrophobicContact CB-CB 4.21Å; F86-P165 HydrophobicContact CB-CG 3.93Å; F86-P165 HydrophobicContact CD1-CG 4.24Å; F86-P165 HydrophobicContact CD2-CB 4.09Å; F86-P165 HydrophobicContact CD2-CG 3.92Å; F86-P165 HydrophobicContact CG-CB 4.25Å; F86-P165 HydrophobicContact CG-CG 3.75Å
87	S	95	Very high	94.2	Very high	95 Å²	95	64.3 Å²	64.3	66%	0.664	31%	0.309	S	S	*	.			trans	-94	134.4	169.7	-66.3	0	0	0	0	109.7
88	F	96.1	Very high	94.5	Very high	5 Å²	5	55.1 Å²	55.1	2%	0.022	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	157.4	174.8	77.1	-74.3	0	0	0	110.8	P84 F86 F90 I95 V98 L108 I163 P165	P84-F88 HydrophobicContact CG-CE1 3.97Å; F86-F88 HydrophobicContact CD2-CB 4.1Å; F86-F88 HydrophobicContact CD2-CD1 4.1Å; F86-F88 HydrophobicContact CD2-CG 4.45Å; F86-F88 HydrophobicContact CE2-CB 4.14Å; F86-F88 AromaticContact CE2-CD1 3.75Å; F86-F88 HydrophobicContact CE2-CD1 3.75Å; F86-F88 HydrophobicContact CE2-CG 4.1Å; F88-F90 HydrophobicContact CE2-CB 4.36Å; F88-I95 HydrophobicContact CD1-CB 4.38Å; F88-I95 HydrophobicContact CE1-CB 3.66Å; F88-I95 HydrophobicContact CE1-CG1 4.44Å; F88-I95 HydrophobicContact CE1-CG2 3.76Å; F88-I95 HydrophobicContact CE2-CB 4.09Å; F88-I95 HydrophobicContact CE2-CG1 3.95Å; F88-I95 HydrophobicContact CZ-CB 3.52Å; F88-I95 HydrophobicContact CZ-CG1 3.83Å; F88-I95 HydrophobicContact CZ-CG2 3.58Å; F88-I95 PolarHBondContact O-N 3.18Å; F88-V98 HydrophobicContact CE1-CG2 4.46Å; F88-V98 HydrophobicContact CZ-CG2 4.39Å; F88-L108 HydrophobicContact CZ-CD2 4.24Å; F88-I163 HydrophobicContact CD1-CG2 4.39Å; F88-I163 HydrophobicContact CD2-CG2 3.75Å; F88-I163 HydrophobicContact CE1-CG2 4.22Å; F88-I163 HydrophobicContact CE2-CG2 3.53Å; F88-I163 HydrophobicContact CG-CG2 4.17Å; F88-I163 HydrophobicContact CZ-CD1 4.5Å; F88-I163 HydrophobicContact CZ-CG2 3.78Å; F88-P165 WeakPolarHBondContact CB-O 3.41Å
89	R	94.6	Very high	94.7	Very high	147 Å²	147	50.2 Å²	50.2	56%	0.555	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	142.9	173.8	-69.5	-180	174.6	-107.2	2.1	110.3	D92 T93 G167	R89-D92 PolarHBondContact NH1-O 3.24Å; R89-T93 CarbonylContact C-O 3.34Å; R89-T93 VanDerWaalsContact CA-O 3.29Å; R89-T93 WeakPolarHBondContact CA-O 3.44Å; R89-G167 WeakPolarHBondContact O-CA 3.14Å
90	F	95.9	Very high	94.9	Very high	1 Å²	1	48.2 Å²	48.2	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	120.1	167.2	-178.4	-109.4	0	0	0	107.5	Y56 F88 D92 T93 I95 L108 F116 I169 I189 D190	Y56-F90 WeakPolarHBondContact OH-CA 3.1Å; Y56-F90 WeakPolarHBondContact OH-CD2 3.33Å; F88-F90 HydrophobicContact CE2-CB 4.36Å; F90-D92 PolarHBondContact O-N 3.21Å; F90-T93 PolarHBondContact N-O 2.85Å; F90-T93 PolarHBondContact O-N 3.07Å; F90-T93 VanDerWaalsContact O-N 3.1Å; F90-I95 HydrophobicContact CB-CD1 4.05Å; F90-I95 HydrophobicContact CB-CG1 3.7Å; F90-L108 HydrophobicContact CB-CD1 3.85Å; F90-L108 HydrophobicContact CD1-CD1 3.7Å; F90-L108 HydrophobicContact CD2-CD1 3.54Å; F90-L108 HydrophobicContact CE1-CD1 4.04Å; F90-L108 HydrophobicContact CE2-CD1 3.9Å; F90-L108 HydrophobicContact CG-CD1 3.42Å; F90-L108 VanDerWaalsContact CG-CD1 3.42Å; F90-L108 HydrophobicContact CZ-CD1 4.12Å; F90-F116 AromaticContact CD1-CD1 3.95Å; F90-F116 HydrophobicContact CD1-CD1 3.95Å; F90-F116 AromaticContact CD1-CE1 3.96Å; F90-F116 HydrophobicContact CD1-CE1 3.96Å; F90-F116 WeakPolarHBondContact O-CE1 3.43Å; F90-I169 HydrophobicContact CD2-CD1 3.65Å; F90-I169 HydrophobicContact CE2-CD1 3.5Å; F90-I189 HydrophobicContact CE2-CB 4.15Å; F90-I189 HydrophobicContact CE2-CD1 4.1Å; F90-I189 HydrophobicContact CZ-CB 4.14Å; F90-D190 WeakPolarHBondContact CE1-O 3.43Å; F90-D190 WeakPolarHBondContact CZ-O 3.3Å
91	Y	92.6	Very high	94.8	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.008	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	-133.4	-156.5	-63.6	-104.7	0	0	0	109.2	Y54 N55 Y56 T93 T191 F193 H202	Y54-Y91 HydrophobicContact CD1-CD1 4.31Å; Y54-Y91 HydrophobicContact CD1-CE1 4.06Å; Y54-Y91 HydrophobicContact CE1-CD1 4.26Å; Y54-Y91 HydrophobicContact CE1-CE1 4.43Å; N55-Y91 HydrophobicContact CB-CD1 3.64Å; N55-Y91 HydrophobicContact CB-CE1 4.09Å; N55-Y91 HydrophobicContact CB-CG 4.46Å; Y56-Y91 HydrophobicContact CD2-CD1 4.32Å; Y56-Y91 AromaticContact CD2-CE1 3.96Å; Y56-Y91 HydrophobicContact CD2-CE1 3.96Å; Y56-Y91 HydrophobicContact CD2-CE2 4.15Å; Y56-Y91 AromaticContact CD2-CZ 3.85Å; Y56-Y91 AromaticContact CE2-CD1 3.97Å; Y56-Y91 HydrophobicContact CE2-CD1 3.97Å; Y56-Y91 AromaticContact CE2-CD2 3.57Å; Y56-Y91 HydrophobicContact CE2-CD2 3.57Å; Y56-Y91 AromaticContact CE2-CE1 3.93Å; Y56-Y91 HydrophobicContact CE2-CE1 3.93Å; Y56-Y91 AromaticContact CE2-CE2 3.51Å; Y56-Y91 HydrophobicContact CE2-CE2 3.51Å; Y56-Y91 AromaticContact CE2-CG 3.78Å; Y56-Y91 HydrophobicContact CE2-CG 3.78Å; Y56-Y91 AromaticContact CE2-CZ 3.69Å; Y56-Y91 PolarHBondContact OH-N 3.47Å; Y91-T93 VanDerWaalsContact C-N 3.3Å; Y91-T93 PolarHBondContact O-N 3.39Å; Y91-T191 HydrophobicContact CD1-CG2 4.35Å; Y91-T191 HydrophobicContact CD2-CG2 3.98Å; Y91-T191 HydrophobicContact CE1-CG2 3.95Å; Y91-T191 HydrophobicContact CE2-CG2 3.55Å; Y91-T191 HydrophobicContact CG-CG2 4.39Å; Y91-F193 AromaticContact CD1-CZ 3.81Å; Y91-F193 HydrophobicContact CD1-CZ 3.81Å; Y91-F193 HydrophobicContact CE1-CZ 4.11Å; Y91-F193 HydrophobicContact CG-CZ 4.31Å; Y91-H202 AromaticContact CE1-CE1 3.95Å; Y91-H202 AromaticContact CE1-ND1 3.5Å; Y91-H202 AromaticContact CZ-ND1 3.51Å; Y91-H202 PolarHBondContact OH-CE1 3.16Å; Y91-H202 VanDerWaalsContact OH-CE1 3.31Å; Y91-H202 PolarHBondContact OH-ND1 3.15Å
92	D	88.5	Confident	94	Very high	83 Å²	83	49 Å²	49	44%	0.444	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	11.4	179.7	-59.6	-51.6	0	0	0	113.3	N55 R89 F90	N55-D92 PolarHBondContact ND2-OD2 2.96Å; R89-D92 PolarHBondContact NH1-O 3.24Å; F90-D92 PolarHBondContact O-N 3.21Å
93	T	92	Very high	93.2	Very high	25 Å²	25	52.9 Å²	52.9	15%	0.153	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	130	-171.5	-65.9	0	0	0	0	112.1	R89 F90 Y91 I95 R110 F116	R89-T93 CarbonylContact C-O 3.34Å; R89-T93 VanDerWaalsContact CA-O 3.29Å; R89-T93 WeakPolarHBondContact CA-O 3.44Å; F90-T93 PolarHBondContact N-O 2.85Å; F90-T93 PolarHBondContact O-N 3.07Å; F90-T93 VanDerWaalsContact O-N 3.1Å; Y91-T93 VanDerWaalsContact C-N 3.3Å; Y91-T93 PolarHBondContact O-N 3.39Å; T93-I95 HydrophobicContact CG2-CD1 4.32Å; T93-I95 PolarHBondContact O-N 3.06Å; T93-R110 HydrophobicContact CG2-CG 3.47Å; T93-R110 VanDerWaalsContact CG2-CG 3.47Å; T93-F116 VanDerWaalsContact CB-CE1 3.45Å; T93-F116 HydrophobicContact CG2-CD1 3.91Å; T93-F116 HydrophobicContact CG2-CD2 4.31Å; T93-F116 HydrophobicContact CG2-CE1 4.01Å; T93-F116 HydrophobicContact CG2-CE2 4.39Å; T93-F116 HydrophobicContact CG2-CG 4.07Å; T93-F116 HydrophobicContact CG2-CZ 4.25Å; T93-F116 WeakPolarHBondContact OG1-CZ 3.35Å
94	L	94.6	Very high	92.4	Very high	66 Å²	66	45.9 Å²	45.9	35%	0.346	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	127	171.6	-176.3	65.8	0	0	0	110.2
95	I	96.2	Very high	92.1	Very high	5 Å²	5	46.6 Å²	46.6	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	131.3	177.2	-57.3	-55	0	0	0	109.1	F88 F90 T93 V98 L108 F116	F88-I95 HydrophobicContact CD1-CB 4.38Å; F88-I95 HydrophobicContact CE1-CB 3.66Å; F88-I95 HydrophobicContact CE1-CG1 4.44Å; F88-I95 HydrophobicContact CE1-CG2 3.76Å; F88-I95 HydrophobicContact CE2-CB 4.09Å; F88-I95 HydrophobicContact CE2-CG1 3.95Å; F88-I95 HydrophobicContact CZ-CB 3.52Å; F88-I95 HydrophobicContact CZ-CG1 3.83Å; F88-I95 HydrophobicContact CZ-CG2 3.58Å; F88-I95 PolarHBondContact O-N 3.18Å; F90-I95 HydrophobicContact CB-CD1 4.05Å; F90-I95 HydrophobicContact CB-CG1 3.7Å; T93-I95 HydrophobicContact CG2-CD1 4.32Å; T93-I95 PolarHBondContact O-N 3.06Å; I95-V98 HydrophobicContact CG2-CG2 4.21Å; I95-L108 HydrophobicContact CD1-CB 3.89Å; I95-L108 HydrophobicContact CG1-CB 4.18Å; I95-L108 HydrophobicContact CG2-CB 4.1Å; I95-F116 HydrophobicContact CD1-CD1 4.13Å
96	H	94.5	Very high	92.1	Very high	108 Å²	108	41 Å²	41	50%	0.5	20%	0.195	S	C	.	.			trans	-106.8	-31.1	-177.1	-74.7	-81.3	0	0	0	113.1	T109 R110	H96-T109 PolarHBondContact N-O 3.44Å; H96-R110 PolarHBondContact CD2-O 2.9Å
97	E	95.4	Very high	92.1	Very high	22 Å²	22	44.2 Å²	44.2	10%	0.103	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	142.1	-176.5	-171	174.5	112.2	0	0	109.7	F81 K83 T109 R112	F81-E97 HydrophobicContact CB-CG 4.5Å; F81-E97 HydrophobicContact CD1-CG 4.38Å; F81-E97 WeakPolarHBondContact CD1-OE1 3.16Å; K83-E97 HydrophobicContact CG-CG 4.38Å; E97-T109 WeakPolarHBondContact CB-OG1 3.31Å; E97-T109 PolarHBondContact N-O 3.36Å; E97-T109 WeakPolarHBondContact O-CB 3.48Å; E97-T109 PolarHBondContact O-N 3.44Å; E97-T109 PolarHBondContact O-OG1 2.82Å; E97-R112 WeakPolarHBondContact OE1-CG 3.37Å
98	V	96.7	Very high	92.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131.4	-179.3	177.7	0	0	0	0	108.3	F81 V82 P84 F88 I95 I100 I106 R107 L108 L140	F81-V98 WeakPolarHBondContact CA-O 3.36Å; V82-V98 HydrophobicContact CG1-CB 3.92Å; V82-V98 HydrophobicContact CG1-CG1 4.4Å; V82-V98 PolarHBondContact N-O 3.28Å; V82-V98 PolarHBondContact O-N 3.48Å; P84-V98 HydrophobicContact CG-CG2 3.83Å; F88-V98 HydrophobicContact CE1-CG2 4.46Å; F88-V98 HydrophobicContact CZ-CG2 4.39Å; I95-V98 HydrophobicContact CG2-CG2 4.21Å; V98-I100 HydrophobicContact CG1-CG1 4.16Å; V98-I106 HydrophobicContact CG1-CG2 3.32Å; V98-R107 WeakPolarHBondContact CA-O 3.26Å; V98-L108 HydrophobicContact CG1-CD2 4.13Å; V98-L108 HydrophobicContact CG2-CD2 3.83Å; V98-L140 HydrophobicContact CB-CD2 4Å; V98-L140 HydrophobicContact CG1-CD2 3.91Å; V98-L140 HydrophobicContact CG2-CD2 3.98Å
99	C	95.8	Very high	92.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	110	175.1	-178.7	0	0	0	0	109.4	F81 Y101 R107	F81-C99 HydrophobicContact CD1-CB 3.76Å; F81-C99 HydrophobicContact CE1-CB 3.6Å; F81-C99 HydrophobicContact CG-CB 4.46Å; F81-C99 HydrophobicContact CZ-CB 4.16Å; F81-C99 VanDerWaalsContact CZ-SG 3.52Å; C99-Y101 HydrophobicContact CB-CE2 4.1Å; C99-Y101 WeakPolarHBondContact SG-CE2 3.46Å; C99-R107 HydrophobicContact CB-CB 4.35Å; C99-R107 PolarHBondContact N-O 2.73Å; C99-R107 PolarHBondContact O-N 2.84Å
100	I	95.7	Very high	92.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	109.4	178.4	-58.8	168.7	0	0	0	107.3	I76 S79 Y80 V82 V98 T131 V133 V142	I76-I100 HydrophobicContact CD1-CB 4.31Å; I76-I100 HydrophobicContact CD1-CG2 3.84Å; S79-I100 VanDerWaalsContact CA-O 3.31Å; S79-I100 WeakPolarHBondContact CA-O 3.41Å; Y80-I100 HydrophobicContact CD1-CD1 4.35Å; Y80-I100 PolarHBondContact N-O 3.17Å; Y80-I100 PolarHBondContact O-N 2.92Å; V82-I100 HydrophobicContact CG1-CD1 4.02Å; V98-I100 HydrophobicContact CG1-CG1 4.16Å; I100-T131 HydrophobicContact CG2-CG2 3.98Å; I100-V133 HydrophobicContact CD1-CB 4.27Å; I100-V133 HydrophobicContact CD1-CG1 3.58Å; I100-V133 HydrophobicContact CD1-CG2 3.6Å; I100-V133 HydrophobicContact CG2-CG2 4.39Å; I100-V142 HydrophobicContact CD1-CG2 3.52Å; I100-V142 HydrophobicContact CG1-CG2 4.01Å; I100-V142 HydrophobicContact CG2-CG1 3.83Å; I100-V142 HydrophobicContact CG2-CG2 4.35Å
101	Y	91.1	Very high	91.7	Very high	46 Å²	46	44.2 Å²	44.2	18%	0.18	20%	0.196	C	C	.	.			trans	-83.9	150.5	174.7	-76.8	-95.7	0	0	0	110.8	S79 C99 F103 N105 R107 Y115 R144	S79-Y101 WeakPolarHBondContact OG-CD1 3.06Å; C99-Y101 HydrophobicContact CB-CE2 4.1Å; C99-Y101 WeakPolarHBondContact SG-CE2 3.46Å; Y101-F103 VanDerWaalsContact C-N 3.34Å; Y101-F103 PolarHBondContact O-N 3.5Å; Y101-N105 WeakPolarHBondContact CB-O 3.49Å; Y101-N105 PolarHBondContact N-O 3.09Å; Y101-R107 HydrophobicContact CD2-CG 3.85Å; Y101-R107 HydrophobicContact CE2-CB 4.19Å; Y101-R107 HydrophobicContact CE2-CG 3.6Å; Y101-R107 VanDerWaalsContact CZ-NH1 3.25Å; Y101-R107 PolarHBondContact OH-NH1 3.38Å; Y101-Y115 PolarHBondContact OH-OH 2.62Å; Y101-Y115 VanDerWaalsContact OH-OH 3.06Å; Y101-R144 PolarHBondContact O-NH2 3.41Å
102	Y	76.8	Confident	91.2	Very high	110 Å²	110	51.4 Å²	51.4	43%	0.431	22%	0.223	S	C	.	.	S	Bend	trans	-68.6	-29	-177.5	70.4	-80.1	0	0	0	113.3	G104 C129	Y102-G104 VanDerWaalsContact C-N 3.35Å; Y102-G104 PolarHBondContact O-N 2.91Å; Y102-C129 WeakPolarHBondContact O-CB 3.4Å; Y102-C129 PolarHBondContact O-SG 3.47Å
103	F	78.8	Confident	90.9	Very high	86 Å²	86	53.8 Å²	53.8	38%	0.377	23%	0.227	S	C	.	.	S	Bend	trans	-91.3	50.9	174.6	-65.5	-53.5	0	0	0	113.4	Y101 N105 I126	Y101-F103 VanDerWaalsContact C-N 3.34Å; Y101-F103 PolarHBondContact O-N 3.5Å; F103-N105 VanDerWaalsContact C-N 3.26Å; F103-N105 PolarHBondContact O-N 3.43Å; F103-N105 PolarHBondContact O-ND2 2.92Å; F103-I126 HydrophobicContact CD1-CG2 4.2Å; F103-I126 HydrophobicContact CE1-CG2 4.44Å
104	G	79.4	Confident	90.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	23%	0.23	C	C	.	.	S	Bend	trans	80.2	-9.2	166.4	0	0	0	0	0	118.1	Y102 R144	Y102-G104 VanDerWaalsContact C-N 3.35Å; Y102-G104 PolarHBondContact O-N 2.91Å; G104-R144 VanDerWaalsContact C-CZ 3.48Å; G104-R144 PolarHBondContact O-NH1 3.19Å; G104-R144 VanDerWaalsContact O-NH1 3.12Å
105	N	91.4	Very high	90.7	Very high	32 Å²	32	55.5 Å²	55.5	17%	0.171	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	135.2	-177.9	-70.6	-108.1	0	0	0	111.1	Y101 F103 F122 R144	Y101-N105 WeakPolarHBondContact CB-O 3.49Å; Y101-N105 PolarHBondContact N-O 3.09Å; F103-N105 VanDerWaalsContact C-N 3.26Å; F103-N105 PolarHBondContact O-N 3.43Å; F103-N105 PolarHBondContact O-ND2 2.92Å; N105-F122 WeakPolarHBondContact ND2-CE1 2.93Å; N105-R144 PolarHBondContact O-NH2 3.12Å
106	I	96.8	Very high	90.6	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	113	169.3	-58.6	172.9	0	0	0	107	V98 L108 G118 V119 V142 I163	V98-I106 HydrophobicContact CG1-CG2 3.32Å; I106-L108 HydrophobicContact CG2-CD2 4.21Å; I106-G118 CarbonylContact O-C 3.6Å; I106-G118 WeakPolarHBondContact O-CA 3.33Å; I106-V119 HydrophobicContact CB-CB 4.2Å; I106-V119 PolarHBondContact N-O 2.97Å; I106-V119 PolarHBondContact O-N 2.91Å; I106-V142 HydrophobicContact CD1-CB 3.86Å; I106-V142 HydrophobicContact CD1-CG1 4.32Å; I106-V142 HydrophobicContact CD1-CG2 3.7Å; I106-V142 HydrophobicContact CG1-CG2 4.4Å; I106-I163 HydrophobicContact CG2-CD1 4.4Å
107	R	96.5	Very high	90.7	Very high	94 Å²	94	50.9 Å²	50.9	36%	0.355	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	130.8	179.6	-58.6	-165.8	-175.8	155.1	-4.2	111.1	V98 C99 Y101 Y115	V98-R107 WeakPolarHBondContact CA-O 3.26Å; C99-R107 HydrophobicContact CB-CB 4.35Å; C99-R107 PolarHBondContact N-O 2.73Å; C99-R107 PolarHBondContact O-N 2.84Å; Y101-R107 HydrophobicContact CD2-CG 3.85Å; Y101-R107 HydrophobicContact CE2-CB 4.19Å; Y101-R107 HydrophobicContact CE2-CG 3.6Å; Y101-R107 VanDerWaalsContact CZ-NH1 3.25Å; Y101-R107 PolarHBondContact OH-NH1 3.38Å; R107-Y115 HydrophobicContact CB-CD1 3.68Å; R107-Y115 HydrophobicContact CB-CE1 3.98Å; R107-Y115 HydrophobicContact CG-CD1 4.25Å; R107-Y115 HydrophobicContact CG-CE1 4.43Å
108	L	97.1	Very high	90.7	Very high	0 Å²	0	50 Å²	50	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	127.1	-179.9	-51.6	-177.5	0	0	0	109.3	F88 F90 I95 V98 I106 F116 G117 I163	F88-L108 HydrophobicContact CZ-CD2 4.24Å; F90-L108 HydrophobicContact CB-CD1 3.85Å; F90-L108 HydrophobicContact CD1-CD1 3.7Å; F90-L108 HydrophobicContact CD2-CD1 3.54Å; F90-L108 HydrophobicContact CE1-CD1 4.04Å; F90-L108 HydrophobicContact CE2-CD1 3.9Å; F90-L108 HydrophobicContact CG-CD1 3.42Å; F90-L108 VanDerWaalsContact CG-CD1 3.42Å; F90-L108 HydrophobicContact CZ-CD1 4.12Å; I95-L108 HydrophobicContact CD1-CB 3.89Å; I95-L108 HydrophobicContact CG1-CB 4.18Å; I95-L108 HydrophobicContact CG2-CB 4.1Å; V98-L108 HydrophobicContact CG1-CD2 4.13Å; V98-L108 HydrophobicContact CG2-CD2 3.83Å; I106-L108 HydrophobicContact CG2-CD2 4.21Å; L108-F116 PolarHBondContact O-N 2.79Å; L108-G117 PolarHBondContact N-O 2.77Å; L108-G117 PolarHBondContact O-N 3.09Å; L108-I163 HydrophobicContact CD2-CD1 3.86Å
109	T	95.4	Very high	90.8	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	139.1	-172.9	75	0	0	0	0	112.4	H96 E97 K111 D114 Y115	H96-T109 PolarHBondContact N-O 3.44Å; E97-T109 WeakPolarHBondContact CB-OG1 3.31Å; E97-T109 PolarHBondContact N-O 3.36Å; E97-T109 WeakPolarHBondContact O-CB 3.48Å; E97-T109 PolarHBondContact O-N 3.44Å; E97-T109 PolarHBondContact O-OG1 2.82Å; T109-K111 VanDerWaalsContact C-N 3.31Å; T109-K111 VanDerWaalsContact CB-O 3.3Å; T109-K111 WeakPolarHBondContact CB-O 3.28Å; T109-K111 PolarHBondContact OG1-O 2.84Å; T109-D114 VanDerWaalsContact CA-O 3.23Å; T109-D114 WeakPolarHBondContact CA-O 3.3Å; T109-D114 WeakPolarHBondContact CB-O 3.28Å; T109-Y115 HydrophobicContact CG2-CD1 3.6Å; T109-Y115 HydrophobicContact CG2-CE1 3.94Å; T109-Y115 HydrophobicContact CG2-CG 4.41Å
110	R	92.7	Very high	90.8	Very high	107 Å²	107	51.2 Å²	51.2	40%	0.404	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	-29.3	173.4	-68.6	-179.8	-63.1	-143.9	-6.3	111.8	T93 H96 D114 F116	T93-R110 HydrophobicContact CG2-CG 3.47Å; T93-R110 VanDerWaalsContact CG2-CG 3.47Å; H96-R110 PolarHBondContact CD2-O 2.9Å; R110-D114 IonicContact CZ-OD1 3.13Å; R110-D114 IonicContact CZ-OD2 3.93Å; R110-D114 PolarHBondContact N-O 2.81Å; R110-D114 IonicContact NE-OD1 3.84Å; R110-D114 IonicContact NE-OD2 3.3Å; R110-D114 PolarHBondContact NE-OD2 3.03Å; R110-D114 VanDerWaalsContact NH2-CG 3.35Å; R110-D114 IonicContact NH2-OD1 3.91Å; R110-D114 PolarHBondContact NH2-OD1 3.35Å; R110-D114 IonicContact NH2-OD2 2.67Å; R110-D114 PolarHBondContact NH2-OD2 3.46Å; R110-F116 HydrophobicContact CG-CB 4.08Å; R110-F116 HydrophobicContact CG-CG 4.42Å
111	K	87	Confident	90.8	Very high	140 Å²	140	51.2 Å²	51.2	61%	0.609	21%	0.214	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-157.5	165	172	56.5	-179.3	178.1	-177.7	0	106.4	T109 Y113 D114	T109-K111 VanDerWaalsContact C-N 3.31Å; T109-K111 VanDerWaalsContact CB-O 3.3Å; T109-K111 WeakPolarHBondContact CB-O 3.28Å; T109-K111 PolarHBondContact OG1-O 2.84Å; K111-Y113 PolarHBondContact O-N 3.34Å; K111-D114 HydrophobicContact CD-CB 4.32Å; K111-D114 HydrophobicContact CG-CB 3.41Å; K111-D114 VanDerWaalsContact CG-CB 3.41Å; K111-D114 WeakPolarHBondContact O-CB 3.42Å; K111-D114 PolarHBondContact O-N 3.43Å
112	R	82.2	Confident	90.9	Very high	153 Å²	153	50.3 Å²	50.3	58%	0.577	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47.9	125.7	180	-165.4	177.3	175.8	162.9	0.1	111.3	E97 D114	E97-R112 WeakPolarHBondContact OE1-CG 3.37Å; R112-D114 PolarHBondContact O-N 2.86Å
113	Y	82.5	Confident	91.5	Very high	133 Å²	133	45.2 Å²	45.2	52%	0.522	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	1.1	-176.3	-48.4	-64	0	0	0	117.4	F81 K111 Y115	F81-Y113 HydrophobicContact CE1-CE1 4.29Å; F81-Y113 HydrophobicContact CZ-CD1 4.33Å; F81-Y113 AromaticContact CZ-CE1 3.78Å; F81-Y113 HydrophobicContact CZ-CE1 3.78Å; K111-Y113 PolarHBondContact O-N 3.34Å; Y113-Y115 WeakPolarHBondContact O-CD2 3.49Å; Y113-Y115 PolarHBondContact O-N 3.4Å
114	D	90.6	Very high	91.9	Very high	42 Å²	42	45.4 Å²	45.4	23%	0.225	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	81.1	171.8	-176.9	19.2	0	0	0	110.2	T109 R110 K111 R112 F116	T109-D114 VanDerWaalsContact CA-O 3.23Å; T109-D114 WeakPolarHBondContact CA-O 3.3Å; T109-D114 WeakPolarHBondContact CB-O 3.28Å; R110-D114 IonicContact CZ-OD1 3.13Å; R110-D114 IonicContact CZ-OD2 3.93Å; R110-D114 PolarHBondContact N-O 2.81Å; R110-D114 IonicContact NE-OD1 3.84Å; R110-D114 IonicContact NE-OD2 3.3Å; R110-D114 PolarHBondContact NE-OD2 3.03Å; R110-D114 VanDerWaalsContact NH2-CG 3.35Å; R110-D114 IonicContact NH2-OD1 3.91Å; R110-D114 PolarHBondContact NH2-OD1 3.35Å; R110-D114 IonicContact NH2-OD2 2.67Å; R110-D114 PolarHBondContact NH2-OD2 3.46Å; K111-D114 HydrophobicContact CD-CB 4.32Å; K111-D114 HydrophobicContact CG-CB 3.41Å; K111-D114 VanDerWaalsContact CG-CB 3.41Å; K111-D114 WeakPolarHBondContact O-CB 3.42Å; K111-D114 PolarHBondContact O-N 3.43Å; R112-D114 PolarHBondContact O-N 2.86Å; D114-F116 PolarHBondContact O-N 2.03Å
115	Y	91.8	Very high	92.3	Very high	85 Å²	85	50.1 Å²	50.1	33%	0.333	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	122	-179.1	-55.4	-74.8	0	0	0	111.2	Y101 R107 T109 Y113	Y101-Y115 PolarHBondContact OH-OH 2.62Å; Y101-Y115 VanDerWaalsContact OH-OH 3.06Å; R107-Y115 HydrophobicContact CB-CD1 3.68Å; R107-Y115 HydrophobicContact CB-CE1 3.98Å; R107-Y115 HydrophobicContact CG-CD1 4.25Å; R107-Y115 HydrophobicContact CG-CE1 4.43Å; T109-Y115 HydrophobicContact CG2-CD1 3.6Å; T109-Y115 HydrophobicContact CG2-CE1 3.94Å; T109-Y115 HydrophobicContact CG2-CG 4.41Å; Y113-Y115 WeakPolarHBondContact O-CD2 3.49Å; Y113-Y115 PolarHBondContact O-N 3.4Å
116	F	94.1	Very high	92.3	Very high	6 Å²	6	49.9 Å²	49.9	3%	0.026	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-42.3	179.6	178.4	-111	0	0	0	112.1	F90 T93 I95 L108 R110 D114 T191 K192 F193	F90-F116 AromaticContact CD1-CD1 3.95Å; F90-F116 HydrophobicContact CD1-CD1 3.95Å; F90-F116 AromaticContact CD1-CE1 3.96Å; F90-F116 HydrophobicContact CD1-CE1 3.96Å; F90-F116 WeakPolarHBondContact O-CE1 3.43Å; T93-F116 VanDerWaalsContact CB-CE1 3.45Å; T93-F116 HydrophobicContact CG2-CD1 3.91Å; T93-F116 HydrophobicContact CG2-CD2 4.31Å; T93-F116 HydrophobicContact CG2-CE1 4.01Å; T93-F116 HydrophobicContact CG2-CE2 4.39Å; T93-F116 HydrophobicContact CG2-CG 4.07Å; T93-F116 HydrophobicContact CG2-CZ 4.25Å; T93-F116 WeakPolarHBondContact OG1-CZ 3.35Å; I95-F116 HydrophobicContact CD1-CD1 4.13Å; L108-F116 PolarHBondContact O-N 2.79Å; R110-F116 HydrophobicContact CG-CB 4.08Å; R110-F116 HydrophobicContact CG-CG 4.42Å; D114-F116 PolarHBondContact O-N 2.03Å; F116-T191 PolarHBondContact O-OG1 2.8Å; F116-T191 VanDerWaalsContact O-OG1 3.12Å; F116-K192 PolarHBondContact O-N 3.31Å; F116-K192 VanDerWaalsContact O-N 3.09Å; F116-F193 HydrophobicContact CZ-CE1 4.28Å
117	G	96	Very high	92	Very high	10 Å²	10	55.1 Å²	55.1	10%	0.103	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.1	-165.3	178.3	0	0	0	0	0	111.8	L108 D190	L108-G117 PolarHBondContact N-O 2.77Å; L108-G117 PolarHBondContact O-N 3.09Å; G117-D190 CarbonylContact C-O 3.56Å; G117-D190 WeakPolarHBondContact CA-O 2.97Å
118	G	96.9	Very high	91.9	Very high	4 Å²	4	57.1 Å²	57.1	4%	0.041	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	167.6	-173.8	0	0	0	0	0	114.8	I106 I189 D190	I106-G118 CarbonylContact O-C 3.6Å; I106-G118 WeakPolarHBondContact O-CA 3.33Å; G118-I189 WeakPolarHBondContact O-CA 3.12Å; G118-D190 WeakPolarHBondContact CA-OD1 3.45Å; G118-D190 PolarHBondContact N-O 2.9Å; G118-D190 PolarHBondContact N-OD1 3Å; G118-D190 PolarHBondContact O-N 2.89Å
119	V	97.9	Very high	91.7	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.012	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	120.7	167.3	-174.9	0	0	0	0	106.3	I106 I169 L171 I189	I106-V119 HydrophobicContact CB-CB 4.2Å; I106-V119 PolarHBondContact N-O 2.97Å; I106-V119 PolarHBondContact O-N 2.91Å; V119-I169 HydrophobicContact CG1-CG2 3.98Å; V119-I169 HydrophobicContact CG2-CD1 3.84Å; V119-I169 HydrophobicContact CG2-CG1 4.49Å; V119-I169 HydrophobicContact CG2-CG2 4Å; V119-L171 HydrophobicContact CG1-CD2 3.51Å; V119-I189 HydrophobicContact CG1-CG2 4.35Å; V119-I189 HydrophobicContact CG2-CG2 4.11Å
120	E	96	Very high	91.6	Very high	23 Å²	23	61.9 Å²	61.9	11%	0.107	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	130.7	178.9	-66.7	-177.3	-152.4	0	0	107.9	F122 I186 S187 K188	E120-F122 HydrophobicContact CB-CD1 4.23Å; E120-F122 HydrophobicContact CB-CE1 3.93Å; E120-F122 HydrophobicContact CG-CE1 4.17Å; E120-I186 HydrophobicContact CB-CG2 4.35Å; E120-I186 VanDerWaalsContact OE2-CG2 3.24Å; E120-I186 WeakPolarHBondContact OE2-CG2 3.46Å; E120-S187 CarbonylContact O-C 3.52Å; E120-S187 VanDerWaalsContact O-CA 3.26Å; E120-S187 WeakPolarHBondContact O-CA 3.37Å; E120-K188 HydrophobicContact CB-CG 3.98Å; E120-K188 VanDerWaalsContact CD-CE 3.44Å; E120-K188 HydrophobicContact CG-CG 4.45Å; E120-K188 PolarHBondContact N-O 3.28Å; E120-K188 PolarHBondContact O-N 2.9Å; E120-K188 WeakPolarHBondContact OE2-CE 3.28Å; E120-K188 IonicContact OE2-NZ 2.8Å
121	N	95.2	Very high	91.7	Very high	0 Å²	0	57 Å²	57	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	86	173.3	-165.7	18.2	0	0	0	110.3	L171 F173 W185 I186 S187	N121-L171 HydrophobicContact CB-CD2 4.41Å; N121-F173 VanDerWaalsContact OD1-CE1 3.3Å; N121-F173 WeakPolarHBondContact OD1-CE1 3.45Å; N121-W185 PolarHBondContact OD1-NE1 2.95Å; N121-I186 CarbonylContact C-O 3.51Å; N121-I186 VanDerWaalsContact CA-O 3.31Å; N121-I186 WeakPolarHBondContact CA-O 3.43Å; N121-S187 WeakPolarHBondContact OD1-CB 3.45Å; N121-S187 PolarHBondContact OD1-OG 3.42Å
122	F	93.4	Very high	92.1	Very high	28 Å²	28	52.4 Å²	52.4	12%	0.123	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	153.8	-171.9	69.8	-84.2	0	0	0	112.9	N105 E120 I126 F146 I186	N105-F122 WeakPolarHBondContact ND2-CE1 2.93Å; E120-F122 HydrophobicContact CB-CD1 4.23Å; E120-F122 HydrophobicContact CB-CE1 3.93Å; E120-F122 HydrophobicContact CG-CE1 4.17Å; F122-I126 HydrophobicContact CB-CD1 3.99Å; F122-I126 HydrophobicContact CD2-CD1 3.87Å; F122-I126 HydrophobicContact CG-CD1 4.39Å; F122-F146 HydrophobicContact CB-CE1 4.14Å; F122-F146 HydrophobicContact CB-CZ 4.08Å; F122-I186 HydrophobicContact CE1-CB 4.17Å; F122-I186 HydrophobicContact CE1-CG2 4.18Å; F122-I186 HydrophobicContact CE2-CD1 4.18Å; F122-I186 HydrophobicContact CZ-CB 4.16Å; F122-I186 HydrophobicContact CZ-CD1 3.94Å; F122-I186 HydrophobicContact CZ-CG2 4.37Å; F122-I186 PolarHBondContact N-O 3.34Å; F122-I186 PolarHBondContact O-N 2.89Å
123	A	89.5	Confident	92.7	Very high	2 Å²	2	45.1 Å²	45.1	2%	0.017	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	158.8	172.5	0	0	0	0	0	112.4	I126 I148 E184 W185	A123-I126 HydrophobicContact CB-CG1 4.5Å; A123-I126 WeakPolarHBondContact O-CD1 3.48Å; A123-I126 VanDerWaalsContact O-CG1 3.31Å; A123-I126 WeakPolarHBondContact O-CG1 3.14Å; A123-I148 HydrophobicContact CB-CD1 4.13Å; A123-I148 HydrophobicContact CB-CG2 3.82Å; A123-E184 CarbonylContact C-O 3.54Å; A123-W185 HydrophobicContact CB-CD2 4.34Å; A123-W185 HydrophobicContact CB-CE3 3.62Å; A123-W185 HydrophobicContact CB-CH2 4.37Å; A123-W185 HydrophobicContact CB-CZ3 3.66Å
124	Q	87.6	Confident	93.4	Very high	91 Å²	91	38.8 Å²	38.8	43%	0.425	19%	0.191	S	C	.	.	S	Bend	trans	-69.9	162.8	158.9	-66.6	178	25	0	0	109.9	I126 E184 I186	Q124-I126 PolarHBondContact O-N 3.34Å; Q124-E184 WeakPolarHBondContact CB-O 3.37Å; Q124-E184 VanDerWaalsContact CG-O 3.32Å; Q124-E184 WeakPolarHBondContact CG-O 3.11Å; Q124-E184 PolarHBondContact N-O 2.78Å; Q124-I186 HydrophobicContact CG-CD1 4.38Å
125	N	87.6	Confident	93.7	Very high	98 Å²	98	38.2 Å²	38.2	52%	0.524	19%	0.188	S	C	.	.	S	Bend	trans	57.2	40.3	175.3	-52.3	-32.2	0	0	0	115.6	Q127 T149	N125-Q127 PolarHBondContact O-N 2.87Å; N125-T149 PolarHBondContact O-N 3.46Å
126	I	90.9	Very high	93.9	Very high	27 Å²	27	37 Å²	37	14%	0.138	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	123.2	173.7	-63.9	162	0	0	0	110.2	F103 F122 A123 Q124 E128 C129 F146 I148	F103-I126 HydrophobicContact CD1-CG2 4.2Å; F103-I126 HydrophobicContact CE1-CG2 4.44Å; F122-I126 HydrophobicContact CB-CD1 3.99Å; F122-I126 HydrophobicContact CD2-CD1 3.87Å; F122-I126 HydrophobicContact CG-CD1 4.39Å; A123-I126 HydrophobicContact CB-CG1 4.5Å; A123-I126 WeakPolarHBondContact O-CD1 3.48Å; A123-I126 VanDerWaalsContact O-CG1 3.31Å; A123-I126 WeakPolarHBondContact O-CG1 3.14Å; Q124-I126 PolarHBondContact O-N 3.34Å; I126-E128 WeakPolarHBondContact CG2-O 3.38Å; I126-C129 HydrophobicContact CG2-CB 4.09Å; I126-F146 HydrophobicContact CD1-CD1 3.85Å; I126-F146 HydrophobicContact CD1-CE1 3.91Å; I126-F146 HydrophobicContact CG1-CD1 4.07Å; I126-F146 HydrophobicContact CG2-CD1 4.2Å; I126-I148 HydrophobicContact CG1-CG2 4.07Å
127	Q	92.4	Very high	93.9	Very high	113 Å²	113	43.9 Å²	43.9	53%	0.528	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-49	171	-61.4	-57.3	-26.7	0	0	111	N125 V147 T149	N125-Q127 PolarHBondContact O-N 2.87Å; Q127-V147 PolarHBondContact N-O 2.96Å; Q127-T149 WeakPolarHBondContact CG-OG1 3.46Å; Q127-T149 PolarHBondContact NE2-OG1 2.87Å
128	E	92.8	Very high	93.9	Very high	136 Å²	136	50.7 Å²	50.7	64%	0.636	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-134	145.2	179.9	-57.2	-171.4	168.6	0	0	110.4	I126 F146 V147	I126-E128 WeakPolarHBondContact CG2-O 3.38Å; E128-F146 CarbonylContact O-C 3.52Å; E128-F146 WeakPolarHBondContact O-CA 3.43Å; E128-V147 HydrophobicContact CB-CB 4.03Å; E128-V147 HydrophobicContact CB-CG2 4.17Å; E128-V147 PolarHBondContact N-O 2.58Å; E128-V147 PolarHBondContact O-N 2.76Å
129	C	93.4	Very high	93.8	Very high	32 Å²	32	51.3 Å²	51.3	22%	0.216	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	115.3	172	-175.9	0	0	0	0	110	Y102 I126 N145 F146	Y102-C129 WeakPolarHBondContact O-CB 3.4Å; Y102-C129 PolarHBondContact O-SG 3.47Å; I126-C129 HydrophobicContact CG2-CB 4.09Å; C129-N145 CarbonylContact C-O 3.57Å; C129-N145 WeakPolarHBondContact CA-O 3.26Å; C129-F146 HydrophobicContact CB-CD1 3.92Å; C129-F146 HydrophobicContact CB-CE1 4.27Å; C129-F146 VanDerWaalsContact SG-CD1 3.53Å; C129-F146 WeakPolarHBondContact SG-CE1 3.21Å
130	E	94.2	Very high	93.8	Very high	68 Å²	68	51.2 Å²	51.2	32%	0.318	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	122.6	166.4	172.6	161.5	170.6	0	0	109.1	K75 M132 R144 N145	K75-E130 HydrophobicContact CD-CG 4.3Å; K75-E130 WeakPolarHBondContact CD-OE1 3.48Å; K75-E130 VanDerWaalsContact CE-CD 3.4Å; K75-E130 WeakPolarHBondContact CE-OE1 3.42Å; K75-E130 WeakPolarHBondContact CE-OE2 3.29Å; K75-E130 IonicContact NZ-OE1 3.4Å; K75-E130 PolarHBondContact NZ-OE1 3.14Å; K75-E130 IonicContact NZ-OE2 3.9Å; K75-E130 PolarHBondContact NZ-OE2 2.95Å; E130-M132 HydrophobicContact CG-CE 4.27Å; E130-M132 VanDerWaalsContact OE1-CE 3.29Å; E130-M132 WeakPolarHBondContact OE1-CE 3.36Å; E130-R144 VanDerWaalsContact O-CA 3.29Å; E130-R144 WeakPolarHBondContact O-CA 3.26Å; E130-N145 HydrophobicContact CB-CB 4.32Å; E130-N145 PolarHBondContact N-O 2.99Å; E130-N145 PolarHBondContact O-N 2.88Å
131	T	95	Very high	93.8	Very high	3 Å²	3	50.1 Å²	50.1	2%	0.018	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130.7	178.7	-59	0	0	0	0	110.7	I76 I100 V133 V142 R144	I76-T131 HydrophobicContact CD1-CG2 3.67Å; I76-T131 HydrophobicContact CG1-CG2 3.76Å; I76-T131 WeakPolarHBondContact CG1-O 3.49Å; I76-T131 PolarHBondContact N-O 3.45Å; I100-T131 HydrophobicContact CG2-CG2 3.98Å; T131-V133 HydrophobicContact CG2-CG2 4.21Å; T131-V142 HydrophobicContact CG2-CG1 3.66Å; T131-R144 HydrophobicContact CG2-CG 4.09Å; T131-R144 PolarHBondContact OG1-NE 3.35Å
132	M	94.7	Very high	93.9	Very high	44 Å²	44	50.1 Å²	50.1	22%	0.217	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.9	173.4	-64	177.6	-145.7	0	0	109.6	Y73 Q74 E130 V142 K143	Y73-M132 HydrophobicContact CD1-CB 3.92Å; Y73-M132 HydrophobicContact CG-CB 4.25Å; Q74-M132 CarbonylContact O-C 3.52Å; Q74-M132 WeakPolarHBondContact O-CA 3.48Å; E130-M132 HydrophobicContact CG-CE 4.27Å; E130-M132 VanDerWaalsContact OE1-CE 3.29Å; E130-M132 WeakPolarHBondContact OE1-CE 3.36Å; M132-V142 CarbonylContact O-C 3.58Å; M132-V142 WeakPolarHBondContact O-CA 3.27Å; M132-K143 HydrophobicContact CB-CB 4.3Å; M132-K143 PolarHBondContact N-O 2.85Å; M132-K143 PolarHBondContact O-N 2.83Å
133	V	95.5	Very high	93.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.8	-176.1	-176.1	0	0	0	0	109.7	Q74 I76 Y80 I100 T131 L140 A141	Q74-V133 VanDerWaalsContact CG-O 3.24Å; Q74-V133 WeakPolarHBondContact CG-O 3.04Å; Q74-V133 PolarHBondContact N-O 3.16Å; Q74-V133 PolarHBondContact O-N 3.42Å; I76-V133 HydrophobicContact CD1-CG2 3.79Å; I76-V133 HydrophobicContact CG1-CG2 4.14Å; I76-V133 HydrophobicContact CG2-CG2 4.05Å; Y80-V133 HydrophobicContact CD1-CG2 4.49Å; Y80-V133 HydrophobicContact CE1-CG1 4.39Å; I100-V133 HydrophobicContact CD1-CB 4.27Å; I100-V133 HydrophobicContact CD1-CG1 3.58Å; I100-V133 HydrophobicContact CD1-CG2 3.6Å; I100-V133 HydrophobicContact CG2-CG2 4.39Å; T131-V133 HydrophobicContact CG2-CG2 4.21Å; V133-L140 HydrophobicContact CG1-CD1 3.96Å; V133-A141 WeakPolarHBondContact CA-O 3.37Å
134	S	96.2	Very high	94.2	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.007	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.3	167.4	179.7	0	0	0	0	108.8	T70 S72 L140 A141	T70-S134 VanDerWaalsContact CG2-OG 3.23Å; T70-S134 WeakPolarHBondContact CG2-OG 3.32Å; T70-S134 PolarHBondContact OG1-OG 3.2Å; S72-S134 WeakPolarHBondContact O-CB 3.29Å; S72-S134 PolarHBondContact O-OG 3.42Å; S72-S134 VanDerWaalsContact O-OG 3.07Å; S72-S134 PolarHBondContact OG-OG 3.36Å; S134-L140 CarbonylContact O-C 3.59Å; S134-L140 WeakPolarHBondContact O-CA 3.31Å; S134-A141 PolarHBondContact N-O 2.93Å; S134-A141 PolarHBondContact O-N 3.19Å
135	N	96.5	Very high	94.5	Very high	29 Å²	29	48.7 Å²	48.7	16%	0.155	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	96.3	-177.4	178.5	33.1	0	0	0	108.7	V82 K83 P84 K85 L140	V82-N135 HydrophobicContact CG2-CB 4Å; V82-N135 WeakPolarHBondContact CG2-ND2 3.3Å; K83-N135 PolarHBondContact O-ND2 2.8Å; P84-N135 WeakPolarHBondContact CA-OD1 3.48Å; K85-N135 WeakPolarHBondContact CD-O 3.29Å; K85-N135 WeakPolarHBondContact CE-O 3.45Å; K85-N135 PolarHBondContact N-OD1 3.18Å; K85-N135 PolarHBondContact NZ-O 3.34Å; N135-L140 HydrophobicContact CB-CD1 3.83Å
136	E	95.8	Very high	94.8	Very high	59 Å²	59	44.2 Å²	44.2	28%	0.276	21%	0.214	S	C	.	.			trans	-115.4	173.1	-176.4	-55.9	-52	159.4	0	0	111.9	S72 K85 F86 E138 L139	S72-E136 WeakPolarHBondContact CB-OE1 3.07Å; S72-E136 PolarHBondContact OG-OE1 3.06Å; K85-E136 IonicContact NZ-OE2 3.01Å; K85-E136 PolarHBondContact NZ-OE2 2.88Å; F86-E136 WeakPolarHBondContact CD1-O 3.49Å; F86-E136 WeakPolarHBondContact CE1-O 3.24Å; E136-E138 PolarHBondContact O-N 3.42Å; E136-L139 CarbonylContact C-O 3.58Å; E136-L139 PolarHBondContact N-O 3.12Å; E136-L139 VanDerWaalsContact O-O 3.06Å
137	E	95.3	Very high	95	Very high	151 Å²	151	45 Å²	45	71%	0.706	22%	0.22	S	C	*	.	S	Bend	trans	-65.1	-30.1	-178.8	-64.4	-174.2	171.8	0	0	112.2	K85 F86	K85-E137 HydrophobicContact CB-CG 4.43Å; K85-E137 HydrophobicContact CD-CG 4.34Å; F86-E137 WeakPolarHBondContact CD1-O 3.32Å
138	E	94.4	Very high	95	Very high	154 Å²	154	39.7 Å²	39.7	72%	0.72	20%	0.195	S	C	*	.	S	Bend	trans	-98.4	-13.6	-176.4	-60.7	-174.9	166.7	0	0	113.7	E136 P165	E136-E138 PolarHBondContact O-N 3.42Å; E138-P165 WeakPolarHBondContact O-CD 3.42Å
139	L	96.5	Very high	94.9	Very high	16 Å²	16	34.7 Å²	34.7	8%	0.084	17%	0.174	C	C	.	.			trans	-165.9	157.7	-177.9	60.5	85.7	0	0	0	114.4	F69 T70 E136 A141 V162 I163	F69-L139 HydrophobicContact CB-CD2 4Å; F69-L139 HydrophobicContact CD1-CD2 4.4Å; F69-L139 WeakPolarHBondContact O-CD2 3.46Å; T70-L139 HydrophobicContact CG2-CD1 4.14Å; E136-L139 CarbonylContact C-O 3.58Å; E136-L139 PolarHBondContact N-O 3.12Å; E136-L139 VanDerWaalsContact O-O 3.06Å; L139-A141 HydrophobicContact CD1-CB 3.71Å; L139-V162 HydrophobicContact CB-CG1 3.88Å; L139-V162 HydrophobicContact CD2-CG1 4.39Å; L139-I163 CarbonylContact C-O 3.52Å; L139-I163 VanDerWaalsContact CA-O 3.31Å; L139-I163 WeakPolarHBondContact CA-O 3.32Å
140	L	97.2	Very high	94.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	112.7	161	174	68.9	0	0	0	107.3	V82 P84 F86 V98 V133 S134 N135 V162 I163	V82-L140 HydrophobicContact CG1-CD1 4.01Å; V82-L140 HydrophobicContact CG1-CD2 4Å; V82-L140 HydrophobicContact CG2-CD1 4.47Å; P84-L140 HydrophobicContact CG-CD2 4.31Å; F86-L140 HydrophobicContact CE1-CB 4.31Å; F86-L140 HydrophobicContact CZ-CB 3.99Å; V98-L140 HydrophobicContact CB-CD2 4Å; V98-L140 HydrophobicContact CG1-CD2 3.91Å; V98-L140 HydrophobicContact CG2-CD2 3.98Å; V133-L140 HydrophobicContact CG1-CD1 3.96Å; S134-L140 CarbonylContact O-C 3.59Å; S134-L140 WeakPolarHBondContact O-CA 3.31Å; N135-L140 HydrophobicContact CB-CD1 3.83Å; L140-V162 CarbonylContact O-C 3.56Å; L140-V162 WeakPolarHBondContact O-CA 3.47Å; L140-I163 HydrophobicContact CB-CB 4.44Å; L140-I163 HydrophobicContact CD2-CD1 4.47Å; L140-I163 PolarHBondContact N-O 3.33Å; L140-I163 PolarHBondContact O-N 2.82Å
141	A	96.6	Very high	94.2	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	139.1	177.3	0	0	0	0	0	111.2	T70 Y73 V133 S134 L139 S161 V162	T70-A141 HydrophobicContact CG2-CB 4.38Å; Y73-A141 HydrophobicContact CE1-CB 3.98Å; V133-A141 WeakPolarHBondContact CA-O 3.37Å; S134-A141 PolarHBondContact N-O 2.93Å; S134-A141 PolarHBondContact O-N 3.19Å; L139-A141 HydrophobicContact CD1-CB 3.71Å; A141-S161 CarbonylContact C-O 3.49Å; A141-S161 WeakPolarHBondContact CA-O 3.43Å; A141-V162 HydrophobicContact CB-CG2 3.97Å
142	V	95.8	Very high	93.8	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.006	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	110.4	174.9	-175	0	0	0	0	107.9	I100 I106 T131 M132 R144 T160 S161	I100-V142 HydrophobicContact CD1-CG2 3.52Å; I100-V142 HydrophobicContact CG1-CG2 4.01Å; I100-V142 HydrophobicContact CG2-CG1 3.83Å; I100-V142 HydrophobicContact CG2-CG2 4.35Å; I106-V142 HydrophobicContact CD1-CB 3.86Å; I106-V142 HydrophobicContact CD1-CG1 4.32Å; I106-V142 HydrophobicContact CD1-CG2 3.7Å; I106-V142 HydrophobicContact CG1-CG2 4.4Å; T131-V142 HydrophobicContact CG2-CG1 3.66Å; M132-V142 CarbonylContact O-C 3.58Å; M132-V142 WeakPolarHBondContact O-CA 3.27Å; V142-R144 HydrophobicContact CG1-CG 4.3Å; V142-T160 WeakPolarHBondContact O-CA 3.41Å; V142-S161 PolarHBondContact N-O 3.09Å; V142-S161 PolarHBondContact O-N 2.8Å
143	K	94.9	Very high	93.6	Very high	37 Å²	37	46.7 Å²	46.7	16%	0.161	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	137.1	177.2	-172.3	174.3	-171.1	-170	0	109.4	Y73 M132 E158	Y73-K143 HydrophobicContact CD1-CB 4.46Å; Y73-K143 HydrophobicContact CE1-CB 3.98Å; M132-K143 HydrophobicContact CB-CB 4.3Å; M132-K143 PolarHBondContact N-O 2.85Å; M132-K143 PolarHBondContact O-N 2.83Å; K143-E158 WeakPolarHBondContact CE-OE1 3.24Å; K143-E158 IonicContact NZ-OE1 2.67Å; K143-E158 PolarHBondContact NZ-OE1 3.38Å
144	R	94.4	Very high	93.4	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	130.9	-176.9	-68.2	-169.9	172.7	108.3	-10.5	111.8	Y101 G104 N105 E130 T131 V142 F146 E158 T159	Y101-R144 PolarHBondContact O-NH2 3.41Å; G104-R144 VanDerWaalsContact C-CZ 3.48Å; G104-R144 PolarHBondContact O-NH1 3.19Å; G104-R144 VanDerWaalsContact O-NH1 3.12Å; N105-R144 PolarHBondContact O-NH2 3.12Å; E130-R144 VanDerWaalsContact O-CA 3.29Å; E130-R144 WeakPolarHBondContact O-CA 3.26Å; T131-R144 HydrophobicContact CG2-CG 4.09Å; T131-R144 PolarHBondContact OG1-NE 3.35Å; V142-R144 HydrophobicContact CG1-CG 4.3Å; R144-F146 HydrophobicContact CB-CD2 4.33Å; R144-F146 HydrophobicContact CB-CE1 4.19Å; R144-F146 HydrophobicContact CB-CE2 3.63Å; R144-F146 HydrophobicContact CB-CZ 3.55Å; R144-F146 HydrophobicContact CG-CZ 4.19Å; R144-E158 CarbonylContact O-C 3.57Å; R144-E158 VanDerWaalsContact O-CA 3.26Å; R144-E158 WeakPolarHBondContact O-CA 3.47Å; R144-T159 PolarHBondContact N-O 2.89Å; R144-T159 PolarHBondContact O-N 3.39Å
145	N	94.7	Very high	93.3	Very high	54 Å²	54	52.6 Å²	52.6	29%	0.289	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125.7	165.4	-59.6	-42.3	0	0	0	107.8	C129 E130 A157 E158	C129-N145 CarbonylContact C-O 3.57Å; C129-N145 WeakPolarHBondContact CA-O 3.26Å; E130-N145 HydrophobicContact CB-CB 4.32Å; E130-N145 PolarHBondContact N-O 2.99Å; E130-N145 PolarHBondContact O-N 2.88Å; N145-A157 CarbonylContact C-O 3.58Å; N145-A157 WeakPolarHBondContact CA-O 3.3Å; N145-E158 VanDerWaalsContact OD1-CG 3.25Å; N145-E158 WeakPolarHBondContact OD1-CG 3.44Å
146	F	94.1	Very high	93.2	Very high	3 Å²	3	55 Å²	55	1%	0.013	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	142.8	178.4	-52.4	-88	0	0	0	109.8	F122 I126 E128 C129 R144 I148 S156 A157 T159 W185	F122-F146 HydrophobicContact CB-CE1 4.14Å; F122-F146 HydrophobicContact CB-CZ 4.08Å; I126-F146 HydrophobicContact CD1-CD1 3.85Å; I126-F146 HydrophobicContact CD1-CE1 3.91Å; I126-F146 HydrophobicContact CG1-CD1 4.07Å; I126-F146 HydrophobicContact CG2-CD1 4.2Å; E128-F146 CarbonylContact O-C 3.52Å; E128-F146 WeakPolarHBondContact O-CA 3.43Å; C129-F146 HydrophobicContact CB-CD1 3.92Å; C129-F146 HydrophobicContact CB-CE1 4.27Å; C129-F146 VanDerWaalsContact SG-CD1 3.53Å; C129-F146 WeakPolarHBondContact SG-CE1 3.21Å; R144-F146 HydrophobicContact CB-CD2 4.33Å; R144-F146 HydrophobicContact CB-CE1 4.19Å; R144-F146 HydrophobicContact CB-CE2 3.63Å; R144-F146 HydrophobicContact CB-CZ 3.55Å; R144-F146 HydrophobicContact CG-CZ 4.19Å; F146-I148 HydrophobicContact CB-CG2 3.77Å; F146-S156 CarbonylContact O-C 3.42Å; F146-S156 VanDerWaalsContact O-CA 3.3Å; F146-S156 WeakPolarHBondContact O-CA 3.3Å; F146-A157 HydrophobicContact CB-CB 4.38Å; F146-A157 HydrophobicContact CD2-CB 4.41Å; F146-A157 PolarHBondContact N-O 2.87Å; F146-A157 PolarHBondContact O-N 2.95Å; F146-T159 HydrophobicContact CE2-CG2 4.39Å; F146-T159 WeakPolarHBondContact CE2-OG1 3.32Å; F146-W185 HydrophobicContact CD2-CH2 4.01Å; F146-W185 AromaticContact CE2-CH2 3.96Å; F146-W185 HydrophobicContact CE2-CH2 3.96Å; F146-W185 HydrophobicContact CE2-CZ2 4.2Å
147	V	94.1	Very high	93.1	Very high	44 Å²	44	52.2 Å²	52.2	27%	0.267	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	121.8	155.2	-177.6	0	0	0	0	106.1	Q127 E128 D154	Q127-V147 PolarHBondContact N-O 2.96Å; E128-V147 HydrophobicContact CB-CB 4.03Å; E128-V147 HydrophobicContact CB-CG2 4.17Å; E128-V147 PolarHBondContact N-O 2.58Å; E128-V147 PolarHBondContact O-N 2.76Å; V147-D154 HydrophobicContact CG1-CB 3.82Å
148	I	92.4	Very high	93.1	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	146.5	-176.8	65.5	172.5	0	0	0	108.6	A123 I126 F146 V150 D154 V155 A157 I180	A123-I148 HydrophobicContact CB-CD1 4.13Å; A123-I148 HydrophobicContact CB-CG2 3.82Å; I126-I148 HydrophobicContact CG1-CG2 4.07Å; F146-I148 HydrophobicContact CB-CG2 3.77Å; I148-V150 HydrophobicContact CD1-CG2 3.98Å; I148-V150 HydrophobicContact CG1-CG2 4.21Å; I148-D154 CarbonylContact O-C 3.58Å; I148-D154 WeakPolarHBondContact O-CA 3.06Å; I148-V155 HydrophobicContact CD1-CG2 3.83Å; I148-V155 HydrophobicContact CG1-CG2 3.46Å; I148-V155 VanDerWaalsContact CG1-CG2 3.46Å; I148-V155 WeakPolarHBondContact CG1-O 3.2Å; I148-V155 PolarHBondContact N-O 3.3Å; I148-V155 PolarHBondContact O-N 3.11Å; I148-A157 HydrophobicContact CD1-CB 4.46Å; I148-I180 HydrophobicContact CD1-CD1 3.08Å; I148-I180 HydrophobicContact CD1-CG1 3.64Å
149	T	91.1	Very high	93.1	Very high	31 Å²	31	39.9 Å²	39.9	19%	0.19	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	120.9	176.3	-51	0	0	0	0	109.8	N125 Q127 T153 D154	N125-T149 PolarHBondContact O-N 3.46Å; Q127-T149 WeakPolarHBondContact CG-OG1 3.46Å; Q127-T149 PolarHBondContact NE2-OG1 2.87Å; T149-T153 WeakPolarHBondContact CA-O 3.17Å; T149-D154 WeakPolarHBondContact CB-OD1 2.96Å; T149-D154 PolarHBondContact OG1-OD1 3.01Å
150	V	86.1	Confident	93.1	Very high	11 Å²	11	39.1 Å²	39.1	7%	0.067	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	124.3	174.3	-177.2	0	0	0	0	108	I148 D152 T153 V155 E179 I180	I148-V150 HydrophobicContact CD1-CG2 3.98Å; I148-V150 HydrophobicContact CG1-CG2 4.21Å; V150-D152 VanDerWaalsContact C-N 3.32Å; V150-D152 PolarHBondContact O-N 3.36Å; V150-T153 PolarHBondContact N-O 2.84Å; V150-T153 PolarHBondContact O-N 2.82Å; V150-T153 VanDerWaalsContact O-O 3.06Å; V150-V155 HydrophobicContact CB-CG2 4.38Å; V150-V155 HydrophobicContact CG2-CG2 3.87Å; V150-E179 HydrophobicContact CG1-CB 3.93Å; V150-I180 HydrophobicContact CG2-CG1 4.06Å
151	N	87.2	Confident	93.1	Very high	138 Å²	138	39.2 Å²	39.2	74%	0.738	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	50.3	-178.1	-59.8	-40.3	0	0	0	113.3	T153	N151-T153 PolarHBondContact O-N 2.87Å; N151-T153 PolarHBondContact O-OG1 3.4Å
152	D	86	Confident	93.1	Very high	163 Å²	163	39.2 Å²	39.2	87%	0.872	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	13.6	-177.8	-54.8	-48.9	0	0	0	115.3	V150	V150-D152 VanDerWaalsContact C-N 3.32Å; V150-D152 PolarHBondContact O-N 3.36Å
153	T	90.4	Very high	93.2	Very high	86 Å²	86	39.3 Å²	39.3	53%	0.528	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	131.6	176.8	-55.2	0	0	0	0	110.3	T149 V150 N151 V155	T149-T153 WeakPolarHBondContact CA-O 3.17Å; V150-T153 PolarHBondContact N-O 2.84Å; V150-T153 PolarHBondContact O-N 2.82Å; V150-T153 VanDerWaalsContact O-O 3.06Å; N151-T153 PolarHBondContact O-N 2.87Å; N151-T153 PolarHBondContact O-OG1 3.4Å; T153-V155 HydrophobicContact CG2-CG1 4.49Å
154	D	92.2	Very high	93.2	Very high	97 Å²	97	40 Å²	40	52%	0.519	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	125.5	175.1	-72	-18.7	0	0	0	110.7	V147 I148 T149	V147-D154 HydrophobicContact CG1-CB 3.82Å; I148-D154 CarbonylContact O-C 3.58Å; I148-D154 WeakPolarHBondContact O-CA 3.06Å; T149-D154 WeakPolarHBondContact CB-OD1 2.96Å; T149-D154 PolarHBondContact OG1-OD1 3.01Å
155	V	93.6	Very high	93.3	Very high	29 Å²	29	42.7 Å²	42.7	18%	0.176	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	150.9	177.6	-61.6	0	0	0	0	110.3	I148 V150 T153 P177	I148-V155 HydrophobicContact CD1-CG2 3.83Å; I148-V155 HydrophobicContact CG1-CG2 3.46Å; I148-V155 VanDerWaalsContact CG1-CG2 3.46Å; I148-V155 WeakPolarHBondContact CG1-O 3.2Å; I148-V155 PolarHBondContact N-O 3.3Å; I148-V155 PolarHBondContact O-N 3.11Å; V150-V155 HydrophobicContact CB-CG2 4.38Å; V150-V155 HydrophobicContact CG2-CG2 3.87Å; T153-V155 HydrophobicContact CG2-CG1 4.49Å; V155-P177 HydrophobicContact CB-CB 4.4Å; V155-P177 HydrophobicContact CB-CG 4.04Å; V155-P177 HydrophobicContact CG2-CB 4.03Å; V155-P177 HydrophobicContact CG2-CG 3.68Å
156	S	93.9	Very high	93.3	Very high	78 Å²	78	44.2 Å²	44.2	55%	0.545	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	137.4	179.7	62.5	0	0	0	0	111.4	F146 N175 P177	F146-S156 CarbonylContact O-C 3.42Å; F146-S156 VanDerWaalsContact O-CA 3.3Å; F146-S156 WeakPolarHBondContact O-CA 3.3Å; S156-N175 PolarHBondContact O-ND2 3.28Å; S156-P177 VanDerWaalsContact O-CG 3.28Å; S156-P177 WeakPolarHBondContact O-CG 3.34Å
157	A	94.3	Very high	93.4	Very high	2 Å²	2	44.1 Å²	44.1	2%	0.017	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	152.5	171.9	0	0	0	0	0	110.8	N145 F146 I148 N175 P177 W185	N145-A157 CarbonylContact C-O 3.58Å; N145-A157 WeakPolarHBondContact CA-O 3.3Å; F146-A157 HydrophobicContact CB-CB 4.38Å; F146-A157 HydrophobicContact CD2-CB 4.41Å; F146-A157 PolarHBondContact N-O 2.87Å; F146-A157 PolarHBondContact O-N 2.95Å; I148-A157 HydrophobicContact CD1-CB 4.46Å; A157-N175 CarbonylContact C-O 3.55Å; A157-N175 WeakPolarHBondContact CA-O 3.09Å; A157-P177 HydrophobicContact CB-CG 4.38Å; A157-W185 HydrophobicContact CB-CH2 4.02Å; A157-W185 HydrophobicContact CB-CZ3 3.82Å
158	E	94.8	Very high	93.5	Very high	45 Å²	45	42.8 Å²	42.8	21%	0.21	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	135.2	-177.9	-175.4	179.4	-161.1	0	0	110.3	K143 R144 N145 D174 N175	K143-E158 WeakPolarHBondContact CE-OE1 3.24Å; K143-E158 IonicContact NZ-OE1 2.67Å; K143-E158 PolarHBondContact NZ-OE1 3.38Å; R144-E158 CarbonylContact O-C 3.57Å; R144-E158 VanDerWaalsContact O-CA 3.26Å; R144-E158 WeakPolarHBondContact O-CA 3.47Å; N145-E158 VanDerWaalsContact OD1-CG 3.25Å; N145-E158 WeakPolarHBondContact OD1-CG 3.44Å; E158-D174 HydrophobicContact CB-CB 3.85Å; E158-D174 HydrophobicContact CG-CB 3.61Å; E158-D174 WeakPolarHBondContact O-CB 3.44Å; E158-D174 PolarHBondContact O-N 3.4Å; E158-D174 VanDerWaalsContact O-N 3.1Å; E158-N175 HydrophobicContact CB-CB 4.02Å; E158-N175 PolarHBondContact N-O 2.83Å; E158-N175 PolarHBondContact O-N 2.83Å; E158-N175 VanDerWaalsContact O-N 3.08Å
159	T	95.1	Very high	93.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	156.1	173.7	62.6	0	0	0	0	112.5	R144 F146 Y172 F173 D174 I176 W185	R144-T159 PolarHBondContact N-O 2.89Å; R144-T159 PolarHBondContact O-N 3.39Å; F146-T159 HydrophobicContact CE2-CG2 4.39Å; F146-T159 WeakPolarHBondContact CE2-OG1 3.32Å; T159-Y172 WeakPolarHBondContact CA-O 3.49Å; T159-Y172 WeakPolarHBondContact CB-O 3.33Å; T159-F173 HydrophobicContact CG2-CD1 4.18Å; T159-D174 WeakPolarHBondContact CA-OD2 3.35Å; T159-I176 HydrophobicContact CG2-CD1 3.91Å; T159-W185 HydrophobicContact CG2-CH2 3.71Å; T159-W185 HydrophobicContact CG2-CZ2 3.28Å
160	T	95.7	Very high	94	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	130.2	175.8	-53.7	0	0	0	0	109.7	F69 V142 V162 Y172 D174	F69-T160 HydrophobicContact CD2-CG2 3.94Å; F69-T160 HydrophobicContact CE2-CG2 3.94Å; V142-T160 WeakPolarHBondContact O-CA 3.41Å; T160-V162 HydrophobicContact CG2-CG2 3.97Å; T160-Y172 PolarHBondContact N-O 2.05Å; T160-Y172 PolarHBondContact O-N 3.43Å; T160-D174 PolarHBondContact N-OD2 3.21Å; T160-D174 PolarHBondContact OG1-OD1 3.18Å; T160-D174 PolarHBondContact OG1-OD2 2.85Å
161	S	96.6	Very high	94.6	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.014	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.2	175.1	-53.4	0	0	0	0	109.3	A141 V142 T170	A141-S161 CarbonylContact C-O 3.49Å; A141-S161 WeakPolarHBondContact CA-O 3.43Å; V142-S161 PolarHBondContact N-O 3.09Å; V142-S161 PolarHBondContact O-N 2.8Å; S161-T170 CarbonylContact C-O 3.56Å; S161-T170 WeakPolarHBondContact CA-O 3.31Å
162	V	96.9	Very high	95.1	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136.4	-175.6	-174.3	0	0	0	0	110.6	F69 L139 L140 A141 T160 Q164 I169 T170	F69-V162 HydrophobicContact CD1-CB 4.38Å; F69-V162 HydrophobicContact CD1-CG1 4.08Å; F69-V162 HydrophobicContact CD1-CG2 3.82Å; F69-V162 HydrophobicContact CD2-CG2 3.61Å; F69-V162 HydrophobicContact CE1-CB 4.12Å; F69-V162 HydrophobicContact CE1-CG1 4.16Å; F69-V162 HydrophobicContact CE1-CG2 3.73Å; F69-V162 HydrophobicContact CE2-CG2 3.5Å; F69-V162 VanDerWaalsContact CE2-CG2 3.5Å; F69-V162 HydrophobicContact CG-CG2 3.75Å; F69-V162 HydrophobicContact CZ-CB 4.22Å; F69-V162 HydrophobicContact CZ-CG2 3.54Å; L139-V162 HydrophobicContact CB-CG1 3.88Å; L139-V162 HydrophobicContact CD2-CG1 4.39Å; L140-V162 CarbonylContact O-C 3.56Å; L140-V162 WeakPolarHBondContact O-CA 3.47Å; A141-V162 HydrophobicContact CB-CG2 3.97Å; T160-V162 HydrophobicContact CG2-CG2 3.97Å; V162-Q164 HydrophobicContact CG1-CG 4.27Å; V162-I169 CarbonylContact O-C 3.58Å; V162-I169 VanDerWaalsContact O-CA 3.31Å; V162-I169 WeakPolarHBondContact O-CA 3.31Å; V162-T170 PolarHBondContact N-O 2.67Å; V162-T170 PolarHBondContact O-N 3.13Å
163	I	97.8	Very high	95.5	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.015	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	131.7	174.5	-55.8	178.2	0	0	0	107.9	F86 F88 I106 L108 L139 L140 I169	F86-I163 HydrophobicContact CE2-CG2 4.43Å; F86-I163 WeakPolarHBondContact CZ-O 2.96Å; F88-I163 HydrophobicContact CD1-CG2 4.39Å; F88-I163 HydrophobicContact CD2-CG2 3.75Å; F88-I163 HydrophobicContact CE1-CG2 4.22Å; F88-I163 HydrophobicContact CE2-CG2 3.53Å; F88-I163 HydrophobicContact CG-CG2 4.17Å; F88-I163 HydrophobicContact CZ-CD1 4.5Å; F88-I163 HydrophobicContact CZ-CG2 3.78Å; I106-I163 HydrophobicContact CG2-CD1 4.4Å; L108-I163 HydrophobicContact CD2-CD1 3.86Å; L139-I163 CarbonylContact C-O 3.52Å; L139-I163 VanDerWaalsContact CA-O 3.31Å; L139-I163 WeakPolarHBondContact CA-O 3.32Å; L140-I163 HydrophobicContact CB-CB 4.44Å; L140-I163 HydrophobicContact CD2-CD1 4.47Å; L140-I163 PolarHBondContact N-O 3.33Å; L140-I163 PolarHBondContact O-N 2.82Å; I163-I169 HydrophobicContact CG1-CG1 4.38Å
164	Q	96.4	Very high	95.7	Very high	51 Å²	51	24 Å²	24	24%	0.238	14%	0.135	C	C	.	.			trans	-114.9	161.3	-177.4	-63.6	178	-82.4	0	0	112.1	V162 N166 G167 K168	V162-Q164 HydrophobicContact CG1-CG 4.27Å; Q164-N166 VanDerWaalsContact C-N 3.27Å; Q164-N166 PolarHBondContact O-N 2.86Å; Q164-G167 PolarHBondContact O-N 3.19Å; Q164-K168 HydrophobicContact CB-CB 4.4Å; Q164-K168 PolarHBondContact N-O 2.83Å; Q164-K168 VanDerWaalsContact OE1-CD 3.3Å
165	P	96.1	Very high	95.8	Very high	56 Å²	56	22.5 Å²	22.5	36%	0.364	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-35.1	-179.4	-28.9	31.8	0	0	0	115.2	F86 F88 E138 G167	F86-P165 HydrophobicContact CB-CB 4.21Å; F86-P165 HydrophobicContact CB-CG 3.93Å; F86-P165 HydrophobicContact CD1-CG 4.24Å; F86-P165 HydrophobicContact CD2-CB 4.09Å; F86-P165 HydrophobicContact CD2-CG 3.92Å; F86-P165 HydrophobicContact CG-CB 4.25Å; F86-P165 HydrophobicContact CG-CG 3.75Å; F88-P165 WeakPolarHBondContact CB-O 3.41Å; E138-P165 WeakPolarHBondContact O-CD 3.42Å; P165-G167 PolarHBondContact O-N 3.34Å
166	N	93.9	Very high	95.8	Very high	86 Å²	86	21.4 Å²	21.4	46%	0.46	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	1.7	177	67	-4.6	0	0	0	113.6	Q164 K168	Q164-N166 VanDerWaalsContact C-N 3.27Å; Q164-N166 PolarHBondContact O-N 2.86Å; N166-K168 VanDerWaalsContact C-N 3.29Å; N166-K168 WeakPolarHBondContact OD1-CB 3.32Å; N166-K168 PolarHBondContact OD1-N 3.21Å
167	G	95.7	Very high	95.6	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.01	10%	0.098	C	C	.	.	S	Bend	trans	81.9	3.4	-177.8	0	0	0	0	0	114.3	R89 Q164 P165	R89-G167 WeakPolarHBondContact O-CA 3.14Å; Q164-G167 PolarHBondContact O-N 3.19Å; P165-G167 PolarHBondContact O-N 3.34Å
168	K	96.4	Very high	95.2	Very high	17 Å²	17	24.7 Å²	24.7	7%	0.074	14%	0.136	C	C	.	.			trans	-63.8	136.1	172.1	-177.7	172.9	171.3	-176.1	0	110	Q164 N166 E218 Y219	Q164-K168 HydrophobicContact CB-CB 4.4Å; Q164-K168 PolarHBondContact N-O 2.83Å; Q164-K168 VanDerWaalsContact OE1-CD 3.3Å; N166-K168 VanDerWaalsContact C-N 3.29Å; N166-K168 WeakPolarHBondContact OD1-CB 3.32Å; N166-K168 PolarHBondContact OD1-N 3.21Å; K168-E218 WeakPolarHBondContact CE-OE1 3.42Å; K168-E218 IonicContact NZ-OE1 2.72Å; K168-E218 PolarHBondContact NZ-OE1 2.89Å; K168-Y219 WeakPolarHBondContact CA-O 3.08Å
169	I	98	Very high	94.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.7	176.3	-62.3	164.1	0	0	0	108	F90 V119 V162 I163 L171 I189 Y219	F90-I169 HydrophobicContact CD2-CD1 3.65Å; F90-I169 HydrophobicContact CE2-CD1 3.5Å; V119-I169 HydrophobicContact CG1-CG2 3.98Å; V119-I169 HydrophobicContact CG2-CD1 3.84Å; V119-I169 HydrophobicContact CG2-CG1 4.49Å; V119-I169 HydrophobicContact CG2-CG2 4Å; V162-I169 CarbonylContact O-C 3.58Å; V162-I169 VanDerWaalsContact O-CA 3.31Å; V162-I169 WeakPolarHBondContact O-CA 3.31Å; I163-I169 HydrophobicContact CG1-CG1 4.38Å; I169-L171 HydrophobicContact CG2-CD2 4.14Å; I169-I189 HydrophobicContact CD1-CG2 4Å; I169-I189 HydrophobicContact CG2-CG2 4.23Å; I169-Y219 HydrophobicContact CB-CD2 4.42Å; I169-Y219 HydrophobicContact CG2-CD2 4.36Å; I169-Y219 PolarHBondContact N-O 2.84Å; I169-Y219 PolarHBondContact O-N 3.27Å
170	T	97.6	Very high	93.7	Very high	4 Å²	4	28 Å²	28	3%	0.025	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127	179.6	-58.9	0	0	0	0	109.3	F69 S161 V162 L216 V217 E218	F69-T170 HydrophobicContact CZ-CG2 3.93Å; S161-T170 CarbonylContact C-O 3.56Å; S161-T170 WeakPolarHBondContact CA-O 3.31Å; V162-T170 PolarHBondContact N-O 2.67Å; V162-T170 PolarHBondContact O-N 3.13Å; T170-L216 HydrophobicContact CG2-CD1 3.33Å; T170-L216 HydrophobicContact CG2-CG 4.21Å; T170-V217 CarbonylContact C-O 3.59Å; T170-V217 VanDerWaalsContact CA-O 3.28Å; T170-V217 WeakPolarHBondContact CA-O 3.41Å; T170-E218 HydrophobicContact CG2-CG 4.29Å
171	L	97.5	Very high	92.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	123.4	171.1	-49	-177.6	0	0	0	108	V119 N121 I169 S187 V206 V217 Y219	V119-L171 HydrophobicContact CG1-CD2 3.51Å; N121-L171 HydrophobicContact CB-CD2 4.41Å; I169-L171 HydrophobicContact CG2-CD2 4.14Å; L171-S187 VanDerWaalsContact CD1-OG 3.25Å; L171-S187 WeakPolarHBondContact CD1-OG 3.32Å; L171-V206 HydrophobicContact CD1-CG2 4.29Å; L171-V217 HydrophobicContact CB-CB 4.24Å; L171-V217 PolarHBondContact N-O 3.15Å; L171-V217 PolarHBondContact O-N 2.81Å; L171-Y219 HydrophobicContact CD1-CE2 3.79Å; L171-Y219 HydrophobicContact CG-CE2 4.16Å
172	Y	97.2	Very high	91.3	Very high	13 Å²	13	35.4 Å²	35.4	5%	0.051	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	132.8	174.5	-174.6	-112.5	0	0	0	109.4	Q64 S65 Q66 T159 T160 D174 T215 L216	Q64-Y172 HydrophobicContact CB-CE2 4.29Å; Q64-Y172 WeakPolarHBondContact O-CE2 3.12Å; Q64-Y172 PolarHBondContact O-OH 2.98Å; S65-Y172 VanDerWaalsContact C-OH 3.27Å; Q66-Y172 VanDerWaalsContact CA-CE1 3.4Å; Q66-Y172 VanDerWaalsContact CA-CZ 3.5Å; Q66-Y172 HydrophobicContact CB-CD1 4.42Å; Q66-Y172 HydrophobicContact CB-CE1 3.65Å; Q66-Y172 HydrophobicContact CG-CD1 4.15Å; Q66-Y172 HydrophobicContact CG-CE1 3.83Å; Q66-Y172 PolarHBondContact N-OH 2.94Å; T159-Y172 WeakPolarHBondContact CA-O 3.49Å; T159-Y172 WeakPolarHBondContact CB-O 3.33Å; T160-Y172 PolarHBondContact N-O 2.05Å; T160-Y172 PolarHBondContact O-N 3.43Å; Y172-D174 HydrophobicContact CD1-CB 4.12Å; Y172-D174 WeakPolarHBondContact CD1-OD1 3.25Å; Y172-D174 WeakPolarHBondContact CD1-OD2 3.49Å; Y172-D174 HydrophobicContact CE1-CB 3.95Å; Y172-D174 WeakPolarHBondContact CE1-OD1 3.33Å; Y172-T215 WeakPolarHBondContact CA-O 3.4Å; Y172-T215 VanDerWaalsContact CD2-O 3.25Å; Y172-T215 WeakPolarHBondContact CD2-O 3.28Å; Y172-L216 HydrophobicContact CD2-CB 4.15Å; Y172-L216 HydrophobicContact CD2-CD1 3.81Å; Y172-L216 HydrophobicContact CG-CD1 4.31Å
173	F	96	Very high	90.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	85.7	178.1	-64.3	-84.9	0	0	0	107.8	N121 T159 I176 W185 S187 V206 I211 K212 S213 G214 T215 V217	N121-F173 VanDerWaalsContact OD1-CE1 3.3Å; N121-F173 WeakPolarHBondContact OD1-CE1 3.45Å; T159-F173 HydrophobicContact CG2-CD1 4.18Å; F173-I176 HydrophobicContact CB-CD1 4.31Å; F173-I176 HydrophobicContact CB-CG1 3.75Å; F173-I176 HydrophobicContact CD1-CD1 3.86Å; F173-I176 HydrophobicContact CD1-CG1 3.92Å; F173-I176 HydrophobicContact CG-CG1 4.28Å; F173-W185 AromaticContact CE1-CD1 3.95Å; F173-W185 AromaticContact CE1-NE1 3.58Å; F173-S187 WeakPolarHBondContact CZ-OG 3.33Å; F173-V206 HydrophobicContact CE2-CG1 4.36Å; F173-V206 HydrophobicContact CZ-CG1 4.35Å; F173-I211 HydrophobicContact CD1-CG2 3.87Å; F173-I211 HydrophobicContact CE1-CB 4.27Å; F173-I211 HydrophobicContact CE1-CG1 4.15Å; F173-I211 HydrophobicContact CE1-CG2 3.53Å; F173-I211 HydrophobicContact CZ-CB 4.4Å; F173-I211 HydrophobicContact CZ-CG1 3.9Å; F173-I211 HydrophobicContact CZ-CG2 4.14Å; F173-K212 WeakPolarHBondContact CB-O 3.48Å; F173-S213 CarbonylContact O-C 3.55Å; F173-S213 WeakPolarHBondContact O-CA 3.26Å; F173-G214 PolarHBondContact O-N 3.21Å; F173-T215 HydrophobicContact CD2-CG2 3.99Å; F173-T215 WeakPolarHBondContact CD2-O 3.31Å; F173-T215 HydrophobicContact CE2-CG2 4.33Å; F173-T215 PolarHBondContact N-O 2.85Å; F173-V217 HydrophobicContact CE2-CG2 3.78Å
174	D	94.4	Very high	89.7	Confident	20 Å²	20	44.3 Å²	44.3	11%	0.107	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	-53.9	-173.5	-57.4	-106	0	0	0	111.5	Q66 E158 T159 T160 Y172	Q66-D174 VanDerWaalsContact CD-OD1 3.27Å; Q66-D174 WeakPolarHBondContact CG-OD1 3.34Å; Q66-D174 PolarHBondContact NE2-OD1 2.92Å; E158-D174 HydrophobicContact CB-CB 3.85Å; E158-D174 HydrophobicContact CG-CB 3.61Å; E158-D174 WeakPolarHBondContact O-CB 3.44Å; E158-D174 PolarHBondContact O-N 3.4Å; E158-D174 VanDerWaalsContact O-N 3.1Å; T159-D174 WeakPolarHBondContact CA-OD2 3.35Å; T160-D174 PolarHBondContact N-OD2 3.21Å; T160-D174 PolarHBondContact OG1-OD1 3.18Å; T160-D174 PolarHBondContact OG1-OD2 2.85Å; Y172-D174 HydrophobicContact CD1-CB 4.12Å; Y172-D174 WeakPolarHBondContact CD1-OD1 3.25Å; Y172-D174 WeakPolarHBondContact CD1-OD2 3.49Å; Y172-D174 HydrophobicContact CE1-CB 3.95Å; Y172-D174 WeakPolarHBondContact CE1-OD1 3.33Å
175	N	93.4	Very high	89.5	Confident	65 Å²	65	42.3 Å²	42.3	35%	0.348	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	110.3	178.1	179.3	42.9	0	0	0	109.9	S156 A157 E158	S156-N175 PolarHBondContact O-ND2 3.28Å; A157-N175 CarbonylContact C-O 3.55Å; A157-N175 WeakPolarHBondContact CA-O 3.09Å; E158-N175 HydrophobicContact CB-CB 4.02Å; E158-N175 PolarHBondContact N-O 2.83Å; E158-N175 PolarHBondContact O-N 2.83Å; E158-N175 VanDerWaalsContact O-N 3.08Å
176	I	93.1	Very high	89.4	Confident	6 Å²	6	42 Å²	42	3%	0.031	22%	0.22	C	C	.	.			trans	-119.5	114.8	176.9	-54.3	-62.1	0	0	0	107.8	T159 F173 I180 W185 I211 S213	T159-I176 HydrophobicContact CG2-CD1 3.91Å; F173-I176 HydrophobicContact CB-CD1 4.31Å; F173-I176 HydrophobicContact CB-CG1 3.75Å; F173-I176 HydrophobicContact CD1-CD1 3.86Å; F173-I176 HydrophobicContact CD1-CG1 3.92Å; F173-I176 HydrophobicContact CG-CG1 4.28Å; I176-I180 HydrophobicContact CG2-CD1 4.16Å; I176-W185 HydrophobicContact CD1-CD2 4.34Å; I176-W185 HydrophobicContact CD1-CE3 3.98Å; I176-W185 HydrophobicContact CD1-CH2 3.53Å; I176-W185 HydrophobicContact CD1-CZ2 3.93Å; I176-W185 HydrophobicContact CD1-CZ3 3.54Å; I176-W185 HydrophobicContact CG2-CE3 4.45Å; I176-I211 HydrophobicContact CG2-CG2 4.47Å; I176-S213 PolarHBondContact N-OG 2.83Å; I176-S213 PolarHBondContact O-OG 3Å; I176-S213 VanDerWaalsContact O-OG 3.11Å
177	P	90.3	Very high	89.5	Confident	15 Å²	15	38.1 Å²	38.1	10%	0.097	20%	0.2	C	C	.	.			trans	-51.2	138.8	173	-24.2	28.9	0	0	0	111.9	V155 S156 A157 E179 I180	V155-P177 HydrophobicContact CB-CB 4.4Å; V155-P177 HydrophobicContact CB-CG 4.04Å; V155-P177 HydrophobicContact CG2-CB 4.03Å; V155-P177 HydrophobicContact CG2-CG 3.68Å; S156-P177 VanDerWaalsContact O-CG 3.28Å; S156-P177 WeakPolarHBondContact O-CG 3.34Å; A157-P177 HydrophobicContact CB-CG 4.38Å; P177-E179 VanDerWaalsContact CB-OE2 3.24Å; P177-E179 WeakPolarHBondContact CB-OE2 3.38Å; P177-E179 PolarHBondContact O-N 3Å; P177-I180 HydrophobicContact CB-CD1 4.19Å; P177-I180 HydrophobicContact CB-CG1 4.14Å; P177-I180 HydrophobicContact CG-CD1 3.99Å; P177-I180 HydrophobicContact CG-CG1 4.43Å; P177-I180 PolarHBondContact O-N 2.95Å
178	T	87.4	Confident	89.6	Confident	133 Å²	133	39.4 Å²	39.4	82%	0.816	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-17.9	-179.9	46.3	0	0	0	0	113.3	I180	T178-I180 VanDerWaalsContact C-N 3.29Å
179	E	80.6	Confident	89.6	Confident	105 Å²	105	38.6 Å²	38.6	49%	0.491	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-21.5	178.6	-59.2	82.3	174.5	0	0	112.2	V150 P177 E181	V150-E179 HydrophobicContact CG1-CB 3.93Å; P177-E179 VanDerWaalsContact CB-OE2 3.24Å; P177-E179 WeakPolarHBondContact CB-OE2 3.38Å; P177-E179 PolarHBondContact O-N 3Å; E179-E181 PolarHBondContact O-N 2.86Å
180	I	77.5	Confident	89.6	Confident	11 Å²	11	39.6 Å²	39.6	6%	0.056	21%	0.207	C	C	.	.	S	Bend	trans	-78.4	108.3	173.3	-54.6	171.5	0	0	0	107.6	I148 V150 I176 P177 T178 G182 E184 W185	I148-I180 HydrophobicContact CD1-CD1 3.08Å; I148-I180 HydrophobicContact CD1-CG1 3.64Å; V150-I180 HydrophobicContact CG2-CG1 4.06Å; I176-I180 HydrophobicContact CG2-CD1 4.16Å; P177-I180 HydrophobicContact CB-CD1 4.19Å; P177-I180 HydrophobicContact CB-CG1 4.14Å; P177-I180 HydrophobicContact CG-CD1 3.99Å; P177-I180 HydrophobicContact CG-CG1 4.43Å; P177-I180 PolarHBondContact O-N 2.95Å; T178-I180 VanDerWaalsContact C-N 3.29Å; I180-G182 PolarHBondContact O-N 2.86Å; I180-E184 HydrophobicContact CG2-CB 3.83Å; I180-W185 HydrophobicContact CD1-CE3 3.96Å; I180-W185 HydrophobicContact CD1-CZ3 4.05Å; I180-W185 HydrophobicContact CG2-CB 4.48Å
181	E	71.5	Confident	89.5	Confident	141 Å²	141	39.4 Å²	39.4	66%	0.659	21%	0.206	S	C	*	.			trans	-66	131.7	161.7	-66.1	-171.3	179.3	0	0	107.7	E179 I183 E184	E179-E181 PolarHBondContact O-N 2.86Å; E181-I183 PolarHBondContact O-N 3.04Å; E181-E184 PolarHBondContact O-N 3.12Å
182	G	70.3	Confident	89.2	Confident	16 Å²	16	44.8 Å²	44.8	17%	0.165	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-4.1	-175.2	0	0	0	0	0	116.1	I180 W185	I180-G182 PolarHBondContact O-N 2.86Å; G182-W185 PolarHBondContact O-N 2.94Å
183	I	75.3	Confident	88.8	Confident	128 Å²	128	44.3 Å²	44.3	66%	0.656	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-33.3	168.2	-59.4	170.9	0	0	0	111.6	E181 W185	E181-I183 PolarHBondContact O-N 3.04Å; I183-W185 PolarHBondContact O-N 2.7Å
184	E	85.8	Confident	88.4	Confident	63 Å²	63	50.2 Å²	50.2	29%	0.294	25%	0.253	S	S	.	.	S	Bend	trans	-77.4	-12.5	176	-64	-171.8	153.5	0	0	112.2	A123 Q124 I180 E181	A123-E184 CarbonylContact C-O 3.54Å; Q124-E184 WeakPolarHBondContact CB-O 3.37Å; Q124-E184 VanDerWaalsContact CG-O 3.32Å; Q124-E184 WeakPolarHBondContact CG-O 3.11Å; Q124-E184 PolarHBondContact N-O 2.78Å; I180-E184 HydrophobicContact CG2-CB 3.83Å; E181-E184 PolarHBondContact O-N 3.12Å
185	W	91.9	Very high	88.1	Confident	9 Å²	9	50.2 Å²	50.2	3%	0.034	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127.4	178.7	-160.7	-74.4	0	0	0	111.8	N121 A123 F146 A157 T159 F173 I176 I180 G182 I183 I211	N121-W185 PolarHBondContact OD1-NE1 2.95Å; A123-W185 HydrophobicContact CB-CD2 4.34Å; A123-W185 HydrophobicContact CB-CE3 3.62Å; A123-W185 HydrophobicContact CB-CH2 4.37Å; A123-W185 HydrophobicContact CB-CZ3 3.66Å; F146-W185 HydrophobicContact CD2-CH2 4.01Å; F146-W185 AromaticContact CE2-CH2 3.96Å; F146-W185 HydrophobicContact CE2-CH2 3.96Å; F146-W185 HydrophobicContact CE2-CZ2 4.2Å; A157-W185 HydrophobicContact CB-CH2 4.02Å; A157-W185 HydrophobicContact CB-CZ3 3.82Å; T159-W185 HydrophobicContact CG2-CH2 3.71Å; T159-W185 HydrophobicContact CG2-CZ2 3.28Å; F173-W185 AromaticContact CE1-CD1 3.95Å; F173-W185 AromaticContact CE1-NE1 3.58Å; I176-W185 HydrophobicContact CD1-CD2 4.34Å; I176-W185 HydrophobicContact CD1-CE3 3.98Å; I176-W185 HydrophobicContact CD1-CH2 3.53Å; I176-W185 HydrophobicContact CD1-CZ2 3.93Å; I176-W185 HydrophobicContact CD1-CZ3 3.54Å; I176-W185 HydrophobicContact CG2-CE3 4.45Å; I180-W185 HydrophobicContact CD1-CE3 3.96Å; I180-W185 HydrophobicContact CD1-CZ3 4.05Å; I180-W185 HydrophobicContact CG2-CB 4.48Å; G182-W185 PolarHBondContact O-N 2.94Å; I183-W185 PolarHBondContact O-N 2.7Å; W185-I211 HydrophobicContact CB-CD1 4.09Å; W185-I211 HydrophobicContact CB-CG2 3.81Å; W185-I211 HydrophobicContact CD2-CG2 4.2Å; W185-I211 HydrophobicContact CG-CD1 4.32Å; W185-I211 HydrophobicContact CG-CG2 3.65Å
186	I	93.6	Very high	87.7	Confident	48 Å²	48	55.1 Å²	55.1	25%	0.246	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	110.1	175.7	-57.7	175.6	0	0	0	108.2	E120 N121 F122 Q124	E120-I186 HydrophobicContact CB-CG2 4.35Å; E120-I186 VanDerWaalsContact OE2-CG2 3.24Å; E120-I186 WeakPolarHBondContact OE2-CG2 3.46Å; N121-I186 CarbonylContact C-O 3.51Å; N121-I186 VanDerWaalsContact CA-O 3.31Å; N121-I186 WeakPolarHBondContact CA-O 3.43Å; F122-I186 HydrophobicContact CE1-CB 4.17Å; F122-I186 HydrophobicContact CE1-CG2 4.18Å; F122-I186 HydrophobicContact CE2-CD1 4.18Å; F122-I186 HydrophobicContact CZ-CB 4.16Å; F122-I186 HydrophobicContact CZ-CD1 3.94Å; F122-I186 HydrophobicContact CZ-CG2 4.37Å; F122-I186 PolarHBondContact N-O 3.34Å; F122-I186 PolarHBondContact O-N 2.89Å; Q124-I186 HydrophobicContact CG-CD1 4.38Å
187	S	95.9	Very high	87.3	Confident	5 Å²	5	64.3 Å²	64.3	4%	0.035	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	115.9	175.8	-165.4	0	0	0	0	110.5	E120 N121 L171 F173 V206	E120-S187 CarbonylContact O-C 3.52Å; E120-S187 VanDerWaalsContact O-CA 3.26Å; E120-S187 WeakPolarHBondContact O-CA 3.37Å; N121-S187 WeakPolarHBondContact OD1-CB 3.45Å; N121-S187 PolarHBondContact OD1-OG 3.42Å; L171-S187 VanDerWaalsContact CD1-OG 3.25Å; L171-S187 WeakPolarHBondContact CD1-OG 3.32Å; F173-S187 WeakPolarHBondContact CZ-OG 3.33Å; S187-V206 PolarHBondContact O-N 2.83Å
188	K	97.1	Very high	87.1	Confident	29 Å²	29	69.2 Å²	69.2	13%	0.126	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	164.7	-175.7	62.4	-176.2	171.6	-169.5	0	112.8	E120 E203 I204 P205	E120-K188 HydrophobicContact CB-CG 3.98Å; E120-K188 VanDerWaalsContact CD-CE 3.44Å; E120-K188 HydrophobicContact CG-CG 4.45Å; E120-K188 PolarHBondContact N-O 3.28Å; E120-K188 PolarHBondContact O-N 2.9Å; E120-K188 WeakPolarHBondContact OE2-CE 3.28Å; E120-K188 IonicContact OE2-NZ 2.8Å; K188-E203 HydrophobicContact CD-CB 4.32Å; K188-E203 HydrophobicContact CD-CG 4.44Å; K188-E203 IonicContact NZ-OE1 2.64Å; K188-E203 PolarHBondContact NZ-OE1 3.35Å; K188-E203 IonicContact NZ-OE2 3.59Å; K188-E203 PolarHBondContact NZ-OE2 3.37Å; K188-I204 WeakPolarHBondContact CA-O 3.42Å; K188-P205 HydrophobicContact CB-CB 4.32Å
189	I	97.9	Very high	87.1	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	142.9	154.9	65.8	172	0	0	0	109.6	Y56 F90 G118 V119 I169 E203 I204 Y219	Y56-I189 HydrophobicContact CD1-CD1 3.92Å; Y56-I189 HydrophobicContact CD2-CD1 4.01Å; Y56-I189 HydrophobicContact CE1-CD1 3.98Å; Y56-I189 HydrophobicContact CE2-CD1 4.09Å; Y56-I189 HydrophobicContact CG-CD1 3.94Å; F90-I189 HydrophobicContact CE2-CB 4.15Å; F90-I189 HydrophobicContact CE2-CD1 4.1Å; F90-I189 HydrophobicContact CZ-CB 4.14Å; G118-I189 WeakPolarHBondContact O-CA 3.12Å; V119-I189 HydrophobicContact CG1-CG2 4.35Å; V119-I189 HydrophobicContact CG2-CG2 4.11Å; I169-I189 HydrophobicContact CD1-CG2 4Å; I169-I189 HydrophobicContact CG2-CG2 4.23Å; I189-E203 WeakPolarHBondContact O-CA 3.44Å; I189-I204 HydrophobicContact CD1-CD1 4.06Å; I189-I204 HydrophobicContact CG1-CB 3.94Å; I189-I204 HydrophobicContact CG1-CD1 4.17Å; I189-I204 HydrophobicContact CG1-CG1 4.23Å; I189-I204 PolarHBondContact N-O 3.38Å; I189-I204 PolarHBondContact O-N 3.1Å; I189-Y219 HydrophobicContact CD1-CD1 3.62Å; I189-Y219 HydrophobicContact CD1-CE1 4.13Å; I189-Y219 HydrophobicContact CD1-CG 3.89Å; I189-Y219 HydrophobicContact CG1-CD1 3.87Å; I189-Y219 HydrophobicContact CG1-CE1 3.83Å; I189-Y219 HydrophobicContact CG1-CG 4.32Å; I189-Y219 HydrophobicContact CG2-CD2 3.96Å; I189-Y219 HydrophobicContact CG2-CE2 3.97Å; I189-Y219 HydrophobicContact CG2-CG 4.23Å
190	D	96.6	Very high	87.6	Confident	21 Å²	21	65 Å²	65	11%	0.112	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	156.4	-179.4	81	-62.4	0	0	0	112.7	F90 G117 G118 K201 H202 E203	F90-D190 WeakPolarHBondContact CE1-O 3.43Å; F90-D190 WeakPolarHBondContact CZ-O 3.3Å; G117-D190 CarbonylContact C-O 3.56Å; G117-D190 WeakPolarHBondContact CA-O 2.97Å; G118-D190 WeakPolarHBondContact CA-OD1 3.45Å; G118-D190 PolarHBondContact N-O 2.9Å; G118-D190 PolarHBondContact N-OD1 3Å; G118-D190 PolarHBondContact O-N 2.89Å; D190-K201 WeakPolarHBondContact OD2-CE 3.39Å; D190-K201 IonicContact OD2-NZ 2.8Å; D190-H202 CarbonylContact C-O 3.5Å; D190-H202 VanDerWaalsContact CA-O 3.28Å; D190-H202 WeakPolarHBondContact CA-O 3.34Å; D190-E203 HydrophobicContact CB-CG 4.02Å
191	T	95.4	Very high	88.3	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	161.5	176	-171.1	0	0	0	0	111.3	Y91 F116 F193 K201 H202	Y91-T191 HydrophobicContact CD1-CG2 4.35Å; Y91-T191 HydrophobicContact CD2-CG2 3.98Å; Y91-T191 HydrophobicContact CE1-CG2 3.95Å; Y91-T191 HydrophobicContact CE2-CG2 3.55Å; Y91-T191 HydrophobicContact CG-CG2 4.39Å; F116-T191 PolarHBondContact O-OG1 2.8Å; F116-T191 VanDerWaalsContact O-OG1 3.12Å; T191-F193 HydrophobicContact CG2-CD2 4.12Å; T191-F193 HydrophobicContact CG2-CE1 4.15Å; T191-F193 HydrophobicContact CG2-CE2 3.35Å; T191-F193 HydrophobicContact CG2-CZ 3.39Å; T191-K201 WeakPolarHBondContact O-CA 3.44Å; T191-H202 HydrophobicContact CG2-CB 3.96Å; T191-H202 PolarHBondContact N-O 2.81Å; T191-H202 PolarHBondContact O-N 2.9Å
192	K	91.6	Very high	89.4	Confident	113 Å²	113	62.7 Å²	62.7	49%	0.491	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	108	-179.9	-174.3	173.8	172.3	176	0	110.5	F116 F199	F116-K192 PolarHBondContact O-N 3.31Å; F116-K192 VanDerWaalsContact O-N 3.09Å; K192-F199 HydrophobicContact CD-CB 4.05Å; K192-F199 HydrophobicContact CD-CD1 4.04Å; K192-F199 HydrophobicContact CD-CG 4.15Å; K192-F199 HydrophobicContact CG-CB 3.79Å; K192-F199 HydrophobicContact CG-CD1 3.77Å; K192-F199 HydrophobicContact CG-CG 4.1Å
193	F	89.9	Confident	90.6	Very high	3 Å²	3	65.2 Å²	65.2	1%	0.013	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	140.2	175.3	-60.1	-66.4	0	0	0	110.8	H27 I29 Y54 Y91 F116 T191 F199 T200 H202	H27-F193 HydrophobicContact CB-CD1 4.27Å; H27-F193 HydrophobicContact CB-CG 4.49Å; H27-F193 AromaticContact CD2-CD1 3.19Å; H27-F193 WeakPolarHBondContact CD2-CD1 3.3Å; H27-F193 AromaticContact CD2-CE1 3.5Å; H27-F193 AromaticContact CG-CD1 3.68Å; H27-F193 AromaticContact NE2-CD1 3.54Å; H27-F193 AromaticContact NE2-CE1 3.98Å; I29-F193 HydrophobicContact CB-CD2 4.45Å; I29-F193 HydrophobicContact CD1-CD2 3.78Å; I29-F193 HydrophobicContact CD1-CE2 3.33Å; I29-F193 HydrophobicContact CD1-CZ 4.13Å; I29-F193 HydrophobicContact CG2-CD2 4.08Å; Y54-F193 HydrophobicContact CE1-CE2 4.41Å; Y54-F193 HydrophobicContact CE1-CZ 4.14Å; Y91-F193 AromaticContact CD1-CZ 3.81Å; Y91-F193 HydrophobicContact CD1-CZ 3.81Å; Y91-F193 HydrophobicContact CE1-CZ 4.11Å; Y91-F193 HydrophobicContact CG-CZ 4.31Å; F116-F193 HydrophobicContact CZ-CE1 4.28Å; T191-F193 HydrophobicContact CG2-CD2 4.12Å; T191-F193 HydrophobicContact CG2-CE1 4.15Å; T191-F193 HydrophobicContact CG2-CE2 3.35Å; T191-F193 HydrophobicContact CG2-CZ 3.39Å; F193-F199 CarbonylContact O-C 3.51Å; F193-F199 VanDerWaalsContact O-CA 3.23Å; F193-F199 WeakPolarHBondContact O-CA 2.93Å; F193-T200 PolarHBondContact N-O 3.01Å; F193-T200 PolarHBondContact O-N 2.98Å; F193-H202 HydrophobicContact CD2-CB 4.27Å; F193-H202 HydrophobicContact CE2-CB 3.8Å
194	K	87.6	Confident	91.7	Very high	124 Å²	124	59.1 Å²	59.1	54%	0.539	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	113.4	172.1	-173.9	179	179.5	-179	0	108.8	F199	K194-F199 HydrophobicContact CB-CD1 3.94Å; K194-F199 HydrophobicContact CB-CE1 3.8Å; K194-F199 HydrophobicContact CD-CE1 4.33Å; K194-F199 HydrophobicContact CG-CD1 4.28Å; K194-F199 HydrophobicContact CG-CE1 3.96Å; K194-F199 HydrophobicContact CG-CZ 4.41Å
195	C	87.4	Confident	92.2	Very high	20 Å²	20	59.5 Å²	59.5	14%	0.135	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	98.6	176.9	-59.5	0	0	0	0	109	C30 K197 N198 T200	C30-C195 WeakPolarHBondContact CA-SG 3.4Å; C30-C195 HydrophobicContact CB-CB 3.72Å; C30-C195 WeakPolarHBondContact CB-SG 3.4Å; C30-C195 WeakPolarHBondContact SG-CA 3.31Å; C30-C195 WeakPolarHBondContact SG-CB 3.38Å; C30-C195 CovalentContact SG-SG 2.04Å; C30-C195 PolarHBondContact SG-SG 3.07Å; C195-K197 PolarHBondContact O-N 3.25Å; C195-N198 CarbonylContact C-O 3.59Å; C195-N198 PolarHBondContact N-O 3.36Å; C195-N198 PolarHBondContact O-N 2.92Å; C195-N198 VanDerWaalsContact O-O 3.06Å; C195-T200 PolarHBondContact SG-OG1 3.47Å; C195-T200 VanDerWaalsContact SG-OG1 3.32Å
196	E	85.3	Confident	92.5	Very high	168 Å²	168	59.4 Å²	59.4	79%	0.785	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	-100.5	-174.2	-57.4	-173.8	167.2	0	0	113.2
197	K	83.6	Confident	92.6	Very high	199 Å²	199	58.9 Å²	58.9	87%	0.865	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-15.9	-179.1	-63.4	-176.4	-178.4	177.6	0	113.7	C195	C195-K197 PolarHBondContact O-N 3.25Å
198	N	87.2	Confident	92.5	Very high	117 Å²	117	60.7 Å²	60.7	63%	0.626	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.3	163.7	-176.8	-69.6	-26.1	0	0	0	110.9	C195	C195-N198 CarbonylContact C-O 3.59Å; C195-N198 PolarHBondContact N-O 3.36Å; C195-N198 PolarHBondContact O-N 2.92Å; C195-N198 VanDerWaalsContact O-O 3.06Å
199	F	87.7	Confident	92.3	Very high	118 Å²	118	65.5 Å²	65.5	52%	0.518	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	138.3	167.1	-69.6	-87.1	0	0	0	109.7	K192 F193 K194	K192-F199 HydrophobicContact CD-CB 4.05Å; K192-F199 HydrophobicContact CD-CD1 4.04Å; K192-F199 HydrophobicContact CD-CG 4.15Å; K192-F199 HydrophobicContact CG-CB 3.79Å; K192-F199 HydrophobicContact CG-CD1 3.77Å; K192-F199 HydrophobicContact CG-CG 4.1Å; F193-F199 CarbonylContact O-C 3.51Å; F193-F199 VanDerWaalsContact O-CA 3.23Å; F193-F199 WeakPolarHBondContact O-CA 2.93Å; K194-F199 HydrophobicContact CB-CD1 3.94Å; K194-F199 HydrophobicContact CB-CE1 3.8Å; K194-F199 HydrophobicContact CD-CE1 4.33Å; K194-F199 HydrophobicContact CG-CD1 4.28Å; K194-F199 HydrophobicContact CG-CE1 3.96Å; K194-F199 HydrophobicContact CG-CZ 4.41Å
200	T	90.1	Very high	92.2	Very high	32 Å²	32	65.8 Å²	65.8	20%	0.196	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.6	179.9	-54	0	0	0	0	108.2	I29 L36 F193 C195	I29-T200 HydrophobicContact CG2-CG2 4Å; L36-T200 HydrophobicContact CD1-CG2 3.31Å; L36-T200 HydrophobicContact CD2-CG2 3.52Å; L36-T200 HydrophobicContact CG-CG2 3.97Å; F193-T200 PolarHBondContact N-O 3.01Å; F193-T200 PolarHBondContact O-N 2.98Å; C195-T200 PolarHBondContact SG-OG1 3.47Å; C195-T200 VanDerWaalsContact SG-OG1 3.32Å
201	K	92.4	Very high	92.1	Very high	101 Å²	101	65.4 Å²	65.4	44%	0.439	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	134.9	175.7	-164.2	178	-169.7	-172.1	0	109.2	D190 T191 E203	D190-K201 WeakPolarHBondContact OD2-CE 3.39Å; D190-K201 IonicContact OD2-NZ 2.8Å; T191-K201 WeakPolarHBondContact O-CA 3.44Å; K201-E203 HydrophobicContact CD-CG 4.05Å; K201-E203 WeakPolarHBondContact CD-OE1 3.48Å; K201-E203 WeakPolarHBondContact CE-OE1 3.39Å; K201-E203 HydrophobicContact CG-CG 4.08Å; K201-E203 IonicContact NZ-OE1 3.4Å; K201-E203 PolarHBondContact NZ-OE1 3.38Å
202	H	94.8	Very high	92.1	Very high	3 Å²	3	69.7 Å²	69.7	1%	0.014	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	135.6	169.8	177.7	-114.6	0	0	0	108.4	I29 L36 Y91 D190 T191 F193	I29-H202 HydrophobicContact CD1-CB 4.31Å; L36-H202 HydrophobicContact CD2-CB 3.9Å; L36-H202 PolarHBondContact O-CD2 3.37Å; Y91-H202 AromaticContact CE1-CE1 3.95Å; Y91-H202 AromaticContact CE1-ND1 3.5Å; Y91-H202 AromaticContact CZ-ND1 3.51Å; Y91-H202 PolarHBondContact OH-CE1 3.16Å; Y91-H202 VanDerWaalsContact OH-CE1 3.31Å; Y91-H202 PolarHBondContact OH-ND1 3.15Å; D190-H202 CarbonylContact C-O 3.5Å; D190-H202 VanDerWaalsContact CA-O 3.28Å; D190-H202 WeakPolarHBondContact CA-O 3.34Å; T191-H202 HydrophobicContact CG2-CB 3.96Å; T191-H202 PolarHBondContact N-O 2.81Å; T191-H202 PolarHBondContact O-N 2.9Å; F193-H202 HydrophobicContact CD2-CB 4.27Å; F193-H202 HydrophobicContact CE2-CB 3.8Å
203	E	96.4	Very high	92.3	Very high	69 Å²	69	66.8 Å²	66.8	32%	0.322	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	143.3	-176.9	-55.9	-167.9	152.8	0	0	109.3	K188 I189 D190 K201	K188-E203 HydrophobicContact CD-CB 4.32Å; K188-E203 HydrophobicContact CD-CG 4.44Å; K188-E203 IonicContact NZ-OE1 2.64Å; K188-E203 PolarHBondContact NZ-OE1 3.35Å; K188-E203 IonicContact NZ-OE2 3.59Å; K188-E203 PolarHBondContact NZ-OE2 3.37Å; I189-E203 WeakPolarHBondContact O-CA 3.44Å; D190-E203 HydrophobicContact CB-CG 4.02Å; K201-E203 HydrophobicContact CD-CG 4.05Å; K201-E203 WeakPolarHBondContact CD-OE1 3.48Å; K201-E203 WeakPolarHBondContact CE-OE1 3.39Å; K201-E203 HydrophobicContact CG-CG 4.08Å; K201-E203 IonicContact NZ-OE1 3.4Å; K201-E203 PolarHBondContact NZ-OE1 3.38Å
204	I	97.6	Very high	92.6	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	87.7	173	-47.5	-179.8	0	0	0	108.2	H53 Y56 M58 K188 I189 Y219	H53-I204 HydrophobicContact CB-CD1 3.67Å; H53-I204 HydrophobicContact CB-CG1 4.25Å; H53-I204 HydrophobicContact CB-CG2 4.11Å; H53-I204 VanDerWaalsContact CG-CG2 3.5Å; Y56-I204 HydrophobicContact CD2-CD1 4.12Å; Y56-I204 HydrophobicContact CG-CD1 4.16Å; M58-I204 HydrophobicContact CE-CG2 3.48Å; M58-I204 VanDerWaalsContact CE-CG2 3.48Å; K188-I204 WeakPolarHBondContact CA-O 3.42Å; I189-I204 HydrophobicContact CD1-CD1 4.06Å; I189-I204 HydrophobicContact CG1-CB 3.94Å; I189-I204 HydrophobicContact CG1-CD1 4.17Å; I189-I204 HydrophobicContact CG1-CG1 4.23Å; I189-I204 PolarHBondContact N-O 3.38Å; I189-I204 PolarHBondContact O-N 3.1Å; I204-Y219 HydrophobicContact CB-CE1 3.96Å; I204-Y219 HydrophobicContact CG2-CD1 4.36Å; I204-Y219 HydrophobicContact CG2-CE1 3.71Å; I204-Y219 PolarHBondContact O-OH 2.86Å
205	P	97.1	Very high	93	Very high	71 Å²	71	61.3 Å²	61.3	46%	0.461	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	143.5	-176.2	31.8	-34.7	0	0	0	112.6	M58 K188 P207	M58-P205 VanDerWaalsContact CE-O 3.3Å; M58-P205 WeakPolarHBondContact CE-O 3.48Å; K188-P205 HydrophobicContact CB-CB 4.32Å; P205-P207 WeakPolarHBondContact O-CD 3.4Å
206	V	97.2	Very high	93.5	Very high	7 Å²	7	60.9 Å²	60.9	4%	0.042	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-68.8	122.8	162.5	-174.7	0	0	0	0	107.2	I60 L171 F173 S187 A208 W210 I211 V217 Y219	I60-V206 HydrophobicContact CD1-CG1 4.24Å; L171-V206 HydrophobicContact CD1-CG2 4.29Å; F173-V206 HydrophobicContact CE2-CG1 4.36Å; F173-V206 HydrophobicContact CZ-CG1 4.35Å; S187-V206 PolarHBondContact O-N 2.83Å; V206-A208 PolarHBondContact O-N 2.79Å; V206-W210 HydrophobicContact CG1-CB 4.22Å; V206-I211 HydrophobicContact CB-CD1 4.44Å; V206-I211 HydrophobicContact CB-CG1 4.32Å; V206-I211 HydrophobicContact CG1-CG1 3.9Å; V206-V217 HydrophobicContact CG1-CG2 3.87Å; V206-V217 HydrophobicContact CG2-CB 4.4Å; V206-V217 HydrophobicContact CG2-CG1 4.01Å; V206-V217 HydrophobicContact CG2-CG2 4.03Å; V206-Y219 WeakPolarHBondContact CG2-OH 3.38Å
207	P	95.7	Very high	94.2	Very high	37 Å²	37	52.9 Å²	52.9	24%	0.24	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-64.8	134.9	179.6	-10.9	21.4	0	0	0	110.4	P205 K209 W210	P205-P207 WeakPolarHBondContact O-CD 3.4Å; P207-K209 PolarHBondContact O-N 2.7Å; P207-W210 WeakPolarHBondContact O-CB 3.45Å; P207-W210 PolarHBondContact O-N 3.14Å
208	A	94.2	Very high	94.8	Very high	42 Å²	42	44 Å²	44	35%	0.347	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-48.6	-38	-171.8	0	0	0	0	0	114.6	V206 W210 I211	V206-A208 PolarHBondContact O-N 2.79Å; A208-W210 PolarHBondContact O-N 2.81Å; A208-I211 PolarHBondContact O-N 3.13Å
209	K	93.2	Very high	95.4	Very high	130 Å²	130	38.4 Å²	38.4	57%	0.565	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-61.3	-18.2	179.7	73.6	176	-173.2	173	0	114.8	E44 P207	E44-K209 WeakPolarHBondContact OE1-CE 3.37Å; E44-K209 IonicContact OE1-NZ 3.96Å; E44-K209 PolarHBondContact OE1-NZ 3.46Å; P207-K209 PolarHBondContact O-N 2.7Å
210	W	95.5	Very high	95.8	Very high	6 Å²	6	33.3 Å²	33.3	2%	0.023	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-96	-8.2	178.4	-63.8	99.9	0	0	0	112.9	E44 N45 R49 I60 L62 V206 P207 A208 K212 T215	E44-W210 HydrophobicContact CG-CZ2 4.06Å; N45-W210 VanDerWaalsContact O-CH2 3.23Å; N45-W210 WeakPolarHBondContact O-CH2 3.42Å; R49-W210 HydrophobicContact CB-CH2 3.98Å; R49-W210 HydrophobicContact CB-CZ2 3.62Å; R49-W210 HydrophobicContact CG-CZ2 4.41Å; I60-W210 HydrophobicContact CB-CD2 4.33Å; I60-W210 HydrophobicContact CB-CE3 4.2Å; I60-W210 HydrophobicContact CD1-CB 3.96Å; I60-W210 HydrophobicContact CD1-CD2 4.12Å; I60-W210 HydrophobicContact CD1-CG 3.68Å; I60-W210 HydrophobicContact CG2-CB 3.92Å; I60-W210 HydrophobicContact CG2-CD2 3.72Å; I60-W210 HydrophobicContact CG2-CE3 3.39Å; I60-W210 HydrophobicContact CG2-CG 3.95Å; I60-W210 HydrophobicContact CG2-CZ3 4.14Å; L62-W210 HydrophobicContact CD1-CE3 4.21Å; L62-W210 HydrophobicContact CD1-CZ3 4.01Å; L62-W210 HydrophobicContact CD2-CE3 3.77Å; L62-W210 HydrophobicContact CD2-CZ3 4.22Å; L62-W210 HydrophobicContact CG-CE3 3.83Å; L62-W210 HydrophobicContact CG-CZ3 3.75Å; V206-W210 HydrophobicContact CG1-CB 4.22Å; P207-W210 WeakPolarHBondContact O-CB 3.45Å; P207-W210 PolarHBondContact O-N 3.14Å; A208-W210 PolarHBondContact O-N 2.81Å; W210-K212 PolarHBondContact O-N 3.22Å; W210-K212 VanDerWaalsContact O-N 3.14Å; W210-T215 WeakPolarHBondContact O-CB 3.31Å; W210-T215 WeakPolarHBondContact O-CG2 3.35Å; W210-T215 PolarHBondContact O-OG1 3.48Å
211	I	95.1	Very high	96	Very high	13 Å²	13	33.6 Å²	33.6	7%	0.067	18%	0.181	C	C	.	.			trans	-84	94.8	-179.1	-59.7	176.5	0	0	0	108.6	F173 I176 W185 V206 A208	F173-I211 HydrophobicContact CD1-CG2 3.87Å; F173-I211 HydrophobicContact CE1-CB 4.27Å; F173-I211 HydrophobicContact CE1-CG1 4.15Å; F173-I211 HydrophobicContact CE1-CG2 3.53Å; F173-I211 HydrophobicContact CZ-CB 4.4Å; F173-I211 HydrophobicContact CZ-CG1 3.9Å; F173-I211 HydrophobicContact CZ-CG2 4.14Å; I176-I211 HydrophobicContact CG2-CG2 4.47Å; W185-I211 HydrophobicContact CB-CD1 4.09Å; W185-I211 HydrophobicContact CB-CG2 3.81Å; W185-I211 HydrophobicContact CD2-CG2 4.2Å; W185-I211 HydrophobicContact CG-CD1 4.32Å; W185-I211 HydrophobicContact CG-CG2 3.65Å; V206-I211 HydrophobicContact CB-CD1 4.44Å; V206-I211 HydrophobicContact CB-CG1 4.32Å; V206-I211 HydrophobicContact CG1-CG1 3.9Å; A208-I211 PolarHBondContact O-N 3.13Å
212	K	94.8	Very high	96	Very high	90 Å²	90	28.9 Å²	28.9	39%	0.391	16%	0.16	S	C	.	.	S	Bend	trans	-160	162.2	177.5	58.6	-169.4	175.6	-173	0	110.9	L62 F173 W210 T215	L62-K212 HydrophobicContact CD2-CD 4.47Å; L62-K212 HydrophobicContact CD2-CG 4.25Å; F173-K212 WeakPolarHBondContact CB-O 3.48Å; W210-K212 PolarHBondContact O-N 3.22Å; W210-K212 VanDerWaalsContact O-N 3.14Å; K212-T215 WeakPolarHBondContact CG-OG1 3.19Å; K212-T215 WeakPolarHBondContact O-CB 3.4Å; K212-T215 PolarHBondContact O-N 3.38Å; K212-T215 PolarHBondContact O-OG1 2.9Å
213	S	95.4	Very high	95.7	Very high	53 Å²	53	29.4 Å²	29.4	37%	0.371	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	138.6	-180	-53.8	0	0	0	0	112.8	F173 I176 T215	F173-S213 CarbonylContact O-C 3.55Å; F173-S213 WeakPolarHBondContact O-CA 3.26Å; I176-S213 PolarHBondContact N-OG 2.83Å; I176-S213 PolarHBondContact O-OG 3Å; I176-S213 VanDerWaalsContact O-OG 3.11Å; S213-T215 VanDerWaalsContact C-N 3.3Å; S213-T215 PolarHBondContact O-N 2.81Å
214	G	96.1	Very high	95.1	Very high	12 Å²	12	28.5 Å²	28.5	12%	0.124	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	14.8	-179.3	0	0	0	0	0	114.5	L62 H63 Q64 F173	L62-G214 CarbonylContact C-O 3.57Å; H63-G214 PolarHBondContact N-O 3Å; H63-G214 VanDerWaalsContact N-O 3.08Å; Q64-G214 PolarHBondContact N-O 2.8Å; F173-G214 PolarHBondContact O-N 3.21Å
215	T	97.3	Very high	94.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	130.2	175.1	-53.7	0	0	0	0	110.4	I60 L62 Y172 F173 W210 K212 S213 V217	I60-T215 HydrophobicContact CG2-CG2 3.66Å; L62-T215 HydrophobicContact CD2-CG2 3.82Å; L62-T215 WeakPolarHBondContact CD2-OG1 3.2Å; Y172-T215 WeakPolarHBondContact CA-O 3.4Å; Y172-T215 VanDerWaalsContact CD2-O 3.25Å; Y172-T215 WeakPolarHBondContact CD2-O 3.28Å; F173-T215 HydrophobicContact CD2-CG2 3.99Å; F173-T215 WeakPolarHBondContact CD2-O 3.31Å; F173-T215 HydrophobicContact CE2-CG2 4.33Å; F173-T215 PolarHBondContact N-O 2.85Å; W210-T215 WeakPolarHBondContact O-CB 3.31Å; W210-T215 WeakPolarHBondContact O-CG2 3.35Å; W210-T215 PolarHBondContact O-OG1 3.48Å; K212-T215 WeakPolarHBondContact CG-OG1 3.19Å; K212-T215 WeakPolarHBondContact O-CB 3.4Å; K212-T215 PolarHBondContact O-N 3.38Å; K212-T215 PolarHBondContact O-OG1 2.9Å; S213-T215 VanDerWaalsContact C-N 3.3Å; S213-T215 PolarHBondContact O-N 2.81Å; T215-V217 HydrophobicContact CG2-CG2 4.18Å
216	L	97.9	Very high	94.5	Very high	11 Å²	11	29.9 Å²	29.9	6%	0.058	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124.5	172.1	-172.6	70.4	0	0	0	109.5	I60 R61 Q64 P67 T170 Y172 E218	I60-L216 CarbonylContact C-O 3.55Å; I60-L216 WeakPolarHBondContact CA-O 3.31Å; R61-L216 PolarHBondContact N-O 2.93Å; R61-L216 PolarHBondContact O-N 2.64Å; Q64-L216 HydrophobicContact CB-CB 3.99Å; Q64-L216 HydrophobicContact CG-CB 3.74Å; Q64-L216 HydrophobicContact CG-CD2 4.34Å; P67-L216 HydrophobicContact CG-CD1 3.91Å; T170-L216 HydrophobicContact CG2-CD1 3.33Å; T170-L216 HydrophobicContact CG2-CG 4.21Å; Y172-L216 HydrophobicContact CD2-CB 4.15Å; Y172-L216 HydrophobicContact CD2-CD1 3.81Å; Y172-L216 HydrophobicContact CG-CD1 4.31Å; L216-E218 HydrophobicContact CD2-CG 4.43Å; L216-E218 HydrophobicContact CG-CG 4.28Å
217	V	98.4	Very high	94.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	130.1	174.5	-177.3	0	0	0	0	108.9	M58 R59 I60 T170 L171 F173 V206 T215 Y219	M58-V217 HydrophobicContact CG-CG1 3.87Å; M58-V217 HydrophobicContact SD-CG1 4.42Å; R59-V217 CarbonylContact O-C 3.54Å; R59-V217 WeakPolarHBondContact O-CA 3.16Å; I60-V217 HydrophobicContact CG1-CG1 4.29Å; I60-V217 HydrophobicContact CG1-CG2 4.13Å; I60-V217 HydrophobicContact CG2-CG2 4.2Å; T170-V217 CarbonylContact C-O 3.59Å; T170-V217 VanDerWaalsContact CA-O 3.28Å; T170-V217 WeakPolarHBondContact CA-O 3.41Å; L171-V217 HydrophobicContact CB-CB 4.24Å; L171-V217 PolarHBondContact N-O 3.15Å; L171-V217 PolarHBondContact O-N 2.81Å; F173-V217 HydrophobicContact CE2-CG2 3.78Å; V206-V217 HydrophobicContact CG1-CG2 3.87Å; V206-V217 HydrophobicContact CG2-CB 4.4Å; V206-V217 HydrophobicContact CG2-CG1 4.01Å; V206-V217 HydrophobicContact CG2-CG2 4.03Å; T215-V217 HydrophobicContact CG2-CG2 4.18Å; V217-Y219 HydrophobicContact CG1-CD2 4.19Å; V217-Y219 HydrophobicContact CG1-CE2 3.69Å
218	E	97.9	Very high	93.8	Very high	11 Å²	11	37 Å²	37	5%	0.051	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	116.9	179.9	-63.7	168.9	109.6	0	0	109.1	M58 R59 R61 K168 T170 L216	M58-E218 WeakPolarHBondContact CA-O 3.3Å; R59-E218 HydrophobicContact CB-CB 4.42Å; R59-E218 PolarHBondContact N-O 2.8Å; R59-E218 PolarHBondContact O-N 2.86Å; R61-E218 IonicContact CZ-OE2 3.07Å; R61-E218 IonicContact NE-OE2 2.64Å; R61-E218 PolarHBondContact NE-OE2 2.8Å; R61-E218 IonicContact NH2-OE1 3.19Å; R61-E218 PolarHBondContact NH2-OE1 2.82Å; R61-E218 VanDerWaalsContact NH2-OE1 3.15Å; R61-E218 IonicContact NH2-OE2 3.37Å; R61-E218 PolarHBondContact NH2-OE2 3.12Å; K168-E218 WeakPolarHBondContact CE-OE1 3.42Å; K168-E218 IonicContact NZ-OE1 2.72Å; K168-E218 PolarHBondContact NZ-OE1 2.89Å; T170-E218 HydrophobicContact CG2-CG 4.29Å; L216-E218 HydrophobicContact CD2-CG 4.43Å; L216-E218 HydrophobicContact CG-CG 4.28Å
219	Y	98.3	Very high	93.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	117.1	167.6	-60.9	-90.7	0	0	0	108.7	S57 M58 K168 I169 L171 I189 I204 V206 V217	S57-Y219 VanDerWaalsContact O-CA 3.31Å; S57-Y219 WeakPolarHBondContact O-CA 3.32Å; M58-Y219 HydrophobicContact CB-CD1 4.29Å; M58-Y219 HydrophobicContact CB-CE1 4.35Å; M58-Y219 HydrophobicContact CE-CD1 4.35Å; M58-Y219 HydrophobicContact CE-CE1 3.38Å; M58-Y219 HydrophobicContact CG-CD1 4.39Å; M58-Y219 HydrophobicContact CG-CE1 4.15Å; K168-Y219 WeakPolarHBondContact CA-O 3.08Å; I169-Y219 HydrophobicContact CB-CD2 4.42Å; I169-Y219 HydrophobicContact CG2-CD2 4.36Å; I169-Y219 PolarHBondContact N-O 2.84Å; I169-Y219 PolarHBondContact O-N 3.27Å; L171-Y219 HydrophobicContact CD1-CE2 3.79Å; L171-Y219 HydrophobicContact CG-CE2 4.16Å; I189-Y219 HydrophobicContact CD1-CD1 3.62Å; I189-Y219 HydrophobicContact CD1-CE1 4.13Å; I189-Y219 HydrophobicContact CD1-CG 3.89Å; I189-Y219 HydrophobicContact CG1-CD1 3.87Å; I189-Y219 HydrophobicContact CG1-CE1 3.83Å; I189-Y219 HydrophobicContact CG1-CG 4.32Å; I189-Y219 HydrophobicContact CG2-CD2 3.96Å; I189-Y219 HydrophobicContact CG2-CE2 3.97Å; I189-Y219 HydrophobicContact CG2-CG 4.23Å; I204-Y219 HydrophobicContact CB-CE1 3.96Å; I204-Y219 HydrophobicContact CG2-CD1 4.36Å; I204-Y219 HydrophobicContact CG2-CE1 3.71Å; I204-Y219 PolarHBondContact O-OH 2.86Å; V206-Y219 WeakPolarHBondContact CG2-OH 3.38Å; V217-Y219 HydrophobicContact CG1-CD2 4.19Å; V217-Y219 HydrophobicContact CG1-CE2 3.69Å
220	E	96.7	Very high	93.9	Very high	11 Å²	11	38.4 Å²	38.4	5%	0.051	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	134.6	176.9	-163.7	-172.5	140	0	0	109.4	Y56 S57 I222 D259 T262 K266	Y56-E220 CarbonylContact C-O 3.38Å; Y56-E220 VanDerWaalsContact CA-O 3.26Å; Y56-E220 WeakPolarHBondContact CA-O 3.43Å; Y56-E220 WeakPolarHBondContact CD1-O 3.5Å; S57-E220 PolarHBondContact N-O 2.82Å; S57-E220 PolarHBondContact O-N 3.39Å; E220-I222 PolarHBondContact O-N 2.78Å; E220-D259 VanDerWaalsContact OE1-CB 3.26Å; E220-D259 WeakPolarHBondContact OE1-CB 3.46Å; E220-T262 PolarHBondContact OE1-OG1 2.9Å; E220-T262 PolarHBondContact OE2-OG1 2.65Å; E220-K266 WeakPolarHBondContact OE1-CE 3.36Å; E220-K266 IonicContact OE1-NZ 3.19Å; E220-K266 PolarHBondContact OE1-NZ 2.87Å; E220-K266 WeakPolarHBondContact OE2-CE 3.05Å; E220-K266 IonicContact OE2-NZ 2.84Å; E220-K266 PolarHBondContact OE2-NZ 3.3Å
221	V	94.5	Very high	93.9	Very high	39 Å²	39	40.4 Å²	40.4	24%	0.236	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	127.6	176.5	-177.8	0	0	0	0	108.9	Y56	Y56-V221 HydrophobicContact CD1-CG2 4.43Å; Y56-V221 HydrophobicContact CE1-CB 4.46Å; Y56-V221 HydrophobicContact CE1-CG2 3.65Å
222	I	91.9	Very high	93.9	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	22%	0.22	C	C	.	.			trans	-110.1	111.6	171.6	-59.8	-65.5	0	0	0	107.2	N55 E220 W227 K266	N55-I222 CarbonylContact C-O 3.44Å; N55-I222 PolarHBondContact O-N 2.85Å; E220-I222 PolarHBondContact O-N 2.78Å; I222-W227 HydrophobicContact CB-CZ2 4.43Å; I222-W227 HydrophobicContact CG2-CZ2 3.73Å; I222-K266 VanDerWaalsContact CD1-NZ 3.31Å
223	G	88.2	Confident	93.9	Very high	15 Å²	15	42.2 Å²	42.2	16%	0.155	23%	0.227	C	C	.	.			trans	-69.8	168.2	173.6	0	0	0	0	0	112.3	E256	G223-E256 VanDerWaalsContact C-CD 3.45Å; G223-E256 WeakPolarHBondContact CA-OE1 3.49Å; G223-E256 VanDerWaalsContact CA-OE2 3.31Å; G223-E256 WeakPolarHBondContact CA-OE2 3.41Å; G223-E256 PolarHBondContact N-OE2 2.94Å
224	K	84.6	Confident	94	Very high	49 Å²	49	41.4 Å²	41.4	21%	0.213	22%	0.22	C	C	.	.	S	Bend	trans	-98.2	-5.5	-172	-58.8	-175.1	177.3	-159.9	0	113.6	E28 Y54 N55 W227 E256	E28-K224 IonicContact OE2-NZ 2.76Å; E28-K224 PolarHBondContact OE2-NZ 2.83Å; Y54-K224 PolarHBondContact OH-NZ 2.81Å; N55-K224 WeakPolarHBondContact OD1-CE 3.35Å; K224-W227 HydrophobicContact CG-CE3 4.38Å; K224-W227 HydrophobicContact CG-CZ3 4.49Å; K224-W227 PolarHBondContact O-N 3.44Å; K224-E256 PolarHBondContact N-OE1 3.42Å
225	N	88.8	Confident	94	Very high	101 Å²	101	40.8 Å²	40.8	54%	0.54	21%	0.214	S	C	.	.	S	Bend	trans	-71	-43.6	-169.5	-67.1	-28.3	0	0	0	110.8	W227 N228 F229 M243 E256	N225-W227 VanDerWaalsContact C-N 3.28Å; N225-W227 PolarHBondContact O-N 2.86Å; N225-N228 PolarHBondContact O-ND2 2.81Å; N225-F229 WeakPolarHBondContact O-CE2 3.49Å; N225-M243 HydrophobicContact CB-CE 4.23Å; N225-M243 HydrophobicContact CB-SD 3.26Å; N225-M243 WeakPolarHBondContact CB-SD 3.11Å; N225-E256 WeakPolarHBondContact CB-OE1 3.23Å; N225-E256 PolarHBondContact N-OE1 2.78Å
226	C	93.8	Very high	93.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-68	-26.3	177.2	-63.4	0	0	0	0	112.5	N228 F229 C245 C254 E256	C226-N228 PolarHBondContact O-N 3.26Å; C226-F229 WeakPolarHBondContact O-CD2 3.42Å; C226-F229 PolarHBondContact O-N 2.8Å; C226-F229 VanDerWaalsContact O-N 3.12Å; C226-C245 HydrophobicContact CB-CB 3.91Å; C226-C245 WeakPolarHBondContact CB-SG 3.41Å; C226-C245 WeakPolarHBondContact SG-CA 3.47Å; C226-C245 WeakPolarHBondContact SG-CB 3.24Å; C226-C245 CovalentContact SG-SG 2.03Å; C226-C245 PolarHBondContact SG-SG 3.2Å; C226-C254 WeakPolarHBondContact O-CB 3.5Å; C226-C254 PolarHBondContact O-SG 2.85Å; C226-E256 HydrophobicContact CB-CG 3.82Å; C226-E256 WeakPolarHBondContact SG-CG 3.25Å
227	W	88.4	Confident	93.7	Very high	62 Å²	62	55 Å²	55	24%	0.235	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-62.8	-19.6	-175.8	-69.6	6.8	0	0	0	114	I222 K224 N225 F229	I222-W227 HydrophobicContact CB-CZ2 4.43Å; I222-W227 HydrophobicContact CG2-CZ2 3.73Å; K224-W227 HydrophobicContact CG-CE3 4.38Å; K224-W227 HydrophobicContact CG-CZ3 4.49Å; K224-W227 PolarHBondContact O-N 3.44Å; N225-W227 VanDerWaalsContact C-N 3.28Å; N225-W227 PolarHBondContact O-N 2.86Å; W227-F229 VanDerWaalsContact C-N 3.26Å; W227-F229 PolarHBondContact O-N 2.71Å
228	N	88.9	Confident	93.5	Very high	130 Å²	130	55.5 Å²	55.5	70%	0.695	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-73.4	-14.8	178.7	-62.4	-48	0	0	0	113.7	N225 C226	N225-N228 PolarHBondContact O-ND2 2.81Å; C226-N228 PolarHBondContact O-N 3.26Å
229	F	94.8	Very high	93.4	Very high	70 Å²	70	58 Å²	58	31%	0.307	29%	0.292	S	S	.	.			trans	-93.4	119.4	-179.6	-55.7	-77.2	0	0	0	110.6	N225 C226 W227 C235 A238 C254	N225-F229 WeakPolarHBondContact O-CE2 3.49Å; C226-F229 WeakPolarHBondContact O-CD2 3.42Å; C226-F229 PolarHBondContact O-N 2.8Å; C226-F229 VanDerWaalsContact O-N 3.12Å; W227-F229 VanDerWaalsContact C-N 3.26Å; W227-F229 PolarHBondContact O-N 2.71Å; F229-C235 HydrophobicContact CB-CB 4.22Å; F229-A238 HydrophobicContact CD1-CB 4.12Å; F229-A238 HydrophobicContact CD2-CB 3.41Å; F229-A238 VanDerWaalsContact CD2-CB 3.41Å; F229-A238 HydrophobicContact CE1-CB 3.84Å; F229-A238 HydrophobicContact CE2-CB 3.13Å; F229-A238 HydrophobicContact CG-CB 3.92Å; F229-A238 HydrophobicContact CZ-CB 3.35Å; F229-C254 HydrophobicContact CB-CB 4.18Å; F229-C254 VanDerWaalsContact O-CB 3.26Å; F229-C254 WeakPolarHBondContact O-CB 3.44Å
230	N	94.1	Very high	93.1	Very high	133 Å²	133	61.7 Å²	61.7	71%	0.711	32%	0.315	S	S	*	.			trans	-101.5	2.6	-169.6	66.1	-8.4	0	0	0	114.3	W247	N230-W247 VanDerWaalsContact O-CH2 3.3Å; N230-W247 WeakPolarHBondContact O-CH2 3.2Å
231	T	95.3	Very high	92.8	Very high	48 Å²	48	66.8 Å²	66.8	29%	0.294	35%	0.352	S	S	.	.	S	Bend	trans	-130.1	157.3	172.6	85.4	0	0	0	0	111.2	E233 T234 C235	T231-E233 VanDerWaalsContact C-N 3.28Å; T231-E233 VanDerWaalsContact CB-OE2 3.29Å; T231-E233 WeakPolarHBondContact CB-OE2 3.23Å; T231-E233 PolarHBondContact O-N 3.15Å; T231-E233 PolarHBondContact OG1-N 2.89Å; T231-E233 PolarHBondContact OG1-OE2 2.79Å; T231-T234 PolarHBondContact N-OG1 2.72Å; T231-T234 VanDerWaalsContact N-OG1 3.12Å; T231-T234 PolarHBondContact O-N 3.33Å; T231-T234 PolarHBondContact O-OG1 3.19Å; T231-T234 WeakPolarHBondContact OG1-CG2 3.42Å; T231-T234 PolarHBondContact OG1-N 2.87Å; T231-T234 VanDerWaalsContact OG1-N 3.14Å; T231-T234 PolarHBondContact OG1-OG1 3.48Å; T231-C235 WeakPolarHBondContact O-CB 3.29Å; T231-C235 PolarHBondContact O-N 3.46Å
232	S	95.1	Very high	92.5	Very high	27 Å²	27	71.9 Å²	71.9	19%	0.189	38%	0.377	C	S	.	.	H	α-helix	trans	-56.5	-43.3	176.1	-179.4	0	0	0	0	111.9	C235 Q236	S232-C235 WeakPolarHBondContact O-CB 3.27Å; S232-C235 PolarHBondContact O-N 2.74Å; S232-Q236 VanDerWaalsContact O-CG 3.29Å; S232-Q236 WeakPolarHBondContact O-CG 3.36Å; S232-Q236 PolarHBondContact O-N 2.8Å
233	E	95.7	Very high	92.5	Very high	114 Å²	114	73 Å²	73	53%	0.533	38%	0.383	S	S	.	.	H	α-helix	trans	-71.4	-37	-176.3	-53.3	71.2	-152.2	0	0	112	T231 R237	T231-E233 VanDerWaalsContact C-N 3.28Å; T231-E233 VanDerWaalsContact CB-OE2 3.29Å; T231-E233 WeakPolarHBondContact CB-OE2 3.23Å; T231-E233 PolarHBondContact O-N 3.15Å; T231-E233 PolarHBondContact OG1-N 2.89Å; T231-E233 PolarHBondContact OG1-OE2 2.79Å; E233-R237 WeakPolarHBondContact O-CB 3.39Å; E233-R237 WeakPolarHBondContact O-CG 3.34Å; E233-R237 PolarHBondContact O-N 2.96Å; E233-R237 PolarHBondContact O-NE 3.43Å
234	T	96.8	Very high	92.9	Very high	35 Å²	35	74.2 Å²	74.2	22%	0.215	39%	0.387	C	S	.	.	H	α-helix	trans	-72.4	-39.1	175.8	52.2	0	0	0	0	110.8	T231 R237 A238	T231-T234 PolarHBondContact N-OG1 2.72Å; T231-T234 VanDerWaalsContact N-OG1 3.12Å; T231-T234 PolarHBondContact O-N 3.33Å; T231-T234 PolarHBondContact O-OG1 3.19Å; T231-T234 WeakPolarHBondContact OG1-CG2 3.42Å; T231-T234 PolarHBondContact OG1-N 2.87Å; T231-T234 VanDerWaalsContact OG1-N 3.14Å; T231-T234 PolarHBondContact OG1-OG1 3.48Å; T234-R237 PolarHBondContact O-N 2.82Å; T234-A238 PolarHBondContact O-N 2.99Å; T234-A238 VanDerWaalsContact O-N 3.16Å
235	C	97	Very high	93.4	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-60.5	-50.3	175.6	-179.1	0	0	0	0	112.8	F229 T231 S232 R237 A238 C245 I246 W247 C254	F229-C235 HydrophobicContact CB-CB 4.22Å; T231-C235 WeakPolarHBondContact O-CB 3.29Å; T231-C235 PolarHBondContact O-N 3.46Å; S232-C235 WeakPolarHBondContact O-CB 3.27Å; S232-C235 PolarHBondContact O-N 2.74Å; C235-R237 VanDerWaalsContact C-N 3.31Å; C235-R237 PolarHBondContact O-N 3.14Å; C235-A238 WeakPolarHBondContact O-CB 3.42Å; C235-A238 PolarHBondContact O-N 3.02Å; C235-A238 VanDerWaalsContact O-N 3.12Å; C235-C245 VanDerWaalsContact O-CB 3.28Å; C235-C245 WeakPolarHBondContact O-CB 3.38Å; C235-I246 PolarHBondContact SG-O 2.84Å; C235-I246 VanDerWaalsContact SG-O 3.34Å; C235-W247 HydrophobicContact CB-CB 4.37Å; C235-W247 HydrophobicContact CB-CE3 3.82Å; C235-C254 WeakPolarHBondContact CA-SG 3.21Å; C235-C254 HydrophobicContact CB-CB 3.53Å; C235-C254 WeakPolarHBondContact CB-SG 3.07Å; C235-C254 VanDerWaalsContact SG-CA 3.52Å; C235-C254 WeakPolarHBondContact SG-CB 3.34Å; C235-C254 CovalentContact SG-SG 2.02Å; C235-C254 PolarHBondContact SG-SG 2.93Å
236	Q	93.4	Very high	93.8	Very high	122 Å²	122	68 Å²	68	57%	0.57	36%	0.357	S	S	*	.	H	α-helix	trans	-61.9	-40.4	-179.9	-72.7	173.4	-0.9	0	0	111.9	S232 A238 T239	S232-Q236 VanDerWaalsContact O-CG 3.29Å; S232-Q236 WeakPolarHBondContact O-CG 3.36Å; S232-Q236 PolarHBondContact O-N 2.8Å; Q236-A238 PolarHBondContact O-N 3.06Å; Q236-T239 PolarHBondContact O-N 3.38Å; Q236-T239 PolarHBondContact O-OG1 2.77Å
237	R	95.5	Very high	93.9	Very high	187 Å²	187	70 Å²	70	71%	0.706	37%	0.365	S	S	*	.	H	α-helix	trans	-69.7	-17.2	177.4	-74.5	-176.5	-68.2	155.5	-4.6	114.1	E233 T234 C235 T239	E233-R237 WeakPolarHBondContact O-CB 3.39Å; E233-R237 WeakPolarHBondContact O-CG 3.34Å; E233-R237 PolarHBondContact O-N 2.96Å; E233-R237 PolarHBondContact O-NE 3.43Å; T234-R237 PolarHBondContact O-N 2.82Å; C235-R237 VanDerWaalsContact C-N 3.31Å; C235-R237 PolarHBondContact O-N 3.14Å; R237-T239 VanDerWaalsContact C-N 3.27Å; R237-T239 PolarHBondContact O-N 2.7Å
238	A	94.7	Very high	94.3	Very high	11 Å²	11	67.1 Å²	67.1	9%	0.091	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-12.1	178.8	0	0	0	0	0	113.8	F229 T234 C235 Q236 T240 M243 C245	F229-A238 HydrophobicContact CD1-CB 4.12Å; F229-A238 HydrophobicContact CD2-CB 3.41Å; F229-A238 VanDerWaalsContact CD2-CB 3.41Å; F229-A238 HydrophobicContact CE1-CB 3.84Å; F229-A238 HydrophobicContact CE2-CB 3.13Å; F229-A238 HydrophobicContact CG-CB 3.92Å; F229-A238 HydrophobicContact CZ-CB 3.35Å; T234-A238 PolarHBondContact O-N 2.99Å; T234-A238 VanDerWaalsContact O-N 3.16Å; C235-A238 WeakPolarHBondContact O-CB 3.42Å; C235-A238 PolarHBondContact O-N 3.02Å; C235-A238 VanDerWaalsContact O-N 3.12Å; Q236-A238 PolarHBondContact O-N 3.06Å; A238-T240 PolarHBondContact O-N 2.9Å; A238-M243 VanDerWaalsContact O-CE 3.3Å; A238-M243 WeakPolarHBondContact O-CE 3.26Å; A238-C245 HydrophobicContact CB-CB 4.47Å
239	T	94.3	Very high	94.5	Very high	62 Å²	62	65.1 Å²	65.1	38%	0.38	34%	0.34	S	S	.	.			trans	-61	133	176.2	-65.9	0	0	0	0	110.8	Q236 R237 M243 C245	Q236-T239 PolarHBondContact O-N 3.38Å; Q236-T239 PolarHBondContact O-OG1 2.77Å; R237-T239 VanDerWaalsContact C-N 3.27Å; R237-T239 PolarHBondContact O-N 2.7Å; T239-M243 CarbonylContact C-O 3.59Å; T239-M243 WeakPolarHBondContact CA-O 3.38Å; T239-C245 PolarHBondContact OG1-N 2.96Å; T239-C245 PolarHBondContact OG1-O 2.89Å
240	T	92.8	Very high	94.5	Very high	79 Å²	79	65.6 Å²	65.6	49%	0.485	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-129.2	179	178	67	0	0	0	0	109.9	A238 N242 M243	A238-T240 PolarHBondContact O-N 2.9Å; T240-N242 PolarHBondContact O-N 2.94Å; T240-N242 PolarHBondContact OG1-N 3.29Å; T240-M243 PolarHBondContact N-O 2.87Å; T240-M243 PolarHBondContact O-N 2.55Å; T240-M243 VanDerWaalsContact O-O 3.09Å; T240-M243 PolarHBondContact OG1-N 2.89Å
241	S	89.2	Confident	94.4	Very high	118 Å²	118	60.4 Å²	60.4	83%	0.825	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.3	176.7	62.7	0	0	0	0	114.2
242	N	89.3	Confident	94.4	Very high	145 Å²	145	63.8 Å²	63.8	78%	0.775	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	-2.7	-173.6	-61.5	-6.8	0	0	0	112.8	T240	T240-N242 PolarHBondContact O-N 2.94Å; T240-N242 PolarHBondContact OG1-N 3.29Å
243	M	92.3	Very high	94.3	Very high	25 Å²	25	66 Å²	66	12%	0.123	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-154.3	122.6	-173.8	178.9	-173	70.4	0	0	110.1	N225 A238 T239 T240 E256 N258	N225-M243 HydrophobicContact CB-CE 4.23Å; N225-M243 HydrophobicContact CB-SD 3.26Å; N225-M243 WeakPolarHBondContact CB-SD 3.11Å; A238-M243 VanDerWaalsContact O-CE 3.3Å; A238-M243 WeakPolarHBondContact O-CE 3.26Å; T239-M243 CarbonylContact C-O 3.59Å; T239-M243 WeakPolarHBondContact CA-O 3.38Å; T240-M243 PolarHBondContact N-O 2.87Å; T240-M243 PolarHBondContact O-N 2.55Å; T240-M243 VanDerWaalsContact O-O 3.09Å; T240-M243 PolarHBondContact OG1-N 2.89Å; M243-E256 HydrophobicContact CG-CG 4.19Å; M243-E256 HydrophobicContact SD-CG 4.42Å; M243-N258 WeakPolarHBondContact CA-OD1 3.12Å
244	T	95.2	Very high	94.3	Very high	40 Å²	40	60.7 Å²	60.7	25%	0.245	31%	0.313	C	S	.	.			trans	-104.4	122.6	177.2	-59.7	0	0	0	0	109.3	E256 S257 N258	T244-E256 CarbonylContact O-C 3.59Å; T244-E256 WeakPolarHBondContact O-CA 3.46Å; T244-S257 PolarHBondContact O-N 3.07Å; T244-N258 PolarHBondContact N-OD1 3.08Å
245	C	96.4	Very high	94.3	Very high	6 Å²	6	59 Å²	59	4%	0.041	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	136.6	175.6	-63.3	0	0	0	0	110.6	C226 C235 A238 T239 I255	C226-C245 HydrophobicContact CB-CB 3.91Å; C226-C245 WeakPolarHBondContact CB-SG 3.41Å; C226-C245 WeakPolarHBondContact SG-CA 3.47Å; C226-C245 WeakPolarHBondContact SG-CB 3.24Å; C226-C245 CovalentContact SG-SG 2.03Å; C226-C245 PolarHBondContact SG-SG 3.2Å; C235-C245 VanDerWaalsContact O-CB 3.28Å; C235-C245 WeakPolarHBondContact O-CB 3.38Å; A238-C245 HydrophobicContact CB-CB 4.47Å; T239-C245 PolarHBondContact OG1-N 2.96Å; T239-C245 PolarHBondContact OG1-O 2.89Å; C245-I255 WeakPolarHBondContact CA-O 3.42Å
246	I	96	Very high	94.2	Very high	15 Å²	15	59.7 Å²	59.7	8%	0.077	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	143.6	170.8	66	170.5	0	0	0	110.7	C235 C254 I255 K266 V267	C235-I246 PolarHBondContact SG-O 2.84Å; C235-I246 VanDerWaalsContact SG-O 3.34Å; I246-C254 WeakPolarHBondContact O-CA 3.45Å; I246-I255 HydrophobicContact CD1-CD1 4.14Å; I246-I255 HydrophobicContact CD1-CG1 4.08Å; I246-I255 HydrophobicContact CG1-CD1 4.21Å; I246-I255 HydrophobicContact CG1-CG1 3.58Å; I246-I255 PolarHBondContact N-O 2.95Å; I246-I255 PolarHBondContact O-N 3.3Å; I246-K266 HydrophobicContact CD1-CB 3.55Å; I246-V267 HydrophobicContact CD1-CG2 4.24Å; I246-V267 HydrophobicContact CG2-CG2 3.88Å
247	W	96.7	Very high	94.2	Very high	42 Å²	42	53.9 Å²	53.9	16%	0.159	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	122.3	174.2	-176.9	-104.8	0	0	0	110.3	N230 C235 N252 C254	N230-W247 VanDerWaalsContact O-CH2 3.3Å; N230-W247 WeakPolarHBondContact O-CH2 3.2Å; C235-W247 HydrophobicContact CB-CB 4.37Å; C235-W247 HydrophobicContact CB-CE3 3.82Å; W247-N252 WeakPolarHBondContact CH2-O 3.35Å; W247-N252 HydrophobicContact CZ2-CB 4.15Å; W247-C254 HydrophobicContact CE3-CB 3.95Å; W247-C254 HydrophobicContact CZ3-CB 4.17Å
248	C	96.1	Very high	94.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	97.1	176.7	-154	0	0	0	0	111.2	K250 V251 N252 K253 C270	C248-K250 VanDerWaalsContact C-N 3.35Å; C248-K250 PolarHBondContact O-N 3.42Å; C248-V251 HydrophobicContact CB-CG2 3.72Å; C248-V251 PolarHBondContact O-N 3.13Å; C248-N252 WeakPolarHBondContact O-CA 3.09Å; C248-N252 PolarHBondContact O-N 2.94Å; C248-K253 WeakPolarHBondContact CA-O 3.49Å; C248-K253 VanDerWaalsContact CB-O 3.28Å; C248-K253 WeakPolarHBondContact CB-O 3.25Å; C248-K253 PolarHBondContact N-O 2.94Å; C248-K253 PolarHBondContact O-N 2.83Å; C248-C270 VanDerWaalsContact CA-SG 3.57Å; C248-C270 HydrophobicContact CB-CB 3.81Å; C248-C270 WeakPolarHBondContact CB-SG 3.32Å; C248-C270 VanDerWaalsContact SG-CA 3.51Å; C248-C270 WeakPolarHBondContact SG-CB 3.3Å; C248-C270 CovalentContact SG-SG 2.05Å; C248-C270 PolarHBondContact SG-SG 2.77Å
249	Q	94.7	Very high	93.9	Very high	89 Å²	89	48.6 Å²	48.6	42%	0.416	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-62.5	-40.6	-174.7	-68.4	176.8	-32.6	0	0	112.2	V251 N252 C270 V272	Q249-V251 PolarHBondContact O-N 2.86Å; Q249-V251 VanDerWaalsContact O-N 3.12Å; Q249-N252 PolarHBondContact O-N 2.88Å; Q249-N252 PolarHBondContact O-OD1 2.75Å; Q249-C270 PolarHBondContact N-O 2.83Å; Q249-C270 VanDerWaalsContact N-O 3.16Å; Q249-V272 HydrophobicContact CB-CG2 3.91Å
250	K	93.3	Very high	93.8	Very high	79 Å²	79	52.1 Å²	52.1	34%	0.343	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-58.4	-28	-178.4	-68.3	-172.2	-178.3	162.7	0	114.6	I42 C248 D269 R271 V272	I42-K250 HydrophobicContact CG2-CB 4.5Å; I42-K250 HydrophobicContact CG2-CD 4.04Å; I42-K250 WeakPolarHBondContact O-CD 3.48Å; I42-K250 PolarHBondContact O-NZ 3Å; C248-K250 VanDerWaalsContact C-N 3.35Å; C248-K250 PolarHBondContact O-N 3.42Å; K250-D269 WeakPolarHBondContact CD-O 3.48Å; K250-D269 VanDerWaalsContact CE-O 3.3Å; K250-D269 WeakPolarHBondContact CE-O 3.49Å; K250-D269 PolarHBondContact NZ-O 3.35Å; K250-R271 WeakPolarHBondContact CE-O 3.4Å; K250-V272 HydrophobicContact CG-CG2 4.06Å
251	V	93.2	Very high	93.7	Very high	25 Å²	25	55 Å²	55	15%	0.152	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-119.3	3.3	180	-62.6	0	0	0	0	112.8	N40 I42 L52 C248 Q249 K253	N40-V251 HydrophobicContact CB-CG1 3.85Å; I42-V251 HydrophobicContact CG1-CG1 3.97Å; I42-V251 HydrophobicContact CG1-CG2 4.48Å; L52-V251 HydrophobicContact CD1-CG2 4.25Å; C248-V251 HydrophobicContact CB-CG2 3.72Å; C248-V251 PolarHBondContact O-N 3.13Å; Q249-V251 PolarHBondContact O-N 2.86Å; Q249-V251 VanDerWaalsContact O-N 3.12Å; V251-K253 VanDerWaalsContact C-N 3.31Å; V251-K253 HydrophobicContact CG2-CB 4.05Å; V251-K253 HydrophobicContact CG2-CG 4.4Å; V251-K253 WeakPolarHBondContact O-CG 3.41Å; V251-K253 PolarHBondContact O-N 2.81Å
252	N	93.7	Very high	93.9	Very high	118 Å²	118	49.6 Å²	49.6	63%	0.631	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	47.4	-175.1	-65	-51.6	0	0	0	113.8	W247 C248 Q249	W247-N252 WeakPolarHBondContact CH2-O 3.35Å; W247-N252 HydrophobicContact CZ2-CB 4.15Å; C248-N252 WeakPolarHBondContact O-CA 3.09Å; C248-N252 PolarHBondContact O-N 2.94Å; Q249-N252 PolarHBondContact O-N 2.88Å; Q249-N252 PolarHBondContact O-OD1 2.75Å
253	K	93.8	Very high	94.1	Very high	75 Å²	75	45.7 Å²	45.7	33%	0.326	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143.9	179.8	-70.2	-175.7	179.8	-162	0	112.1	Y38 C248 V251 I255	Y38-K253 PolarHBondContact OH-NZ 2.89Å; C248-K253 WeakPolarHBondContact CA-O 3.49Å; C248-K253 VanDerWaalsContact CB-O 3.28Å; C248-K253 WeakPolarHBondContact CB-O 3.25Å; C248-K253 PolarHBondContact N-O 2.94Å; C248-K253 PolarHBondContact O-N 2.83Å; V251-K253 VanDerWaalsContact C-N 3.31Å; V251-K253 HydrophobicContact CG2-CB 4.05Å; V251-K253 HydrophobicContact CG2-CG 4.4Å; V251-K253 WeakPolarHBondContact O-CG 3.41Å; V251-K253 PolarHBondContact O-N 2.81Å; K253-I255 HydrophobicContact CB-CG2 4.49Å
254	C	96.2	Very high	94.2	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.007	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	128.4	166.4	-172.1	0	0	0	0	109.5	C226 F229 C235 I246 W247	C226-C254 WeakPolarHBondContact O-CB 3.5Å; C226-C254 PolarHBondContact O-SG 2.85Å; F229-C254 HydrophobicContact CB-CB 4.18Å; F229-C254 VanDerWaalsContact O-CB 3.26Å; F229-C254 WeakPolarHBondContact O-CB 3.44Å; C235-C254 WeakPolarHBondContact CA-SG 3.21Å; C235-C254 HydrophobicContact CB-CB 3.53Å; C235-C254 WeakPolarHBondContact CB-SG 3.07Å; C235-C254 VanDerWaalsContact SG-CA 3.52Å; C235-C254 WeakPolarHBondContact SG-CB 3.34Å; C235-C254 CovalentContact SG-SG 2.02Å; C235-C254 PolarHBondContact SG-SG 2.93Å; I246-C254 WeakPolarHBondContact O-CA 3.45Å; W247-C254 HydrophobicContact CE3-CB 3.95Å; W247-C254 HydrophobicContact CZ3-CB 4.17Å
255	I	95.6	Very high	94.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	154.1	-179.1	61.9	170.4	0	0	0	111.8	L52 C245 I246 K253	L52-I255 HydrophobicContact CD1-CG2 3.77Å; L52-I255 HydrophobicContact CD2-CD1 4.22Å; C245-I255 WeakPolarHBondContact CA-O 3.42Å; I246-I255 HydrophobicContact CD1-CD1 4.14Å; I246-I255 HydrophobicContact CD1-CG1 4.08Å; I246-I255 HydrophobicContact CG1-CD1 4.21Å; I246-I255 HydrophobicContact CG1-CG1 3.58Å; I246-I255 PolarHBondContact N-O 2.95Å; I246-I255 PolarHBondContact O-N 3.3Å; K253-I255 HydrophobicContact CB-CG2 4.49Å
256	E	95.1	Very high	94.1	Very high	14 Å²	14	47.5 Å²	47.5	7%	0.065	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	141.1	173.7	-74.9	-178.8	-146.2	0	0	112	G223 K224 N225 C226 M243 T244 N258 K266	G223-E256 VanDerWaalsContact C-CD 3.45Å; G223-E256 WeakPolarHBondContact CA-OE1 3.49Å; G223-E256 VanDerWaalsContact CA-OE2 3.31Å; G223-E256 WeakPolarHBondContact CA-OE2 3.41Å; G223-E256 PolarHBondContact N-OE2 2.94Å; K224-E256 PolarHBondContact N-OE1 3.42Å; N225-E256 WeakPolarHBondContact CB-OE1 3.23Å; N225-E256 PolarHBondContact N-OE1 2.78Å; C226-E256 HydrophobicContact CB-CG 3.82Å; C226-E256 WeakPolarHBondContact SG-CG 3.25Å; M243-E256 HydrophobicContact CG-CG 4.19Å; M243-E256 HydrophobicContact SD-CG 4.42Å; T244-E256 CarbonylContact O-C 3.59Å; T244-E256 WeakPolarHBondContact O-CA 3.46Å; E256-N258 PolarHBondContact OE2-ND2 3.42Å; E256-K266 PolarHBondContact O-NZ 3.31Å; E256-K266 VanDerWaalsContact O-NZ 3.11Å
257	S	94.7	Very high	94	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.253	C	S	.	.			trans	-140	53	-178.9	-173	0	0	0	0	110.7	T244 H263	T244-S257 PolarHBondContact O-N 3.07Å; S257-H263 VanDerWaalsContact OG-CA 3.32Å; S257-H263 WeakPolarHBondContact OG-CA 3.46Å; S257-H263 PolarHBondContact OG-ND1 3.18Å
258	N	92.2	Very high	93.9	Very high	68 Å²	68	50.8 Å²	50.8	36%	0.364	27%	0.27	S	S	.	.			trans	-78	-21.3	-173.7	-54.7	-33.2	0	0	0	113.4	M243 T244 E256 N260	M243-N258 WeakPolarHBondContact CA-OD1 3.12Å; T244-N258 PolarHBondContact N-OD1 3.08Å; E256-N258 PolarHBondContact OE2-ND2 3.42Å; N258-N260 PolarHBondContact O-N 2.86Å
259	D	91.4	Very high	93.8	Very high	20 Å²	20	51.5 Å²	51.5	11%	0.107	27%	0.273	C	S	.	.			trans	-77.1	112.8	173.4	-171.1	-21.2	0	0	0	109.7	E220 D261 T262 H263	E220-D259 VanDerWaalsContact OE1-CB 3.26Å; E220-D259 WeakPolarHBondContact OE1-CB 3.46Å; D259-D261 PolarHBondContact O-N 3.1Å; D259-D261 WeakPolarHBondContact OD1-CB 3.29Å; D259-D261 PolarHBondContact OD1-N 2.81Å; D259-T262 PolarHBondContact O-N 2.95Å; D259-H263 WeakPolarHBondContact O-CB 2.68Å; D259-H263 PolarHBondContact O-N 3.25Å
260	N	91.2	Very high	93.8	Very high	135 Å²	135	47.4 Å²	47.4	72%	0.722	25%	0.254	S	S	*	.	H	α-helix	trans	-62.7	-32.9	-179.6	-75.4	-18.2	0	0	0	112.1	N258 T262	N258-N260 PolarHBondContact O-N 2.86Å; N260-T262 VanDerWaalsContact C-N 3.28Å; N260-T262 PolarHBondContact O-N 2.86Å
261	D	91.1	Very high	93.7	Very high	140 Å²	140	50.6 Å²	50.6	75%	0.749	26%	0.264	S	S	*	.	H	α-helix	trans	-71.1	-29	-176.3	-63.9	-22	0	0	0	111.2	D259	D259-D261 PolarHBondContact O-N 3.1Å; D259-D261 WeakPolarHBondContact OD1-CB 3.29Å; D259-D261 PolarHBondContact OD1-N 2.81Å
262	T	92.9	Very high	93.3	Very high	4 Å²	4	53.1 Å²	53.1	3%	0.025	28%	0.279	C	S	.	.	H	α-helix	trans	-104.8	-7.9	-179.4	75.4	0	0	0	0	113.5	E220 D259 N260 G264 L265 K266	E220-T262 PolarHBondContact OE1-OG1 2.9Å; E220-T262 PolarHBondContact OE2-OG1 2.65Å; D259-T262 PolarHBondContact O-N 2.95Å; N260-T262 VanDerWaalsContact C-N 3.28Å; N260-T262 PolarHBondContact O-N 2.86Å; T262-G264 PolarHBondContact O-N 2.69Å; T262-L265 WeakPolarHBondContact O-CB 3.46Å; T262-L265 PolarHBondContact O-N 2.89Å; T262-L265 VanDerWaalsContact O-N 3.15Å; T262-K266 WeakPolarHBondContact O-CG 3.2Å; T262-K266 PolarHBondContact O-N 3.08Å
263	H	94.5	Very high	92.6	Very high	64 Å²	64	55.6 Å²	55.6	30%	0.296	29%	0.287	S	S	.	.	H	α-helix	trans	-54.4	-52	-176.8	175.6	72.1	0	0	0	112.9	S257 D259 L265 K266 V267	S257-H263 VanDerWaalsContact OG-CA 3.32Å; S257-H263 WeakPolarHBondContact OG-CA 3.46Å; S257-H263 PolarHBondContact OG-ND1 3.18Å; D259-H263 WeakPolarHBondContact O-CB 2.68Å; D259-H263 PolarHBondContact O-N 3.25Å; H263-L265 VanDerWaalsContact C-N 3.31Å; H263-L265 PolarHBondContact O-N 2.84Å; H263-K266 PolarHBondContact O-N 2.86Å; H263-V267 WeakPolarHBondContact O-CG2 3.25Å; H263-V267 PolarHBondContact O-N 3.31Å
264	G	94.5	Very high	91.4	Very high	38 Å²	38	59.1 Å²	59.1	39%	0.392	31%	0.31	S	S	.	.	H	α-helix	trans	-60.8	-39.2	179.2	0	0	0	0	0	112.9	T262 V267 N268	T262-G264 PolarHBondContact O-N 2.69Å; G264-V267 PolarHBondContact O-N 3.31Å; G264-N268 PolarHBondContact O-N 3.2Å; G264-N268 VanDerWaalsContact O-N 3.1Å; G264-N268 PolarHBondContact O-ND2 3.49Å
265	L	94	Very high	89.3	Confident	70 Å²	70	67.6 Å²	67.6	37%	0.366	35%	0.351	S	S	.	.	H	α-helix	trans	-63	-49.6	176	-63.3	176.3	0	0	0	110.8	T262 H263 V267 N268 D269	T262-L265 WeakPolarHBondContact O-CB 3.46Å; T262-L265 PolarHBondContact O-N 2.89Å; T262-L265 VanDerWaalsContact O-N 3.15Å; H263-L265 VanDerWaalsContact C-N 3.31Å; H263-L265 PolarHBondContact O-N 2.84Å; L265-V267 VanDerWaalsContact C-N 3.32Å; L265-V267 PolarHBondContact O-N 3.28Å; L265-N268 PolarHBondContact O-N 2.9Å; L265-N268 VanDerWaalsContact O-N 3.13Å; L265-D269 WeakPolarHBondContact O-CB 3.43Å; L265-D269 PolarHBondContact O-N 3.07Å
266	K	94.6	Very high	87.2	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-59.1	-42.5	178.7	-70.3	179.4	167.1	-178.2	0	112.2	Y50 E220 I222 I246 E256 T262 H263 N268 D269 C270	Y50-K266 WeakPolarHBondContact OH-CE 3.34Å; E220-K266 WeakPolarHBondContact OE1-CE 3.36Å; E220-K266 IonicContact OE1-NZ 3.19Å; E220-K266 PolarHBondContact OE1-NZ 2.87Å; E220-K266 WeakPolarHBondContact OE2-CE 3.05Å; E220-K266 IonicContact OE2-NZ 2.84Å; E220-K266 PolarHBondContact OE2-NZ 3.3Å; I222-K266 VanDerWaalsContact CD1-NZ 3.31Å; I246-K266 HydrophobicContact CD1-CB 3.55Å; E256-K266 PolarHBondContact O-NZ 3.31Å; E256-K266 VanDerWaalsContact O-NZ 3.11Å; T262-K266 WeakPolarHBondContact O-CG 3.2Å; T262-K266 PolarHBondContact O-N 3.08Å; H263-K266 PolarHBondContact O-N 2.86Å; K266-N268 VanDerWaalsContact C-N 3.33Å; K266-N268 PolarHBondContact O-N 3.22Å; K266-D269 PolarHBondContact O-N 2.9Å; K266-C270 WeakPolarHBondContact O-CB 3.28Å; K266-C270 PolarHBondContact O-N 2.92Å; K266-C270 VanDerWaalsContact O-N 3.09Å; K266-C270 PolarHBondContact O-SG 3.05Å
267	V	94.4	Very high	85	Confident	33 Å²	33	79.9 Å²	79.9	20%	0.2	42%	0.421	C	S	.	.	H	α-helix	trans	-59.1	-45.9	176.2	169.9	0	0	0	0	110.6	I246 H263 G264 L265 R271	I246-V267 HydrophobicContact CD1-CG2 4.24Å; I246-V267 HydrophobicContact CG2-CG2 3.88Å; H263-V267 WeakPolarHBondContact O-CG2 3.25Å; H263-V267 PolarHBondContact O-N 3.31Å; G264-V267 PolarHBondContact O-N 3.31Å; L265-V267 VanDerWaalsContact C-N 3.32Å; L265-V267 PolarHBondContact O-N 3.28Å; V267-R271 WeakPolarHBondContact O-CG 3.24Å; V267-R271 PolarHBondContact O-N 3.09Å
268	N	94.1	Very high	82.6	Confident	94 Å²	94	88.1 Å²	88.1	50%	0.503	46%	0.459	S	S	.	.	H	α-helix	trans	-68.1	-45.5	179.3	-69.4	-21.6	0	0	0	112.1	G264 L265 K266 C270 R271	G264-N268 PolarHBondContact O-N 3.2Å; G264-N268 VanDerWaalsContact O-N 3.1Å; G264-N268 PolarHBondContact O-ND2 3.49Å; L265-N268 PolarHBondContact O-N 2.9Å; L265-N268 VanDerWaalsContact O-N 3.13Å; K266-N268 VanDerWaalsContact C-N 3.33Å; K266-N268 PolarHBondContact O-N 3.22Å; N268-C270 PolarHBondContact O-N 3.26Å; N268-R271 PolarHBondContact O-N 2.64Å
269	D	94.6	Very high	80.2	Confident	14 Å²	14	89.3 Å²	89.3	8%	0.075	48%	0.479	C	S	.	.	H	α-helix	trans	-55.5	-37.6	178.6	-68.8	-30.6	0	0	0	111.4	I42 Y48 Y50 R59 K250 L265 K266	I42-D269 HydrophobicContact CG2-CB 4.17Å; I42-D269 WeakPolarHBondContact CG2-O 3.37Å; Y48-D269 VanDerWaalsContact CE1-OD1 3.3Å; Y48-D269 WeakPolarHBondContact CE1-OD1 3.18Å; Y48-D269 VanDerWaalsContact OH-CG 3.29Å; Y48-D269 PolarHBondContact OH-OD1 2.67Å; Y48-D269 VanDerWaalsContact OH-OD1 3.14Å; Y48-D269 PolarHBondContact OH-OD2 2.67Å; Y50-D269 HydrophobicContact CD1-CB 3.67Å; Y50-D269 HydrophobicContact CE1-CB 4.28Å; Y50-D269 HydrophobicContact CG-CB 4.37Å; R59-D269 IonicContact NH2-OD2 2.79Å; K250-D269 WeakPolarHBondContact CD-O 3.48Å; K250-D269 VanDerWaalsContact CE-O 3.3Å; K250-D269 WeakPolarHBondContact CE-O 3.49Å; K250-D269 PolarHBondContact NZ-O 3.35Å; L265-D269 WeakPolarHBondContact O-CB 3.43Å; L265-D269 PolarHBondContact O-N 3.07Å; K266-D269 PolarHBondContact O-N 2.9Å
270	C	94.5	Very high	77.9	Confident	3 Å²	3	98.3 Å²	98.3	2%	0.02	53%	0.534	C	S	.	.	H	α-helix	trans	-82.7	-15.4	-175.1	-85.8	0	0	0	0	116.1	C248 Q249 K266 N268	C248-C270 VanDerWaalsContact CA-SG 3.57Å; C248-C270 HydrophobicContact CB-CB 3.81Å; C248-C270 WeakPolarHBondContact CB-SG 3.32Å; C248-C270 VanDerWaalsContact SG-CA 3.51Å; C248-C270 WeakPolarHBondContact SG-CB 3.3Å; C248-C270 CovalentContact SG-SG 2.05Å; C248-C270 PolarHBondContact SG-SG 2.77Å; Q249-C270 PolarHBondContact N-O 2.83Å; Q249-C270 VanDerWaalsContact N-O 3.16Å; K266-C270 WeakPolarHBondContact O-CB 3.28Å; K266-C270 PolarHBondContact O-N 2.92Å; K266-C270 VanDerWaalsContact O-N 3.09Å; K266-C270 PolarHBondContact O-SG 3.05Å; N268-C270 PolarHBondContact O-N 3.26Å
271	R	91.7	Very high	77.3	Confident	147 Å²	147	96.5 Å²	96.5	56%	0.555	53%	0.525	S	S	*	.	S	Bend	trans	-75.2	138.9	179.1	-78.8	171.8	-179	-177.1	0.9	110.7	K250 V267 N268	K250-R271 WeakPolarHBondContact CE-O 3.4Å; V267-R271 WeakPolarHBondContact O-CG 3.24Å; V267-R271 PolarHBondContact O-N 3.09Å; N268-R271 PolarHBondContact O-N 2.64Å
272	V	85.3	Confident	76.5	Confident	77 Å²	77	94.2 Å²	94.2	47%	0.467	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-79.8	123.5	162.5	179.6	0	0	0	0	106.7	Q249 K250 N274	Q249-V272 HydrophobicContact CB-CG2 3.91Å; K250-V272 HydrophobicContact CG-CG2 4.06Å; V272-N274 PolarHBondContact O-N 2.72Å
273	E	78.2	Confident	75.6	Confident	171 Å²	171	99.2 Å²	99.2	80%	0.799	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-64.6	119.4	167.1	-71.3	179.9	-177.9	0	0	107.4	M275	E273-M275 PolarHBondContact O-N 2.86Å
274	N	68.5	Low	74.5	Confident	149 Å²	149	101.2 Å²	101.2	80%	0.797	56%	0.555	S	S	*	*			trans	-63.1	106.8	167.1	-73.1	-18.7	0	0	0	105.9	V272 I276	V272-N274 PolarHBondContact O-N 2.72Å; N274-I276 PolarHBondContact O-N 3.11Å
275	M	52.9	Low	73.3	Confident	178 Å²	178	105.2 Å²	105.2	88%	0.877	57%	0.565	S	S	*	*			trans	-57.2	101.2	161	-70.9	-169.5	170.2	0	0	105.3	E273 T277	E273-M275 PolarHBondContact O-N 2.86Å; M275-T277 PolarHBondContact O-N 3.49Å
276	I	51.8	Low	71.9	Confident	148 Å²	148	107.5 Å²	107.5	76%	0.759	58%	0.578	S	S	*	*			trans	-61.5	100.4	160	-60.3	174.5	0	0	0	102.3	N274 E278	N274-I276 PolarHBondContact O-N 3.11Å; I276-E278 PolarHBondContact O-N 2.84Å
277	T	48.5	Very low	70.3	Confident	124 Å²	124	115.2 Å²	115.2	76%	0.761	62%	0.619	S	S	*	*			trans	-57.1	97.2	161.4	33.9	0	0	0	0	105.1	M275 A279	M275-T277 PolarHBondContact O-N 3.49Å; T277-A279 PolarHBondContact O-N 2.95Å
278	E	44.2	Very low	68.4	Low	174 Å²	174	121.5 Å²	121.5	81%	0.813	65%	0.651	S	S	*	*			trans	-61.9	89.3	160.5	-74.1	-174.6	164.1	0	0	105.8	I276 T280	I276-E278 PolarHBondContact O-N 2.84Å; E278-T280 PolarHBondContact O-N 3.06Å
279	A	41.7	Very low	66.3	Low	93 Å²	93	123.8 Å²	123.8	77%	0.769	66%	0.664	S	S	*	*			trans	-79.8	92.4	165	0	0	0	0	0	106.9	T277	T277-A279 PolarHBondContact O-N 2.95Å
280	T	43.4	Very low	63.7	Low	208 Å²	208	133.8 Å²	133.8	100%	1.276	72%	0.717	S	S	*	*			trans	-143.1	0	153.8	36.2	0	0	0	0	109.3	E278	E278-T280 PolarHBondContact O-N 3.06Å

Retrieved 280 of 280 residues in 727.6 ms (Link to these results)

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