A0A087YFP5_POEFO Loading...

AlkB homolog 4, lysine demthylase

AlphaFold DB , UniProt , Accession A0A087YFP5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 279 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.2	Very low	36.8	Very low	248 Å²	248	142.5 Å²	142.5	100%	1.222	81%	0.814	S	S	*	*				0	123.6	0	-70.4	-179.2	-155	0	0	106.8
2	M	31.4	Very low	38.3	Very low	193 Å²	193	139 Å²	139	95%	0.951	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-66.5	130.8	-164.2	-71	170.6	158.4	0	0	111.3
3	A	32.1	Very low	41	Very low	84 Å²	84	134.8 Å²	134.8	69%	0.694	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-64	145.9	164.2	0	0	0	0	0	108.8	D5	A3-D5 PolarHBondContact O-N 3.38Å
4	P	34	Very low	44.2	Very low	119 Å²	119	126.9 Å²	126.9	77%	0.773	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-64.9	132.9	-176.7	25.5	-31.4	0	0	0	110.6	I6	P4-I6 PolarHBondContact O-N 3.4Å; P4-I6 VanDerWaalsContact O-N 3.08Å
5	D	31.7	Very low	47.1	Very low	154 Å²	154	119.5 Å²	119.5	82%	0.824	71%	0.705	S	S	*	*			trans	-54.1	110	171.5	-81.4	-45.9	0	0	0	109.9	A3 N7	A3-D5 PolarHBondContact O-N 3.38Å; D5-N7 VanDerWaalsContact C-N 3.32Å; D5-N7 PolarHBondContact O-N 2.69Å; D5-N7 VanDerWaalsContact O-N 3.07Å
6	I	37	Very low	49.6	Very low	161 Å²	161	113.6 Å²	113.6	83%	0.826	67%	0.672	S	S	*	*			trans	-74.2	96.1	162.9	-59.2	176.2	0	0	0	105.4	P4 N8	P4-I6 PolarHBondContact O-N 3.4Å; P4-I6 VanDerWaalsContact O-N 3.08Å; I6-N8 PolarHBondContact O-N 3.35Å
7	N	33.1	Very low	51.6	Low	131 Å²	131	115.5 Å²	115.5	70%	0.701	67%	0.669	S	S	*	*			trans	-48.2	107.7	165.3	-90.9	-10.3	0	0	0	109	D5 D9	D5-N7 VanDerWaalsContact C-N 3.32Å; D5-N7 PolarHBondContact O-N 2.69Å; D5-N7 VanDerWaalsContact O-N 3.07Å; N7-D9 PolarHBondContact O-N 2.75Å
8	N	37.7	Very low	53.4	Low	153 Å²	153	113.4 Å²	113.4	82%	0.818	68%	0.677	S	S	*	*			trans	-79.1	63.4	172.9	-169.3	19.7	0	0	0	109.4	I6 G10	I6-N8 PolarHBondContact O-N 3.35Å; N8-G10 PolarHBondContact O-N 3.17Å; N8-G10 VanDerWaalsContact O-N 3.1Å
9	D	40.9	Very low	54.9	Low	136 Å²	136	115.9 Å²	115.9	73%	0.727	68%	0.684	S	S	*	*			trans	-82.4	63.4	169.3	-78.7	-33.8	0	0	0	110	N7	N7-D9 PolarHBondContact O-N 2.75Å
10	G	41.6	Very low	56.4	Low	65 Å²	65	114.9 Å²	114.9	67%	0.67	67%	0.668	S	S	*	*			trans	-97.8	39	176.3	0	0	0	0	0	113.1	N8 S12	N8-G10 PolarHBondContact O-N 3.17Å; N8-G10 VanDerWaalsContact O-N 3.1Å; G10-S12 PolarHBondContact O-N 3.24Å
11	V	48	Very low	57.8	Low	124 Å²	124	113.5 Å²	113.5	75%	0.752	65%	0.652	S	S	*	*			trans	-58.7	128.8	-178.8	176.3	0	0	0	0	110.2	S13	V11-S13 PolarHBondContact O-N 3.48Å
12	S	54.5	Low	60.3	Low	100 Å²	100	101.7 Å²	101.7	70%	0.699	59%	0.594	S	S	*	*			trans	-54.3	101.1	-176.1	57.5	0	0	0	0	113.6	G10 C14	G10-S12 PolarHBondContact O-N 3.24Å; S12-C14 PolarHBondContact O-N 3.25Å
13	S	74.3	Confident	63.1	Low	85 Å²	85	95.2 Å²	95.2	59%	0.594	56%	0.563	S	S	*	*			trans	-73.7	20.6	176.6	64.8	0	0	0	0	114.7	V11	V11-S13 PolarHBondContact O-N 3.48Å
14	C	84.9	Confident	65.8	Low	23 Å²	23	92.6 Å²	92.6	16%	0.155	54%	0.538	C	S	.	.			trans	-143.1	140.4	-171.5	-168	0	0	0	0	112.7	S12 C16 C22 C25	S12-C14 PolarHBondContact O-N 3.25Å; C14-C16 VanDerWaalsContact C-N 3.33Å; C14-C16 PolarHBondContact SG-SG 3.3Å; C14-C22 PolarHBondContact SG-SG 3.06Å; C14-C25 PolarHBondContact SG-SG 2.91Å
15	G	88.2	Confident	68.4	Low	16 Å²	16	88.3 Å²	88.3	17%	0.165	51%	0.51	C	S	.	.			trans	-85.5	3.5	176.9	0	0	0	0	0	115	S99 Q100	G15-S99 CarbonylContact C-O 3.59Å; G15-S99 WeakPolarHBondContact CA-O 3.46Å; G15-Q100 WeakPolarHBondContact O-CG 3.31Å
16	C	87.1	Confident	71.1	Confident	26 Å²	26	84.6 Å²	84.6	18%	0.176	49%	0.488	C	S	.	.			trans	-61.1	138.3	176.9	-75.8	0	0	0	0	112.2	C14 R20 C22 S101	C14-C16 VanDerWaalsContact C-N 3.33Å; C14-C16 PolarHBondContact SG-SG 3.3Å; C16-R20 WeakPolarHBondContact CB-O 3.35Å; C16-C22 PolarHBondContact SG-N 2.78Å; C16-S101 PolarHBondContact SG-N 3.01Å; C16-S101 VanDerWaalsContact SG-N 3.37Å
17	K	83.8	Confident	73.3	Confident	146 Å²	146	85.3 Å²	85.3	64%	0.635	49%	0.485	S	S	*	.			trans	-136.7	146.4	-178.9	-61.3	-174.4	-176.3	179.5	0	110.9	I19 R20	K17-I19 PolarHBondContact O-N 3.37Å; K17-R20 WeakPolarHBondContact O-CB 3.36Å; K17-R20 PolarHBondContact O-N 3.28Å
18	G	84.3	Confident	75.2	Confident	78 Å²	78	87.2 Å²	87.2	80%	0.804	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	-130.2	177.7	0	0	0	0	0	112.3	R20	G18-R20 VanDerWaalsContact C-N 3.27Å; G18-R20 PolarHBondContact O-N 3.3Å
19	I	81.1	Confident	76.3	Confident	160 Å²	160	86.6 Å²	86.6	82%	0.821	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-15.8	179	63.9	171.4	0	0	0	113.5	K17 R21	K17-I19 PolarHBondContact O-N 3.37Å; I19-R21 PolarHBondContact O-N 3.16Å
20	R	84.4	Confident	76.9	Confident	95 Å²	95	82.6 Å²	82.6	36%	0.358	47%	0.468	S	S	.	.			trans	-73.2	126.8	-174.9	-56.9	-177.6	168.2	128.4	7.3	110.2	C16 K17 G18 D166	C16-R20 WeakPolarHBondContact CB-O 3.35Å; K17-R20 WeakPolarHBondContact O-CB 3.36Å; K17-R20 PolarHBondContact O-N 3.28Å; G18-R20 VanDerWaalsContact C-N 3.27Å; G18-R20 PolarHBondContact O-N 3.3Å; R20-D166 VanDerWaalsContact CD-OD2 3.22Å; R20-D166 WeakPolarHBondContact CD-OD2 3.37Å; R20-D166 VanDerWaalsContact CG-OD2 3.24Å; R20-D166 WeakPolarHBondContact CG-OD2 3.27Å; R20-D166 IonicContact CZ-OD2 3.09Å; R20-D166 IonicContact NE-OD2 2.67Å; R20-D166 PolarHBondContact NE-OD2 2.75Å; R20-D166 IonicContact NH2-OD2 2.76Å
21	R	85.7	Confident	77.3	Confident	87 Å²	87	89.9 Å²	89.9	33%	0.328	48%	0.482	S	S	.	.			trans	-134.1	144.8	-178.9	-60.8	-175.5	-172.9	-157.7	8	111	I19 C25 E26 R235	I19-R21 PolarHBondContact O-N 3.16Å; R21-C25 HydrophobicContact CB-CB 4.19Å; R21-C25 HydrophobicContact CG-CB 4.48Å; R21-E26 HydrophobicContact CB-CG 4.16Å; R21-R235 PolarHBondContact O-NH2 3.05Å
22	C	89.9	Confident	77.3	Confident	0 Å²	0	88.7 Å²	88.7	0%	0	48%	0.475	C	S	.	.			trans	-105.9	169	170.1	76.1	0	0	0	0	108.8	C14 C16 V24 C25 E26 G102 R161	C14-C22 PolarHBondContact SG-SG 3.06Å; C16-C22 PolarHBondContact SG-N 2.78Å; C22-V24 PolarHBondContact O-N 3.13Å; C22-C25 WeakPolarHBondContact O-CB 3.49Å; C22-C25 PolarHBondContact O-N 3.47Å; C22-C25 PolarHBondContact SG-N 3.1Å; C22-C25 VanDerWaalsContact SG-SG 3.6Å; C22-E26 WeakPolarHBondContact O-CG 3.21Å; C22-E26 PolarHBondContact O-N 3.28Å; C22-G102 VanDerWaalsContact CB-CA 3.42Å; C22-R161 VanDerWaalsContact CB-O 3.25Å; C22-R161 WeakPolarHBondContact CB-O 3.43Å
23	L	90.9	Very high	77.1	Confident	56 Å²	56	92.1 Å²	92.1	29%	0.293	48%	0.48	S	S	.	.	H	α-helix	trans	-57	-29	-180	-72.1	175	0	0	0	112.9	K27 R161 R235	L23-K27 WeakPolarHBondContact O-CG 3.49Å; L23-K27 PolarHBondContact O-N 3.48Å; L23-R161 PolarHBondContact N-O 2.75Å; L23-R235 VanDerWaalsContact CD2-NH1 3.27Å
24	V	89.5	Confident	75.6	Confident	30 Å²	30	94.6 Å²	94.6	18%	0.182	49%	0.492	C	S	.	.	H	α-helix	trans	-71.1	-46.1	175.2	-178.6	0	0	0	0	110.9	C22 E26 K27 F28	C22-V24 PolarHBondContact O-N 3.13Å; V24-E26 VanDerWaalsContact C-N 3.25Å; V24-E26 PolarHBondContact O-N 2.84Å; V24-K27 PolarHBondContact O-N 3.16Å; V24-F28 HydrophobicContact CG1-CD2 4Å; V24-F28 HydrophobicContact CG1-CE2 3.71Å; V24-F28 VanDerWaalsContact O-CD2 3.23Å; V24-F28 WeakPolarHBondContact O-CD2 3.38Å; V24-F28 PolarHBondContact O-N 3.34Å
25	C	87.2	Confident	73.7	Confident	28 Å²	28	101.8 Å²	101.8	19%	0.189	52%	0.523	C	S	.	.	H	α-helix	trans	-61.4	-34.1	177.4	-66.1	0	0	0	0	112.9	C14 R21 C22 K27 F28 K29	C14-C25 PolarHBondContact SG-SG 2.91Å; R21-C25 HydrophobicContact CB-CB 4.19Å; R21-C25 HydrophobicContact CG-CB 4.48Å; C22-C25 WeakPolarHBondContact O-CB 3.49Å; C22-C25 PolarHBondContact O-N 3.47Å; C22-C25 PolarHBondContact SG-N 3.1Å; C22-C25 VanDerWaalsContact SG-SG 3.6Å; C25-K27 VanDerWaalsContact C-N 3.32Å; C25-F28 PolarHBondContact O-N 3.14Å; C25-K29 PolarHBondContact O-N 3.31Å
26	E	88.4	Confident	71.5	Confident	76 Å²	76	107.1 Å²	107.1	36%	0.355	55%	0.553	S	S	.	*	H	α-helix	trans	-67.1	-30.1	178	-69.1	166.6	-150.3	0	0	112.7	R21 C22 V24 R235	R21-E26 HydrophobicContact CB-CG 4.16Å; C22-E26 WeakPolarHBondContact O-CG 3.21Å; C22-E26 PolarHBondContact O-N 3.28Å; V24-E26 VanDerWaalsContact C-N 3.25Å; V24-E26 PolarHBondContact O-N 2.84Å; E26-R235 IonicContact OE1-CZ 2.64Å; E26-R235 IonicContact OE1-NH1 3.56Å; E26-R235 PolarHBondContact OE1-NH1 2.92Å; E26-R235 IonicContact OE1-NH2 3.68Å; E26-R235 PolarHBondContact OE1-NH2 2.74Å; E26-R235 IonicContact OE2-NH1 3.88Å; E26-R235 PolarHBondContact OE2-NH1 2.78Å
27	K	83.5	Confident	69.5	Low	177 Å²	177	117 Å²	117	77%	0.77	59%	0.586	S	S	*	*	H	α-helix	trans	-73.1	-35.2	176.4	-70.6	175.6	-177.8	-175.4	0	113.2	L23 V24 C25	L23-K27 WeakPolarHBondContact O-CG 3.49Å; L23-K27 PolarHBondContact O-N 3.48Å; V24-K27 PolarHBondContact O-N 3.16Å; C25-K27 VanDerWaalsContact C-N 3.32Å
28	F	73.1	Confident	68.1	Low	170 Å²	170	116.6 Å²	116.6	75%	0.746	59%	0.586	S	S	*	*	H	α-helix	trans	-89	-31	-174.3	-74.3	-74.3	0	0	0	114.2	V24 C25	V24-F28 HydrophobicContact CG1-CD2 4Å; V24-F28 HydrophobicContact CG1-CE2 3.71Å; V24-F28 VanDerWaalsContact O-CD2 3.23Å; V24-F28 WeakPolarHBondContact O-CD2 3.38Å; V24-F28 PolarHBondContact O-N 3.34Å; C25-F28 PolarHBondContact O-N 3.14Å
29	K	61.9	Low	66.8	Low	140 Å²	140	118.1 Å²	118.1	61%	0.609	58%	0.582	S	S	*	*	S	Bend	trans	-100.3	97.2	173.4	-67.1	-174.4	178	-175.6	0	106.5	C25 K31	C25-K29 PolarHBondContact O-N 3.31Å; K29-K31 PolarHBondContact O-N 2.99Å
30	G	53.5	Low	65.7	Low	52 Å²	52	119.7 Å²	119.7	54%	0.536	59%	0.586	S	S	.	*			trans	-39.7	140.9	177.4	0	0	0	0	0	111.1	T32	G30-T32 VanDerWaalsContact C-N 3.34Å; G30-T32 PolarHBondContact O-N 3.45Å; G30-T32 PolarHBondContact O-OG1 3.04Å
31	K	49.7	Very low	65.2	Low	219 Å²	219	122.4 Å²	122.4	95%	0.952	60%	0.6	S	S	*	*			trans	-42.8	93.6	-174.4	-67.7	-179	178	-177.8	0	110.9	K29	K29-K31 PolarHBondContact O-N 2.99Å
32	T	47.2	Very low	65.2	Low	99 Å²	99	122.5 Å²	122.5	61%	0.607	61%	0.611	S	S	*	*			trans	-121.7	85.4	177.8	-34	0	0	0	0	106.8	G30	G30-T32 VanDerWaalsContact C-N 3.34Å; G30-T32 PolarHBondContact O-N 3.45Å; G30-T32 PolarHBondContact O-OG1 3.04Å
33	Q	50.7	Low	65.2	Low	171 Å²	171	125.1 Å²	125.1	80%	0.799	63%	0.627	S	S	*	*				-179.5	122.3	125.9	-95.7	171.2	13.2	0	0	107.4	E35	Q33-E35 PolarHBondContact O-N 3.4Å
34	T	43.3	Very low	65.2	Low	138 Å²	138	124.9 Å²	124.9	85%	0.847	62%	0.624	S	S	*	*			trans	-50.6	117.8	157.9	0.1	0	0	0	0	107.5	T36	T34-T36 PolarHBondContact O-N 2.89Å
35	E	44.8	Very low	65.4	Low	174 Å²	174	128.1 Å²	128.1	81%	0.813	64%	0.637	S	S	*	*			trans	-62.6	102.7	169	-70.2	173.1	176.3	0	0	107.3	Q33 R37	Q33-E35 PolarHBondContact O-N 3.4Å; E35-R37 VanDerWaalsContact C-N 3.26Å; E35-R37 PolarHBondContact O-N 3.43Å
36	T	41.7	Very low	65.8	Low	128 Å²	128	127.2 Å²	127.2	79%	0.785	63%	0.63	S	S	*	*			trans	-61.3	103	151.5	41.8	0	0	0	0	105.1	T34 E38	T34-T36 PolarHBondContact O-N 2.89Å; T36-E38 VanDerWaalsContact C-N 3.27Å; T36-E38 PolarHBondContact O-N 3.18Å
37	R	44.5	Very low	66.2	Low	232 Å²	232	126.5 Å²	126.5	88%	0.875	63%	0.628	S	S	*	*			trans	-54.8	97.5	169.4	-83.6	177.6	164.5	174.5	-8	106.9	E35	E35-R37 VanDerWaalsContact C-N 3.26Å; E35-R37 PolarHBondContact O-N 3.43Å
38	E	54.7	Low	66.9	Low	138 Å²	138	118.9 Å²	118.9	65%	0.645	60%	0.595	S	S	*	*			trans	-54.4	142.7	157.1	-70.7	-160.3	171.9	0	0	106.5	T36 E40 K41	T36-E38 VanDerWaalsContact C-N 3.27Å; T36-E38 PolarHBondContact O-N 3.18Å; E38-E40 PolarHBondContact O-N 3.41Å; E38-K41 IonicContact OE2-NZ 2.85Å
39	P	56	Low	68	Low	110 Å²	110	113.7 Å²	113.7	71%	0.714	58%	0.575	S	S	*	*			trans	-50.6	135.2	176.3	20.7	-31.2	0	0	0	109	K41	P39-K41 VanDerWaalsContact C-N 3.33Å; P39-K41 PolarHBondContact O-N 3.1Å
40	E	59.8	Low	69.5	Low	194 Å²	194	109.2 Å²	109.2	91%	0.907	56%	0.564	S	S	*	*			trans	-54.2	99.2	175.5	-83.5	177.8	166.8	0	0	108.2	E38 T42	E38-E40 PolarHBondContact O-N 3.41Å; E40-T42 PolarHBondContact O-N 2.99Å
41	K	74.1	Confident	71.3	Confident	151 Å²	151	115.3 Å²	115.3	66%	0.657	58%	0.578	S	S	*	*			trans	-68.2	128.1	170.8	-70.9	178.2	-176.5	166	0	105.9	E38 P39 V43	E38-K41 IonicContact OE2-NZ 2.85Å; P39-K41 VanDerWaalsContact C-N 3.33Å; P39-K41 PolarHBondContact O-N 3.1Å; K41-V43 PolarHBondContact O-N 3.24Å; K41-V43 VanDerWaalsContact O-N 3.17Å
42	T	83.9	Confident	73.5	Confident	90 Å²	90	108.5 Å²	108.5	55%	0.552	56%	0.555	S	S	*	*			trans	-55.5	123	171.1	-52.6	0	0	0	0	108.5	E40 G205 G206	E40-T42 PolarHBondContact O-N 2.99Å; T42-G205 CarbonylContact O-C 3.49Å; T42-G205 WeakPolarHBondContact O-CA 3.3Å; T42-G206 PolarHBondContact O-N 3.11Å
43	V	89.9	Confident	75.8	Confident	54 Å²	54	109 Å²	109	33%	0.327	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	123.6	173.2	-179.1	0	0	0	0	108.6	K41 H45 G206 H208	K41-V43 PolarHBondContact O-N 3.24Å; K41-V43 VanDerWaalsContact O-N 3.17Å; V43-H45 PolarHBondContact O-CD2 2.81Å; V43-G206 CarbonylContact C-O 3.51Å; V43-G206 VanDerWaalsContact CA-O 3.26Å; V43-G206 WeakPolarHBondContact CA-O 3.44Å; V43-H208 HydrophobicContact CG1-CB 4.48Å
44	H	91.3	Very high	78	Confident	52 Å²	52	103.2 Å²	103.2	24%	0.241	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	135.3	176.1	-55.8	-82.3	0	0	0	109.5	F46 V204 G206 I207 H208	H44-F46 HydrophobicContact CB-CD2 4.39Å; H44-F46 HydrophobicContact CB-CE2 3.57Å; H44-F46 HydrophobicContact CB-CZ 4.29Å; H44-V204 PolarHBondContact NE2-O 3.32Å; H44-G206 PolarHBondContact N-O 3.24Å; H44-I207 HydrophobicContact CB-CG1 4.34Å; H44-I207 WeakPolarHBondContact O-CA 3.46Å; H44-H208 PolarHBondContact O-N 3.23Å
45	H	93.7	Very high	80.5	Confident	97 Å²	97	96.7 Å²	96.7	45%	0.449	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.3	-176.2	-69.4	-94	0	0	0	111.6	V43 K58 H208	V43-H45 PolarHBondContact O-CD2 2.81Å; H45-K58 PolarHBondContact O-N 2.99Å; H45-H208 WeakPolarHBondContact CA-O 3.46Å; H45-H208 AromaticContact CE1-ND1 3.64Å
46	F	95.9	Very high	82.8	Confident	10 Å²	10	91.2 Å²	91.2	4%	0.044	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	155.8	-179.8	-60.9	-98.7	0	0	0	110.8	H44 A55 V56 C57 F67 L203 I207 H208 V209 A210	H44-F46 HydrophobicContact CB-CD2 4.39Å; H44-F46 HydrophobicContact CB-CE2 3.57Å; H44-F46 HydrophobicContact CB-CZ 4.29Å; F46-A55 HydrophobicContact CB-CB 3.84Å; F46-A55 HydrophobicContact CD1-CB 4.28Å; F46-A55 HydrophobicContact CG-CB 4.19Å; F46-V56 CarbonylContact C-O 3.53Å; F46-V56 VanDerWaalsContact CA-O 3.26Å; F46-V56 WeakPolarHBondContact CA-O 3.48Å; F46-C57 HydrophobicContact CD1-CB 4.18Å; F46-C57 HydrophobicContact CE1-CB 4.02Å; F46-F67 HydrophobicContact CD1-CD1 4.21Å; F46-F67 AromaticContact CD1-CE1 3.81Å; F46-F67 HydrophobicContact CD1-CE1 3.81Å; F46-F67 AromaticContact CD2-CE1 3.85Å; F46-F67 HydrophobicContact CD2-CE1 3.85Å; F46-F67 AromaticContact CE1-CD1 3.96Å; F46-F67 HydrophobicContact CE1-CD1 3.96Å; F46-F67 AromaticContact CE1-CE1 3.8Å; F46-F67 HydrophobicContact CE1-CE1 3.8Å; F46-F67 AromaticContact CE2-CE1 3.8Å; F46-F67 HydrophobicContact CE2-CE1 3.8Å; F46-F67 AromaticContact CG-CE1 3.87Å; F46-F67 HydrophobicContact CG-CE1 3.87Å; F46-F67 HydrophobicContact CZ-CD1 4.2Å; F46-F67 AromaticContact CZ-CE1 3.81Å; F46-F67 HydrophobicContact CZ-CE1 3.81Å; F46-L203 HydrophobicContact CE2-CD1 4.12Å; F46-L203 HydrophobicContact CZ-CD1 3.69Å; F46-L203 HydrophobicContact CZ-CD2 3.97Å; F46-I207 HydrophobicContact CD2-CG2 3.74Å; F46-I207 HydrophobicContact CE2-CG2 3.83Å; F46-H208 PolarHBondContact N-O 3.23Å; F46-V209 HydrophobicContact CB-CG2 4.24Å; F46-V209 WeakPolarHBondContact O-CA 3.2Å; F46-A210 PolarHBondContact O-N 3.36Å
47	L	96.7	Very high	85	Confident	61 Å²	61	87.3 Å²	87.3	32%	0.319	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	133	168.8	-177.4	67.3	0	0	0	109	A55 V56 A210 R212	L47-A55 CarbonylContact O-C 3.49Å; L47-A55 WeakPolarHBondContact O-CA 3.21Å; L47-V56 PolarHBondContact N-O 3.43Å; L47-V56 PolarHBondContact O-N 2.88Å; L47-A210 HydrophobicContact CD1-CB 4.31Å; L47-R212 HydrophobicContact CD1-CG 4.08Å
48	Y	97.9	Very high	86.3	Confident	17 Å²	17	84.4 Å²	84.4	7%	0.067	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	127.7	171.7	178.9	-108.9	0	0	0	110.6	A50 L54 F69 V72 A210 V211	Y48-A50 HydrophobicContact CD1-CB 4.46Å; Y48-A50 HydrophobicContact CE1-CB 3.89Å; Y48-L54 WeakPolarHBondContact CA-O 3.44Å; Y48-F69 HydrophobicContact CD2-CB 4.04Å; Y48-F69 AromaticContact CD2-CD1 3.6Å; Y48-F69 HydrophobicContact CD2-CD1 3.6Å; Y48-F69 HydrophobicContact CD2-CG 4.19Å; Y48-F69 HydrophobicContact CE2-CB 4.18Å; Y48-F69 AromaticContact CE2-CD1 3.89Å; Y48-F69 HydrophobicContact CE2-CD1 3.89Å; Y48-F69 WeakPolarHBondContact CE2-O 3.37Å; Y48-F69 HydrophobicContact CG-CD1 4.48Å; Y48-V72 HydrophobicContact CD1-CG1 4.33Å; Y48-V72 HydrophobicContact CE1-CB 4.04Å; Y48-V72 HydrophobicContact CE1-CG1 3.75Å; Y48-V72 HydrophobicContact CE2-CB 4.25Å; Y48-V72 PolarHBondContact OH-O 2.84Å; Y48-A210 PolarHBondContact N-O 3.17Å; Y48-V211 HydrophobicContact CD1-CG1 4.01Å; Y48-V211 HydrophobicContact CD1-CG2 4.24Å; Y48-V211 HydrophobicContact CG-CG2 4.07Å
49	D	95.8	Very high	86.5	Confident	60 Å²	60	83.4 Å²	83.4	32%	0.321	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	116.2	171.4	-177.4	-72	0	0	0	109.3	E51 T52 K53 L54 V56	D49-E51 PolarHBondContact OD1-N 3.18Å; D49-E51 VanDerWaalsContact OD1-N 3.14Å; D49-T52 WeakPolarHBondContact CB-OG1 3.5Å; D49-T52 WeakPolarHBondContact OD1-CB 3.4Å; D49-T52 WeakPolarHBondContact OD1-CG2 3.19Å; D49-T52 PolarHBondContact OD1-N 3.36Å; D49-T52 PolarHBondContact OD1-OG1 2.93Å; D49-K53 WeakPolarHBondContact O-CA 3.43Å; D49-K53 PolarHBondContact O-N 2.81Å; D49-L54 PolarHBondContact N-O 3.41Å; D49-L54 PolarHBondContact O-N 2.96Å; D49-V56 HydrophobicContact CB-CG2 4.32Å
50	A	93.8	Very high	86.2	Confident	46 Å²	46	81.7 Å²	81.7	38%	0.38	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-25.2	-172.7	0	0	0	0	0	113.9	Y48 L74	Y48-A50 HydrophobicContact CD1-CB 4.46Å; Y48-A50 HydrophobicContact CE1-CB 3.89Å; A50-L74 HydrophobicContact CB-CB 4.48Å; A50-L74 HydrophobicContact CB-CD2 4.27Å
51	E	92.4	Very high	85.5	Confident	180 Å²	180	80.6 Å²	80.6	84%	0.841	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-48.8	-179.1	-176.4	174.4	-174.1	0	0	110.5	D49	D49-E51 PolarHBondContact OD1-N 3.18Å; D49-E51 VanDerWaalsContact OD1-N 3.14Å
52	T	94.8	Very high	84.2	Confident	76 Å²	76	76 Å²	76	47%	0.466	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-16.5	-178.8	64.1	0	0	0	0	113.2	D49 L54	D49-T52 WeakPolarHBondContact CB-OG1 3.5Å; D49-T52 WeakPolarHBondContact OD1-CB 3.4Å; D49-T52 WeakPolarHBondContact OD1-CG2 3.19Å; D49-T52 PolarHBondContact OD1-N 3.36Å; D49-T52 PolarHBondContact OD1-OG1 2.93Å; T52-L54 PolarHBondContact O-N 3.41Å
53	K	96	Very high	82.4	Confident	111 Å²	111	81.1 Å²	81.1	48%	0.483	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	33.7	-174.9	-51	178.4	-177.7	178.1	0	112.7	D49 F69	D49-K53 WeakPolarHBondContact O-CA 3.43Å; D49-K53 PolarHBondContact O-N 2.81Å; K53-F69 PolarHBondContact O-N 2.75Å
54	L	96.3	Very high	80.7	Confident	49 Å²	49	82 Å²	82	26%	0.257	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	149.3	179.7	-60.5	-179.7	0	0	0	110.8	Y48 D49 T52 V56 F67 P68	Y48-L54 WeakPolarHBondContact CA-O 3.44Å; D49-L54 PolarHBondContact N-O 3.41Å; D49-L54 PolarHBondContact O-N 2.96Å; T52-L54 PolarHBondContact O-N 3.41Å; L54-V56 HydrophobicContact CB-CG2 4.16Å; L54-F67 WeakPolarHBondContact CA-O 3.46Å; L54-P68 HydrophobicContact CD2-CB 4.43Å; L54-P68 HydrophobicContact CD2-CG 4.3Å
55	A	96.1	Very high	80	Confident	0 Å²	0	81.8 Å²	81.8	0%	0	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	119.2	159.9	0	0	0	0	0	108	F46 L47 S66 F67 F69 V209	F46-A55 HydrophobicContact CB-CB 3.84Å; F46-A55 HydrophobicContact CD1-CB 4.28Å; F46-A55 HydrophobicContact CG-CB 4.19Å; L47-A55 CarbonylContact O-C 3.49Å; L47-A55 WeakPolarHBondContact O-CA 3.21Å; A55-S66 CarbonylContact O-C 3.52Å; A55-S66 WeakPolarHBondContact O-CA 3.24Å; A55-S66 VanDerWaalsContact O-CB 3.3Å; A55-S66 WeakPolarHBondContact O-CB 3.47Å; A55-F67 HydrophobicContact CB-CD1 3.99Å; A55-F67 HydrophobicContact CB-CD2 4.3Å; A55-F67 HydrophobicContact CB-CE1 3.56Å; A55-F67 HydrophobicContact CB-CE2 3.92Å; A55-F67 HydrophobicContact CB-CG 4.33Å; A55-F67 HydrophobicContact CB-CZ 3.52Å; A55-F67 PolarHBondContact N-O 2.9Å; A55-F67 PolarHBondContact O-N 3.47Å; A55-F69 HydrophobicContact CB-CB 4.05Å; A55-F69 HydrophobicContact CB-CD2 4.43Å; A55-F69 HydrophobicContact CB-CG 4.43Å; A55-V209 HydrophobicContact CB-CG1 3.83Å; A55-V209 HydrophobicContact CB-CG2 3.9Å
56	V	94.4	Very high	79.9	Confident	59 Å²	59	80 Å²	80	36%	0.358	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	129.5	-173.7	-175.5	0	0	0	0	110.1	F46 L47 D49 L54	F46-V56 CarbonylContact C-O 3.53Å; F46-V56 VanDerWaalsContact CA-O 3.26Å; F46-V56 WeakPolarHBondContact CA-O 3.48Å; L47-V56 PolarHBondContact N-O 3.43Å; L47-V56 PolarHBondContact O-N 2.88Å; D49-V56 HydrophobicContact CB-CG2 4.32Å; L54-V56 HydrophobicContact CB-CG2 4.16Å
57	C	87.3	Confident	79.8	Confident	47 Å²	47	79.8 Å²	79.8	32%	0.318	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	140.4	-179.7	-170	0	0	0	0	111.3	F46 A65	F46-C57 HydrophobicContact CD1-CB 4.18Å; F46-C57 HydrophobicContact CE1-CB 4.02Å; C57-A65 HydrophobicContact CB-CB 4.31Å; C57-A65 VanDerWaalsContact CB-O 3.28Å; C57-A65 WeakPolarHBondContact CB-O 3.43Å; C57-A65 PolarHBondContact N-O 2.94Å
58	K	70.5	Confident	79.8	Confident	170 Å²	170	80.4 Å²	80.4	74%	0.739	48%	0.48	S	S	*	.	S	Bend	trans	-79.6	-25.7	179.5	-165	179.5	176.9	-174.1	0	113.1	H45	H45-K58 PolarHBondContact O-N 2.99Å
59	D	60.1	Low	79.8	Confident	118 Å²	118	79.7 Å²	79.7	63%	0.631	48%	0.477	S	S	*	.			trans	-104.7	111.7	-170.5	-57.5	-35.6	0	0	0	110.3	D61	D59-D61 VanDerWaalsContact C-N 3.32Å; D59-D61 PolarHBondContact O-N 3.46Å
60	G	50.5	Low	79.8	Confident	74 Å²	74	80 Å²	80	76%	0.763	48%	0.482	S	S	*	.			trans	-81.6	26.6	-166.2	0	0	0	0	0	117.4
61	D	44.8	Very low	80	Confident	170 Å²	170	78 Å²	78	91%	0.909	47%	0.466	S	S	*	.	S	Bend	trans	-106.9	23.3	-169.9	-66	-21	0	0	0	114.9	D59	D59-D61 VanDerWaalsContact C-N 3.32Å; D59-D61 PolarHBondContact O-N 3.46Å
62	G	45.8	Very low	80.3	Confident	55 Å²	55	69.6 Å²	69.6	57%	0.567	43%	0.427	S	S	*	.	S	Bend	trans	-167.4	147.1	167.3	0	0	0	0	0	108.7	G64	G62-G64 PolarHBondContact O-N 2.96Å
63	E	46.4	Very low	80.4	Confident	198 Å²	198	67.5 Å²	67.5	93%	0.925	41%	0.412	S	S	*	.	S	Bend	trans	-32.2	121	-177.3	-73.2	179.8	149.9	0	0	113.4	A65	E63-A65 PolarHBondContact O-N 3.41Å
64	G	55.2	Low	80.5	Confident	72 Å²	72	63.9 Å²	63.9	74%	0.742	40%	0.397	S	S	*	.			trans	-25.7	83.9	-177.6	0	0	0	0	0	116.6	G62 S66	G62-G64 PolarHBondContact O-N 2.96Å; G64-S66 PolarHBondContact O-N 3.3Å
65	A	76.6	Confident	80.6	Confident	48 Å²	48	65.1 Å²	65.1	40%	0.397	40%	0.399	S	S	.	.			trans	-67	105.9	171	0	0	0	0	0	107.8	C57 E63	C57-A65 HydrophobicContact CB-CB 4.31Å; C57-A65 VanDerWaalsContact CB-O 3.28Å; C57-A65 WeakPolarHBondContact CB-O 3.43Å; C57-A65 PolarHBondContact N-O 2.94Å; E63-A65 PolarHBondContact O-N 3.41Å
66	S	91.6	Very high	80.7	Confident	58 Å²	58	70.2 Å²	70.2	41%	0.406	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	153.8	171.1	62.9	0	0	0	0	109.5	A55 G64	A55-S66 CarbonylContact O-C 3.52Å; A55-S66 WeakPolarHBondContact O-CA 3.24Å; A55-S66 VanDerWaalsContact O-CB 3.3Å; A55-S66 WeakPolarHBondContact O-CB 3.47Å; G64-S66 PolarHBondContact O-N 3.3Å
67	F	93.9	Very high	80.9	Confident	6 Å²	6	72.1 Å²	72.1	3%	0.026	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	151.1	174.4	64.2	-87	0	0	0	111.1	F46 L54 A55 F69 L198 L203 I207 V209 W229	F46-F67 HydrophobicContact CD1-CD1 4.21Å; F46-F67 AromaticContact CD1-CE1 3.81Å; F46-F67 HydrophobicContact CD1-CE1 3.81Å; F46-F67 AromaticContact CD2-CE1 3.85Å; F46-F67 HydrophobicContact CD2-CE1 3.85Å; F46-F67 AromaticContact CE1-CD1 3.96Å; F46-F67 HydrophobicContact CE1-CD1 3.96Å; F46-F67 AromaticContact CE1-CE1 3.8Å; F46-F67 HydrophobicContact CE1-CE1 3.8Å; F46-F67 AromaticContact CE2-CE1 3.8Å; F46-F67 HydrophobicContact CE2-CE1 3.8Å; F46-F67 AromaticContact CG-CE1 3.87Å; F46-F67 HydrophobicContact CG-CE1 3.87Å; F46-F67 HydrophobicContact CZ-CD1 4.2Å; F46-F67 AromaticContact CZ-CE1 3.81Å; F46-F67 HydrophobicContact CZ-CE1 3.81Å; L54-F67 WeakPolarHBondContact CA-O 3.46Å; A55-F67 HydrophobicContact CB-CD1 3.99Å; A55-F67 HydrophobicContact CB-CD2 4.3Å; A55-F67 HydrophobicContact CB-CE1 3.56Å; A55-F67 HydrophobicContact CB-CE2 3.92Å; A55-F67 HydrophobicContact CB-CG 4.33Å; A55-F67 HydrophobicContact CB-CZ 3.52Å; A55-F67 PolarHBondContact N-O 2.9Å; A55-F67 PolarHBondContact O-N 3.47Å; F67-F69 AromaticContact CE2-CD2 3.88Å; F67-F69 HydrophobicContact CE2-CD2 3.88Å; F67-F69 HydrophobicContact CZ-CD2 4.42Å; F67-F69 PolarHBondContact O-N 2.94Å; F67-L198 HydrophobicContact CD2-CD1 3.86Å; F67-L198 HydrophobicContact CE2-CD1 3.69Å; F67-L198 HydrophobicContact CG-CD1 4.36Å; F67-L198 HydrophobicContact CZ-CD1 4.06Å; F67-L203 HydrophobicContact CD1-CD1 3.99Å; F67-L203 HydrophobicContact CE1-CD1 4.05Å; F67-I207 HydrophobicContact CE1-CG2 4.35Å; F67-I207 HydrophobicContact CZ-CG2 4.05Å; F67-V209 HydrophobicContact CZ-CG2 3.84Å; F67-W229 HydrophobicContact CE2-CH2 4.05Å; F67-W229 HydrophobicContact CE2-CZ2 4.06Å; F67-W229 AromaticContact CZ-CH2 3.94Å; F67-W229 HydrophobicContact CZ-CH2 3.94Å; F67-W229 HydrophobicContact CZ-CZ2 4.43Å
68	P	95.8	Very high	81.4	Confident	74 Å²	74	70 Å²	70	48%	0.481	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	129	173.6	-25.2	34.8	0	0	0	111.5	L54 P70	L54-P68 HydrophobicContact CD2-CB 4.43Å; L54-P68 HydrophobicContact CD2-CG 4.3Å; P68-P70 VanDerWaalsContact C-CD 3.45Å; P68-P70 WeakPolarHBondContact O-CD 3.06Å
69	F	97.2	Very high	82.8	Confident	2 Å²	2	62 Å²	62	1%	0.009	38%	0.381	C	S	.	.			trans	-122.3	71.2	176.6	-164.1	-99.5	0	0	0	109.9	Y48 K53 A55 F67 V72 M192 V209 A225 W229	Y48-F69 HydrophobicContact CD2-CB 4.04Å; Y48-F69 AromaticContact CD2-CD1 3.6Å; Y48-F69 HydrophobicContact CD2-CD1 3.6Å; Y48-F69 HydrophobicContact CD2-CG 4.19Å; Y48-F69 HydrophobicContact CE2-CB 4.18Å; Y48-F69 AromaticContact CE2-CD1 3.89Å; Y48-F69 HydrophobicContact CE2-CD1 3.89Å; Y48-F69 WeakPolarHBondContact CE2-O 3.37Å; Y48-F69 HydrophobicContact CG-CD1 4.48Å; K53-F69 PolarHBondContact O-N 2.75Å; A55-F69 HydrophobicContact CB-CB 4.05Å; A55-F69 HydrophobicContact CB-CD2 4.43Å; A55-F69 HydrophobicContact CB-CG 4.43Å; F67-F69 AromaticContact CE2-CD2 3.88Å; F67-F69 HydrophobicContact CE2-CD2 3.88Å; F67-F69 HydrophobicContact CZ-CD2 4.42Å; F67-F69 PolarHBondContact O-N 2.94Å; F69-V72 HydrophobicContact CD1-CG2 3.89Å; F69-V72 HydrophobicContact CE1-CG2 3.6Å; F69-M192 HydrophobicContact CE1-CB 4.35Å; F69-M192 HydrophobicContact CE1-CG 4.03Å; F69-M192 HydrophobicContact CE2-CB 4.49Å; F69-M192 HydrophobicContact CZ-CB 3.63Å; F69-M192 HydrophobicContact CZ-CG 3.79Å; F69-V209 HydrophobicContact CD1-CG1 4.26Å; F69-V209 HydrophobicContact CD2-CB 4.39Å; F69-V209 HydrophobicContact CD2-CG1 4.29Å; F69-V209 HydrophobicContact CD2-CG2 3.89Å; F69-V209 HydrophobicContact CE1-CG1 4.27Å; F69-V209 HydrophobicContact CE2-CB 4Å; F69-V209 HydrophobicContact CE2-CG1 4.29Å; F69-V209 HydrophobicContact CE2-CG2 3.66Å; F69-V209 HydrophobicContact CG-CG1 4.27Å; F69-V209 HydrophobicContact CZ-CB 4.11Å; F69-V209 HydrophobicContact CZ-CG1 4.3Å; F69-V209 HydrophobicContact CZ-CG2 4.28Å; F69-A225 HydrophobicContact CE1-CB 4.47Å; F69-W229 HydrophobicContact CD2-CH2 4.44Å; F69-W229 HydrophobicContact CD2-CZ2 4.13Å; F69-W229 AromaticContact CE2-CD2 3.56Å; F69-W229 HydrophobicContact CE2-CD2 3.56Å; F69-W229 AromaticContact CE2-CE2 3.46Å; F69-W229 VanDerWaalsContact CE2-CE2 3.46Å; F69-W229 AromaticContact CE2-CE3 3.79Å; F69-W229 HydrophobicContact CE2-CE3 3.79Å; F69-W229 HydrophobicContact CE2-CG 4.14Å; F69-W229 AromaticContact CE2-CH2 3.88Å; F69-W229 HydrophobicContact CE2-CH2 3.88Å; F69-W229 AromaticContact CE2-CZ2 3.64Å; F69-W229 HydrophobicContact CE2-CZ2 3.64Å; F69-W229 AromaticContact CE2-CZ3 3.95Å; F69-W229 HydrophobicContact CE2-CZ3 3.95Å; F69-W229 AromaticContact CE2-NE1 3.93Å; F69-W229 AromaticContact CZ-CD2 3.98Å; F69-W229 HydrophobicContact CZ-CD2 3.98Å; F69-W229 HydrophobicContact CZ-CE3 4.22Å; F69-W229 HydrophobicContact CZ-CG 4.18Å
70	P	96.1	Very high	84.6	Confident	67 Å²	67	58.5 Å²	58.5	44%	0.435	37%	0.366	S	S	.	.			trans	-72.2	165.6	-178.3	33.3	-36.9	0	0	0	111.5	P68	P68-P70 VanDerWaalsContact C-CD 3.45Å; P68-P70 WeakPolarHBondContact O-CD 3.06Å
71	G	97.6	Very high	86.9	Confident	4 Å²	4	60 Å²	60	4%	0.041	35%	0.354	C	S	.	.	S	Bend	trans	92.4	8.9	174.1	0	0	0	0	0	114.9	L221 Y222 A225	G71-L221 CarbonylContact O-C 3.52Å; G71-L221 WeakPolarHBondContact O-CA 3.38Å; G71-Y222 CarbonylContact C-O 3.51Å; G71-Y222 WeakPolarHBondContact CA-O 3.49Å; G71-Y222 PolarHBondContact O-N 3.35Å; G71-Y222 VanDerWaalsContact O-O 3.13Å; G71-A225 WeakPolarHBondContact O-CB 3.15Å
72	V	98.4	Very high	89.5	Confident	3 Å²	3	58.3 Å²	58.3	2%	0.018	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.7	170.2	-176.4	0	0	0	0	109	Y48 F69 V211 V219 L221 A225	Y48-V72 HydrophobicContact CD1-CG1 4.33Å; Y48-V72 HydrophobicContact CE1-CB 4.04Å; Y48-V72 HydrophobicContact CE1-CG1 3.75Å; Y48-V72 HydrophobicContact CE2-CB 4.25Å; Y48-V72 PolarHBondContact OH-O 2.84Å; F69-V72 HydrophobicContact CD1-CG2 3.89Å; F69-V72 HydrophobicContact CE1-CG2 3.6Å; V72-V211 HydrophobicContact CG1-CG1 4.17Å; V72-V219 HydrophobicContact CG1-CG2 4.1Å; V72-L221 HydrophobicContact CG1-CD2 4.48Å; V72-L221 HydrophobicContact CG2-CD2 3.92Å; V72-A225 HydrophobicContact CG2-CB 3.93Å
73	F	98	Very high	92	Very high	33 Å²	33	57.7 Å²	57.7	15%	0.145	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	129	167.7	170.9	-102	0	0	0	108.8	W75 E141 L218 V219 A220 Y222	F73-W75 HydrophobicContact CE1-CB 3.83Å; F73-W75 HydrophobicContact CE1-CE3 4.22Å; F73-W75 HydrophobicContact CZ-CB 4.01Å; F73-W75 HydrophobicContact CZ-CE3 4.35Å; F73-E141 HydrophobicContact CE1-CG 3.72Å; F73-E141 HydrophobicContact CE2-CG 4.13Å; F73-E141 WeakPolarHBondContact CE2-OE1 3.29Å; F73-E141 HydrophobicContact CZ-CG 3.5Å; F73-L218 HydrophobicContact CD1-CD2 4.19Å; F73-L218 HydrophobicContact CE1-CD2 4.22Å; F73-V219 CarbonylContact O-C 3.53Å; F73-V219 VanDerWaalsContact O-CA 3.29Å; F73-V219 WeakPolarHBondContact O-CA 3.43Å; F73-A220 HydrophobicContact CB-CB 4.3Å; F73-A220 HydrophobicContact CD1-CB 4.34Å; F73-A220 PolarHBondContact N-O 3.23Å; F73-A220 PolarHBondContact O-N 3.45Å; F73-Y222 HydrophobicContact CB-CE1 3.86Å
74	L	98.2	Very high	94.5	Very high	34 Å²	34	48.3 Å²	48.3	18%	0.178	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.9	179.8	-175.2	69.4	0	0	0	109	A50 E76 L213 C217 L218 V219	A50-L74 HydrophobicContact CB-CB 4.48Å; A50-L74 HydrophobicContact CB-CD2 4.27Å; L74-E76 HydrophobicContact CD2-CG 4.47Å; L74-L213 HydrophobicContact CD1-CD2 4.03Å; L74-C217 HydrophobicContact CD1-CB 4.07Å; L74-L218 WeakPolarHBondContact CA-O 3.39Å; L74-V219 HydrophobicContact CD1-CB 4.22Å
75	W	98	Very high	96.5	Very high	75 Å²	75	52.8 Å²	52.8	28%	0.284	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	101.5	175.4	-173.6	-7.6	0	0	0	108.9	F73 F78 R137 E141 C217 L218	F73-W75 HydrophobicContact CE1-CB 3.83Å; F73-W75 HydrophobicContact CE1-CE3 4.22Å; F73-W75 HydrophobicContact CZ-CB 4.01Å; F73-W75 HydrophobicContact CZ-CE3 4.35Å; W75-F78 HydrophobicContact CD2-CB 4.44Å; W75-F78 AromaticContact CD2-CD2 3.68Å; W75-F78 HydrophobicContact CD2-CD2 3.68Å; W75-F78 AromaticContact CE3-CD2 3.53Å; W75-F78 HydrophobicContact CE3-CD2 3.53Å; W75-F78 AromaticContact CE3-CE2 3.96Å; W75-F78 HydrophobicContact CE3-CE2 3.96Å; W75-F78 HydrophobicContact CG-CB 4.21Å; W75-F78 HydrophobicContact CG-CD2 4.29Å; W75-F78 HydrophobicContact CH2-CD2 4.17Å; W75-F78 HydrophobicContact CH2-CE2 4.28Å; W75-F78 HydrophobicContact CZ2-CD2 4.29Å; W75-F78 AromaticContact CZ3-CD2 3.8Å; W75-F78 HydrophobicContact CZ3-CD2 3.8Å; W75-F78 AromaticContact CZ3-CE2 3.83Å; W75-F78 HydrophobicContact CZ3-CE2 3.83Å; W75-R137 HydrophobicContact CH2-CG 4.02Å; W75-E141 HydrophobicContact CZ3-CB 4.1Å; W75-C217 CarbonylContact O-C 3.53Å; W75-C217 VanDerWaalsContact O-CA 3.24Å; W75-C217 WeakPolarHBondContact O-CA 3.46Å; W75-L218 HydrophobicContact CB-CB 4.34Å; W75-L218 PolarHBondContact N-O 2.94Å; W75-L218 PolarHBondContact O-N 2.57Å
76	E	98.2	Very high	97.6	Very high	108 Å²	108	55.8 Å²	55.8	51%	0.505	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	148.3	176.3	-64.3	-170.9	-164.8	0	0	112.2	L74 F78 P214	L74-E76 HydrophobicContact CD2-CG 4.47Å; E76-F78 PolarHBondContact O-N 2.87Å; E76-P214 HydrophobicContact CG-CG 4.19Å
77	N	98.3	Very high	97.9	Very high	98 Å²	98	53.5 Å²	53.5	52%	0.524	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	37.6	-177.2	-56.1	-64.7	0	0	0	112.9	I79 R216	N77-I79 PolarHBondContact O-N 3.47Å; N77-R216 CarbonylContact C-O 3.25Å; N77-R216 PolarHBondContact OD1-NH2 3.37Å
78	F	98.7	Very high	98.2	Very high	3 Å²	3	53.9 Å²	53.9	1%	0.013	27%	0.269	C	S	.	.			trans	-60.2	-35.3	177.2	170.5	-106.2	0	0	0	111.8	W75 E76 L134 R137 M138 V182 R216 L218	W75-F78 HydrophobicContact CD2-CB 4.44Å; W75-F78 AromaticContact CD2-CD2 3.68Å; W75-F78 HydrophobicContact CD2-CD2 3.68Å; W75-F78 AromaticContact CE3-CD2 3.53Å; W75-F78 HydrophobicContact CE3-CD2 3.53Å; W75-F78 AromaticContact CE3-CE2 3.96Å; W75-F78 HydrophobicContact CE3-CE2 3.96Å; W75-F78 HydrophobicContact CG-CB 4.21Å; W75-F78 HydrophobicContact CG-CD2 4.29Å; W75-F78 HydrophobicContact CH2-CD2 4.17Å; W75-F78 HydrophobicContact CH2-CE2 4.28Å; W75-F78 HydrophobicContact CZ2-CD2 4.29Å; W75-F78 AromaticContact CZ3-CD2 3.8Å; W75-F78 HydrophobicContact CZ3-CD2 3.8Å; W75-F78 AromaticContact CZ3-CE2 3.83Å; W75-F78 HydrophobicContact CZ3-CE2 3.83Å; E76-F78 PolarHBondContact O-N 2.87Å; F78-L134 HydrophobicContact CE1-CB 4.31Å; F78-L134 HydrophobicContact CE1-CD2 4.09Å; F78-L134 HydrophobicContact CZ-CB 4.41Å; F78-R137 HydrophobicContact CE2-CB 4.12Å; F78-R137 VanDerWaalsContact CE2-CD 3.48Å; F78-R137 HydrophobicContact CE2-CG 3.7Å; F78-R137 HydrophobicContact CZ-CB 4.22Å; F78-R137 HydrophobicContact CZ-CG 4.25Å; F78-R137 PolarHBondContact O-NH1 3.25Å; F78-M138 HydrophobicContact CE1-CE 4.07Å; F78-M138 HydrophobicContact CE2-CG 4.23Å; F78-M138 HydrophobicContact CZ-CE 4.07Å; F78-M138 HydrophobicContact CZ-CG 3.78Å; F78-V182 HydrophobicContact CD1-CG1 4.33Å; F78-V182 HydrophobicContact CD1-CG2 3.97Å; F78-V182 HydrophobicContact CE1-CG2 3.84Å; F78-R216 PolarHBondContact N-O 3.21Å; F78-L218 HydrophobicContact CB-CB 3.67Å; F78-L218 HydrophobicContact CD1-CB 3.73Å; F78-L218 HydrophobicContact CD1-CD1 3.83Å; F78-L218 HydrophobicContact CD1-CG 4.44Å; F78-L218 HydrophobicContact CD2-CB 4.09Å; F78-L218 HydrophobicContact CD2-CD1 3.95Å; F78-L218 HydrophobicContact CE1-CB 4.44Å; F78-L218 HydrophobicContact CE1-CD1 3.69Å; F78-L218 HydrophobicContact CE2-CD1 3.78Å; F78-L218 HydrophobicContact CG-CB 3.54Å; F78-L218 HydrophobicContact CG-CD1 3.98Å; F78-L218 HydrophobicContact CG-CG 4.43Å; F78-L218 HydrophobicContact CZ-CD1 3.67Å
79	I	98.8	Very high	98.3	Very high	1 Å²	1	52 Å²	52	1%	0.005	26%	0.263	C	S	.	.	S	Bend	trans	-112	150.7	169.3	61.9	176.9	0	0	0	110.8	N77 E83 E84 L87 L134 V182 M184 R216	N77-I79 PolarHBondContact O-N 3.47Å; I79-E83 VanDerWaalsContact CA-OE2 3.29Å; I79-E83 WeakPolarHBondContact CA-OE2 3.45Å; I79-E83 HydrophobicContact CB-CB 4.09Å; I79-E84 HydrophobicContact CD1-CB 3.75Å; I79-E84 HydrophobicContact CD1-CG 4.15Å; I79-E84 HydrophobicContact CG1-CB 4.42Å; I79-L87 HydrophobicContact CD1-CD1 4.06Å; I79-L87 HydrophobicContact CG2-CD1 4.45Å; I79-L134 HydrophobicContact CG2-CD2 3.64Å; I79-V182 HydrophobicContact CD1-CG1 4.01Å; I79-V182 HydrophobicContact CG2-CG1 4.27Å; I79-M184 HydrophobicContact CD1-CG 3.68Å; I79-M184 HydrophobicContact CD1-SD 4.23Å; I79-R216 HydrophobicContact CD1-CB 4.37Å; I79-R216 HydrophobicContact CD1-CG 4.28Å; I79-R216 HydrophobicContact CG1-CB 3.62Å; I79-R216 HydrophobicContact CG1-CG 3.86Å; I79-R216 PolarHBondContact N-O 3.32Å; I79-R216 WeakPolarHBondContact O-CB 3.29Å; I79-R216 WeakPolarHBondContact O-CD 3.3Å
80	S	98.7	Very high	98.3	Very high	45 Å²	45	54.6 Å²	54.6	32%	0.315	28%	0.281	S	S	.	.			trans	-76.5	171.5	171	90.4	0	0	0	0	112.1	E82 E83 E84	S80-E82 VanDerWaalsContact C-N 3.31Å; S80-E82 WeakPolarHBondContact CB-OE2 3.38Å; S80-E82 PolarHBondContact OG-N 3.24Å; S80-E82 PolarHBondContact OG-OE2 3.4Å; S80-E83 PolarHBondContact N-OE2 3.28Å; S80-E83 PolarHBondContact O-N 3.22Å; S80-E83 PolarHBondContact OG-N 2.92Å; S80-E83 VanDerWaalsContact OG-N 3.17Å; S80-E84 WeakPolarHBondContact O-CB 3.44Å; S80-E84 PolarHBondContact O-N 3.22Å
81	E	98.7	Very high	98.4	Very high	107 Å²	107	51.8 Å²	51.8	50%	0.5	26%	0.262	S	S	.	.	H	α-helix	trans	-66.5	-35.5	174.8	-53.9	-158.3	148.3	0	0	112	K85 R216	E81-K85 WeakPolarHBondContact O-CB 3.2Å; E81-K85 PolarHBondContact O-N 3.07Å; E81-R216 IonicContact OE1-CZ 3.59Å; E81-R216 IonicContact OE1-NH1 3.42Å; E81-R216 PolarHBondContact OE1-NH1 2.83Å; E81-R216 IonicContact OE1-NH2 2.81Å
82	E	98.6	Very high	98.4	Very high	134 Å²	134	54.6 Å²	54.6	63%	0.626	28%	0.276	S	S	*	.	H	α-helix	trans	-67	-45.1	175.5	-60.2	73.4	-161.8	0	0	111.4	S80 E84 K85 E86	S80-E82 VanDerWaalsContact C-N 3.31Å; S80-E82 WeakPolarHBondContact CB-OE2 3.38Å; S80-E82 PolarHBondContact OG-N 3.24Å; S80-E82 PolarHBondContact OG-OE2 3.4Å; E82-E84 VanDerWaalsContact C-N 3.35Å; E82-K85 PolarHBondContact O-N 3.27Å; E82-E86 PolarHBondContact O-N 2.88Å
83	E	98.6	Very high	98.4	Very high	41 Å²	41	62.3 Å²	62.3	19%	0.192	31%	0.313	C	S	.	.	H	α-helix	trans	-62.5	-43.3	176.2	-70.3	-179.1	138.6	0	0	111.1	I79 S80 K85 E86 L87 R137	I79-E83 VanDerWaalsContact CA-OE2 3.29Å; I79-E83 WeakPolarHBondContact CA-OE2 3.45Å; I79-E83 HydrophobicContact CB-CB 4.09Å; S80-E83 PolarHBondContact N-OE2 3.28Å; S80-E83 PolarHBondContact O-N 3.22Å; S80-E83 PolarHBondContact OG-N 2.92Å; S80-E83 VanDerWaalsContact OG-N 3.17Å; E83-K85 VanDerWaalsContact C-N 3.34Å; E83-K85 PolarHBondContact O-N 2.99Å; E83-E86 PolarHBondContact O-N 3.12Å; E83-L87 WeakPolarHBondContact O-CB 3.44Å; E83-L87 WeakPolarHBondContact O-CD1 3.4Å; E83-L87 WeakPolarHBondContact O-CG 3.45Å; E83-L87 PolarHBondContact O-N 2.99Å; E83-R137 IonicContact OE1-CZ 3.48Å; E83-R137 IonicContact OE1-NH1 3.79Å; E83-R137 PolarHBondContact OE1-NH1 3.34Å; E83-R137 IonicContact OE1-NH2 2.69Å; E83-R137 PolarHBondContact OE1-NH2 2.77Å; E83-R137 IonicContact OE2-CZ 3.67Å; E83-R137 IonicContact OE2-NH1 3.35Å; E83-R137 PolarHBondContact OE2-NH1 2.83Å; E83-R137 IonicContact OE2-NH2 3.56Å
84	E	98.8	Very high	98.3	Very high	2 Å²	2	63.6 Å²	63.6	1%	0.009	32%	0.321	C	S	.	.	H	α-helix	trans	-60.1	-44.2	174.5	-174.8	-179.1	-136	0	0	111.6	I79 S80 E82 E86 L87 I88 M184 L185 R215 R216	I79-E84 HydrophobicContact CD1-CB 3.75Å; I79-E84 HydrophobicContact CD1-CG 4.15Å; I79-E84 HydrophobicContact CG1-CB 4.42Å; S80-E84 WeakPolarHBondContact O-CB 3.44Å; S80-E84 PolarHBondContact O-N 3.22Å; E82-E84 VanDerWaalsContact C-N 3.35Å; E84-E86 VanDerWaalsContact C-N 3.35Å; E84-E86 PolarHBondContact O-N 3.05Å; E84-L87 PolarHBondContact O-N 3.05Å; E84-I88 HydrophobicContact CG-CG1 4.35Å; E84-I88 WeakPolarHBondContact O-CB 3.49Å; E84-I88 VanDerWaalsContact O-CG1 3.23Å; E84-I88 WeakPolarHBondContact O-CG1 3.42Å; E84-I88 PolarHBondContact O-N 2.69Å; E84-M184 HydrophobicContact CG-CB 4.14Å; E84-M184 HydrophobicContact CG-CG 4.16Å; E84-M184 WeakPolarHBondContact OE1-CA 3.47Å; E84-L185 PolarHBondContact OE1-N 2.79Å; E84-R215 VanDerWaalsContact CD-NE 3.28Å; E84-R215 VanDerWaalsContact OE1-CG 3.3Å; E84-R215 WeakPolarHBondContact OE1-CG 3.4Å; E84-R215 IonicContact OE1-CZ 2.86Å; E84-R215 IonicContact OE1-NE 3.91Å; E84-R215 PolarHBondContact OE1-NE 3.23Å; E84-R215 IonicContact OE2-CZ 3.53Å; E84-R215 IonicContact OE2-NE 3.96Å; E84-R215 PolarHBondContact OE2-NE 2.86Å; E84-R215 IonicContact OE2-NH2 3.01Å; E84-R215 PolarHBondContact OE2-NH2 2.84Å; E84-R216 HydrophobicContact CB-CG 4.3Å; E84-R216 HydrophobicContact CG-CG 4.43Å
85	K	98.7	Very high	98.2	Very high	166 Å²	166	67 Å²	67	72%	0.722	34%	0.343	S	S	*	.	H	α-helix	trans	-62.3	-41.7	176.9	-175.2	-179.8	178.7	-178.1	0	112	E81 E82 E83 G89	E81-K85 WeakPolarHBondContact O-CB 3.2Å; E81-K85 PolarHBondContact O-N 3.07Å; E82-K85 PolarHBondContact O-N 3.27Å; E83-K85 VanDerWaalsContact C-N 3.34Å; E83-K85 PolarHBondContact O-N 2.99Å; K85-G89 PolarHBondContact O-N 2.88Å
86	E	98.6	Very high	98.1	Very high	111 Å²	111	64.8 Å²	64.8	52%	0.519	33%	0.334	S	S	.	.	H	α-helix	trans	-64.2	-48	176.8	-175.3	178.7	-162.4	0	0	111.4	E82 E83 E84 G89 S90 L130	E82-E86 PolarHBondContact O-N 2.88Å; E83-E86 PolarHBondContact O-N 3.12Å; E84-E86 VanDerWaalsContact C-N 3.35Å; E84-E86 PolarHBondContact O-N 3.05Å; E86-G89 PolarHBondContact O-N 3.14Å; E86-S90 WeakPolarHBondContact O-CB 3.34Å; E86-S90 PolarHBondContact O-N 2.96Å; E86-L130 HydrophobicContact CG-CD1 4.22Å; E86-L130 HydrophobicContact CG-CD2 4.08Å; E86-L130 WeakPolarHBondContact OE1-CD2 3.23Å
87	L	98.6	Very high	98.1	Very high	9 Å²	9	62.9 Å²	62.9	5%	0.047	33%	0.328	C	S	.	.	H	α-helix	trans	-58.7	-52.5	178.3	-73.2	164.3	0	0	0	111.5	I79 E83 E84 S90 M91 L130 L134 M184	I79-L87 HydrophobicContact CD1-CD1 4.06Å; I79-L87 HydrophobicContact CG2-CD1 4.45Å; E83-L87 WeakPolarHBondContact O-CB 3.44Å; E83-L87 WeakPolarHBondContact O-CD1 3.4Å; E83-L87 WeakPolarHBondContact O-CG 3.45Å; E83-L87 PolarHBondContact O-N 2.99Å; E84-L87 PolarHBondContact O-N 3.05Å; L87-S90 PolarHBondContact O-N 2.9Å; L87-M91 HydrophobicContact CB-CE 4.19Å; L87-M91 HydrophobicContact CD2-CE 4.34Å; L87-M91 VanDerWaalsContact O-CG 3.25Å; L87-M91 WeakPolarHBondContact O-CG 3.47Å; L87-M91 PolarHBondContact O-N 2.57Å; L87-L130 HydrophobicContact CD2-CB 3.75Å; L87-L130 HydrophobicContact CD2-CD1 4.15Å; L87-L134 HydrophobicContact CD1-CD1 3.99Å; L87-L134 HydrophobicContact CD2-CD1 4.11Å; L87-M184 HydrophobicContact CB-SD 4.18Å; L87-M184 HydrophobicContact CD1-SD 4.07Å
88	I	98.7	Very high	97.9	Very high	14 Å²	14	61.9 Å²	61.9	7%	0.072	33%	0.327	C	S	.	.	H	α-helix	trans	-65.8	-42.4	-179.3	-62.2	-62.6	0	0	0	110.9	E84 S90 M91 D92 M184 L185 V243	E84-I88 HydrophobicContact CG-CG1 4.35Å; E84-I88 WeakPolarHBondContact O-CB 3.49Å; E84-I88 VanDerWaalsContact O-CG1 3.23Å; E84-I88 WeakPolarHBondContact O-CG1 3.42Å; E84-I88 PolarHBondContact O-N 2.69Å; I88-S90 VanDerWaalsContact C-N 3.28Å; I88-S90 PolarHBondContact O-N 3.38Å; I88-M91 HydrophobicContact CD1-SD 4.4Å; I88-M91 PolarHBondContact O-N 2.82Å; I88-D92 WeakPolarHBondContact O-CB 3.11Å; I88-D92 PolarHBondContact O-N 3.38Å; I88-M184 HydrophobicContact CD1-CB 4.1Å; I88-M184 HydrophobicContact CD1-SD 4.09Å; I88-L185 HydrophobicContact CD1-CD1 4Å; I88-L185 HydrophobicContact CD1-CD2 4.33Å; I88-L185 HydrophobicContact CD1-CG 3.89Å; I88-L185 HydrophobicContact CG1-CD1 4.31Å; I88-L185 HydrophobicContact CG1-CD2 3.83Å; I88-L185 HydrophobicContact CG1-CG 3.96Å; I88-L185 HydrophobicContact CG2-CD1 4.21Å; I88-L185 HydrophobicContact CG2-CD2 4.27Å; I88-V243 HydrophobicContact CD1-CB 3.66Å; I88-V243 HydrophobicContact CD1-CG1 3.74Å; I88-V243 HydrophobicContact CD1-CG2 3.99Å
89	G	98.4	Very high	97.7	Very high	36 Å²	36	62.5 Å²	62.5	37%	0.371	33%	0.331	S	S	.	.	H	α-helix	trans	-57.5	-41.5	176.7	0	0	0	0	0	112.4	K85 E86 Q93	K85-G89 PolarHBondContact O-N 2.88Å; E86-G89 PolarHBondContact O-N 3.14Å; G89-Q93 WeakPolarHBondContact O-CG 3.33Å
90	S	97.7	Very high	97.4	Very high	55 Å²	55	64.8 Å²	64.8	39%	0.385	34%	0.342	S	S	.	.	H	α-helix	trans	-69.7	-47.5	174.9	-174.1	0	0	0	0	112.4	E86 L87 I88 D92 Q93 L130	E86-S90 WeakPolarHBondContact O-CB 3.34Å; E86-S90 PolarHBondContact O-N 2.96Å; L87-S90 PolarHBondContact O-N 2.9Å; I88-S90 VanDerWaalsContact C-N 3.28Å; I88-S90 PolarHBondContact O-N 3.38Å; S90-D92 PolarHBondContact O-N 2.85Å; S90-Q93 WeakPolarHBondContact O-CB 3.27Å; S90-Q93 PolarHBondContact O-N 2.84Å; S90-Q93 VanDerWaalsContact O-N 3.11Å; S90-L130 VanDerWaalsContact CB-CD1 3.46Å
91	M	98.3	Very high	97.2	Very high	8 Å²	8	62.8 Å²	62.8	4%	0.039	33%	0.328	C	S	.	.	H	α-helix	trans	-60.2	-36.2	-179.6	-69.7	172.8	-165	0	0	111.8	L87 I88 Q93 D94 W96 Q106 N154 M184 V243 S245	L87-M91 HydrophobicContact CB-CE 4.19Å; L87-M91 HydrophobicContact CD2-CE 4.34Å; L87-M91 VanDerWaalsContact O-CG 3.25Å; L87-M91 WeakPolarHBondContact O-CG 3.47Å; L87-M91 PolarHBondContact O-N 2.57Å; I88-M91 HydrophobicContact CD1-SD 4.4Å; I88-M91 PolarHBondContact O-N 2.82Å; M91-Q93 VanDerWaalsContact C-N 3.26Å; M91-Q93 PolarHBondContact O-N 3.33Å; M91-D94 PolarHBondContact O-N 2.91Å; M91-D94 VanDerWaalsContact O-N 3.16Å; M91-W96 HydrophobicContact CB-CH2 4.38Å; M91-W96 HydrophobicContact CB-CZ2 3.74Å; M91-W96 HydrophobicContact SD-CH2 4.38Å; M91-W96 HydrophobicContact SD-CZ2 4.48Å; M91-Q106 PolarHBondContact O-NE2 2.8Å; M91-N154 HydrophobicContact SD-CB 4.36Å; M91-M184 HydrophobicContact CE-CE 4.11Å; M91-M184 HydrophobicContact CE-SD 4.44Å; M91-V243 HydrophobicContact SD-CG1 3.91Å; M91-S245 VanDerWaalsContact CE-OG 3.31Å; M91-S245 WeakPolarHBondContact CE-OG 3.33Å
92	D	98.3	Very high	97	Very high	63 Å²	63	57.9 Å²	57.9	34%	0.337	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-9.5	179.8	-75.5	-12.9	0	0	0	114.1	I88 S90 W96 R241	I88-D92 WeakPolarHBondContact O-CB 3.11Å; I88-D92 PolarHBondContact O-N 3.38Å; S90-D92 PolarHBondContact O-N 2.85Å; D92-W96 PolarHBondContact OD1-NE1 3.25Å; D92-R241 IonicContact OD1-CZ 3.86Å; D92-R241 IonicContact OD1-NH1 3.85Å; D92-R241 IonicContact OD1-NH2 3.08Å; D92-R241 PolarHBondContact OD1-NH2 2.81Å; D92-R241 IonicContact OD2-CZ 3.53Å; D92-R241 IonicContact OD2-NH1 3.64Å; D92-R241 PolarHBondContact OD2-NH1 3.16Å; D92-R241 IonicContact OD2-NH2 3.67Å; D92-R241 PolarHBondContact OD2-NH2 3.27Å
93	Q	97.1	Very high	97	Very high	166 Å²	166	52.4 Å²	52.4	78%	0.776	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-23	167.3	-60.6	-50.1	-57	0	0	112.6	G89 S90 M91	G89-Q93 WeakPolarHBondContact O-CG 3.33Å; S90-Q93 WeakPolarHBondContact O-CB 3.27Å; S90-Q93 PolarHBondContact O-N 2.84Å; S90-Q93 VanDerWaalsContact O-N 3.11Å; M91-Q93 VanDerWaalsContact C-N 3.26Å; M91-Q93 PolarHBondContact O-N 3.33Å
94	D	96	Very high	97	Very high	60 Å²	60	56.4 Å²	56.4	32%	0.321	29%	0.293	S	S	.	.	S	Bend	trans	-92	161.8	179.9	-77	-45.3	0	0	0	112.1	M91 W96 Q106 P278	M91-D94 PolarHBondContact O-N 2.91Å; M91-D94 VanDerWaalsContact O-N 3.16Å; D94-W96 PolarHBondContact O-N 3.11Å; D94-Q106 VanDerWaalsContact CB-NE2 3.31Å; D94-P278 HydrophobicContact CB-CG 3.92Å
95	V	95.8	Very high	96.9	Very high	105 Å²	105	59.4 Å²	59.4	64%	0.636	31%	0.306	S	S	*	.			trans	-74.6	119.9	-179.2	179.1	0	0	0	0	111.1	N97	V95-N97 PolarHBondContact O-N 3.31Å
96	W	97.6	Very high	96.9	Very high	28 Å²	28	51.5 Å²	51.5	11%	0.106	27%	0.271	C	S	.	.			trans	-81.1	103.6	168.2	-73.5	108.1	0	0	0	111.6	M91 D92 D94 R104 Q106 N154 D156 V243	M91-W96 HydrophobicContact CB-CH2 4.38Å; M91-W96 HydrophobicContact CB-CZ2 3.74Å; M91-W96 HydrophobicContact SD-CH2 4.38Å; M91-W96 HydrophobicContact SD-CZ2 4.48Å; D92-W96 PolarHBondContact OD1-NE1 3.25Å; D94-W96 PolarHBondContact O-N 3.11Å; W96-R104 HydrophobicContact CB-CB 3.88Å; W96-R104 HydrophobicContact CB-CG 4.41Å; W96-R104 HydrophobicContact CE3-CB 4.29Å; W96-Q106 HydrophobicContact CD2-CG 4.18Å; W96-Q106 HydrophobicContact CE3-CG 3.76Å; W96-Q106 HydrophobicContact CZ3-CB 4.43Å; W96-Q106 HydrophobicContact CZ3-CG 3.96Å; W96-N154 HydrophobicContact CH2-CB 3.74Å; W96-N154 HydrophobicContact CZ3-CB 3.84Å; W96-D156 HydrophobicContact CD2-CB 3.96Å; W96-D156 HydrophobicContact CE3-CB 3.7Å; W96-D156 HydrophobicContact CH2-CB 3.9Å; W96-D156 HydrophobicContact CZ2-CB 4.13Å; W96-D156 HydrophobicContact CZ3-CB 3.68Å; W96-V243 HydrophobicContact CH2-CG1 4.05Å; W96-V243 HydrophobicContact CZ2-CG1 4.46Å
97	N	96.6	Very high	96.8	Very high	68 Å²	68	48 Å²	48	36%	0.364	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	138.9	-179.1	-72.2	-53.3	0	0	0	111.9	V95 S99 R104 K105	V95-N97 PolarHBondContact O-N 3.31Å; N97-S99 PolarHBondContact O-N 3.32Å; N97-R104 CarbonylContact O-C 3.58Å; N97-R104 WeakPolarHBondContact O-CA 3.21Å; N97-R104 WeakPolarHBondContact O-CB 3.48Å; N97-K105 PolarHBondContact N-O 3.25Å; N97-K105 PolarHBondContact O-N 2.63Å
98	P	95.5	Very high	96.8	Very high	78 Å²	78	47.9 Å²	47.9	51%	0.506	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	133.6	174.5	-25.3	34.2	0	0	0	112.6
99	S	94.4	Very high	96.7	Very high	15 Å²	15	47.4 Å²	47.4	11%	0.105	25%	0.254	C	S	.	.			trans	-122.7	176.9	176.6	-168.9	0	0	0	0	110.5	G15 N97 R103	G15-S99 CarbonylContact C-O 3.59Å; G15-S99 WeakPolarHBondContact CA-O 3.46Å; N97-S99 PolarHBondContact O-N 3.32Å; S99-R103 CarbonylContact C-O 3.55Å; S99-R103 WeakPolarHBondContact CA-O 3.49Å; S99-R103 WeakPolarHBondContact CB-O 3.49Å; S99-R103 PolarHBondContact N-O 2.78Å
100	Q	92.7	Very high	96.6	Very high	49 Å²	49	46.3 Å²	46.3	23%	0.229	24%	0.24	C	C	.	.	S	Bend	trans	-68.4	161.6	-179.7	-67.7	178.4	-5.9	0	0	111.7	G15 G102 R103	G15-Q100 WeakPolarHBondContact O-CG 3.31Å; Q100-G102 PolarHBondContact O-N 2.83Å; Q100-G102 VanDerWaalsContact O-N 3.14Å; Q100-R103 WeakPolarHBondContact O-CB 3.35Å; Q100-R103 VanDerWaalsContact O-CZ 3.31Å; Q100-R103 PolarHBondContact O-N 2.72Å; Q100-R103 PolarHBondContact O-NH1 2.93Å
101	S	94.3	Very high	96.5	Very high	4 Å²	4	50.7 Å²	50.7	3%	0.028	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.1	45.8	176.6	-39.6	0	0	0	0	113.1	C16 R103 S163 A164 D166	C16-S101 PolarHBondContact SG-N 3.01Å; C16-S101 VanDerWaalsContact SG-N 3.37Å; S101-R103 VanDerWaalsContact C-N 3.27Å; S101-R103 PolarHBondContact O-N 3.39Å; S101-S163 VanDerWaalsContact O-CA 3.28Å; S101-S163 WeakPolarHBondContact O-CA 3.37Å; S101-A164 WeakPolarHBondContact CB-O 3.34Å; S101-A164 PolarHBondContact O-N 2.82Å; S101-D166 PolarHBondContact OG-OD1 3.02Å
102	G	94.7	Very high	96.4	Very high	3 Å²	3	52.1 Å²	52.1	3%	0.031	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	-10.9	171.5	0	0	0	0	0	116.1	C22 Q100 R161 S163	C22-G102 VanDerWaalsContact CB-CA 3.42Å; Q100-G102 PolarHBondContact O-N 2.83Å; Q100-G102 VanDerWaalsContact O-N 3.14Å; G102-R161 WeakPolarHBondContact O-CB 3.27Å; G102-S163 PolarHBondContact O-OG 2.63Å
103	R	97.2	Very high	96.2	Very high	19 Å²	19	52.4 Å²	52.4	7%	0.072	26%	0.263	C	S	.	.			trans	-73.4	165.5	-177.7	-56	-173.2	-57.5	-75.8	9.8	112.6	S99 Q100 S101 D156 Y157 A164	S99-R103 CarbonylContact C-O 3.55Å; S99-R103 WeakPolarHBondContact CA-O 3.49Å; S99-R103 WeakPolarHBondContact CB-O 3.49Å; S99-R103 PolarHBondContact N-O 2.78Å; Q100-R103 WeakPolarHBondContact O-CB 3.35Å; Q100-R103 VanDerWaalsContact O-CZ 3.31Å; Q100-R103 PolarHBondContact O-N 2.72Å; Q100-R103 PolarHBondContact O-NH1 2.93Å; S101-R103 VanDerWaalsContact C-N 3.27Å; S101-R103 PolarHBondContact O-N 3.39Å; R103-D156 WeakPolarHBondContact CA-O 3.49Å; R103-Y157 VanDerWaalsContact CD-CZ 3.47Å; R103-Y157 HydrophobicContact CG-CD1 3.91Å; R103-Y157 HydrophobicContact CG-CE1 3.87Å; R103-Y157 HydrophobicContact CG-CG 4.48Å; R103-A164 VanDerWaalsContact CD-O 3.25Å; R103-A164 WeakPolarHBondContact CD-O 3.5Å; R103-A164 WeakPolarHBondContact CG-O 3.39Å; R103-A164 PolarHBondContact NH1-O 2.72Å
104	R	98.1	Very high	96.1	Very high	126 Å²	126	48.4 Å²	48.4	48%	0.475	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	165.7	159.6	-59.4	174.3	172	177.5	-7.9	110	W96 N97 L155 D156	W96-R104 HydrophobicContact CB-CB 3.88Å; W96-R104 HydrophobicContact CB-CG 4.41Å; W96-R104 HydrophobicContact CE3-CB 4.29Å; N97-R104 CarbonylContact O-C 3.58Å; N97-R104 WeakPolarHBondContact O-CA 3.21Å; N97-R104 WeakPolarHBondContact O-CB 3.48Å; R104-L155 WeakPolarHBondContact O-CA 3.48Å; R104-D156 HydrophobicContact CB-CB 4.25Å; R104-D156 PolarHBondContact N-O 2.79Å; R104-D156 PolarHBondContact O-N 3.37Å
105	K	97.9	Very high	96	Very high	64 Å²	64	55.2 Å²	55.2	28%	0.278	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	158.1	-177.2	68.6	177.3	-176.3	150.7	0	114.2	N97 D107 N154 L155	N97-K105 PolarHBondContact N-O 3.25Å; N97-K105 PolarHBondContact O-N 2.63Å; K105-D107 WeakPolarHBondContact CD-OD2 3.27Å; K105-D107 WeakPolarHBondContact CE-OD2 3.39Å; K105-D107 IonicContact NZ-OD1 3.96Å; K105-D107 IonicContact NZ-OD2 2.64Å; K105-D107 PolarHBondContact NZ-OD2 3.23Å; K105-N154 CarbonylContact C-O 3.58Å; K105-N154 WeakPolarHBondContact CA-O 3.25Å; K105-N154 WeakPolarHBondContact CB-O 3.47Å; K105-L155 HydrophobicContact CB-CD2 3.64Å
106	Q	98.3	Very high	96	Very high	0 Å²	0	58 Å²	58	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	123.1	163.6	-66.1	166.4	-13.3	0	0	106.9	M91 D94 W96 Y108 N154 P278	M91-Q106 PolarHBondContact O-NE2 2.8Å; D94-Q106 VanDerWaalsContact CB-NE2 3.31Å; W96-Q106 HydrophobicContact CD2-CG 4.18Å; W96-Q106 HydrophobicContact CE3-CG 3.76Å; W96-Q106 HydrophobicContact CZ3-CB 4.43Å; W96-Q106 HydrophobicContact CZ3-CG 3.96Å; Q106-Y108 HydrophobicContact CB-CE2 4.07Å; Q106-N154 HydrophobicContact CB-CB 4.16Å; Q106-N154 PolarHBondContact N-O 2.86Å; Q106-N154 PolarHBondContact O-N 2.71Å; Q106-N154 PolarHBondContact OE1-ND2 3.36Å; Q106-N154 VanDerWaalsContact OE1-ND2 3.11Å; Q106-P278 HydrophobicContact CB-CB 3.97Å; Q106-P278 HydrophobicContact CG-CB 4.36Å
107	D	97.3	Very high	95.9	Very high	37 Å²	37	62.8 Å²	62.8	20%	0.198	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	137.6	-179.5	-63.4	-46.9	0	0	0	109.2	K105 C153 P278 V279	K105-D107 WeakPolarHBondContact CD-OD2 3.27Å; K105-D107 WeakPolarHBondContact CE-OD2 3.39Å; K105-D107 IonicContact NZ-OD1 3.96Å; K105-D107 IonicContact NZ-OD2 2.64Å; K105-D107 PolarHBondContact NZ-OD2 3.23Å; D107-C153 PolarHBondContact OD1-SG 2.89Å; D107-P278 CarbonylContact O-C 3.41Å; D107-P278 WeakPolarHBondContact O-CA 3.24Å; D107-V279 HydrophobicContact CB-CG2 4.22Å; D107-V279 WeakPolarHBondContact O-CG2 3.42Å; D107-V279 PolarHBondContact O-N 3.46Å
108	Y	98	Very high	95.9	Very high	7 Å²	7	64.6 Å²	64.6	3%	0.027	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	99.4	171.7	-62.5	-102.3	0	0	0	106.9	Q106 P128 E151 Q152 P278	Q106-Y108 HydrophobicContact CB-CE2 4.07Å; Y108-P128 HydrophobicContact CD1-CB 4.29Å; Y108-P128 HydrophobicContact CD1-CG 4.13Å; Y108-P128 HydrophobicContact CD2-CG 4.39Å; Y108-P128 HydrophobicContact CE1-CB 3.72Å; Y108-P128 HydrophobicContact CE1-CG 3.9Å; Y108-P128 HydrophobicContact CE2-CG 4.24Å; Y108-P128 HydrophobicContact CG-CG 4.35Å; Y108-E151 CarbonylContact O-C 3.56Å; Y108-E151 VanDerWaalsContact O-CA 3.23Å; Y108-E151 WeakPolarHBondContact O-CA 3.46Å; Y108-Q152 WeakPolarHBondContact CB-O 3.47Å; Y108-Q152 HydrophobicContact CD2-CG 4.49Å; Y108-Q152 PolarHBondContact N-O 2.94Å; Y108-Q152 PolarHBondContact O-N 3.24Å; Y108-P278 HydrophobicContact CE1-CB 4.11Å; Y108-P278 HydrophobicContact CE1-CG 4.43Å; Y108-P278 HydrophobicContact CE2-CB 3.95Å; Y108-P278 WeakPolarHBondContact OH-CD 3.42Å
109	G	96.8	Very high	95.9	Very high	4 Å²	4	61.8 Å²	61.8	4%	0.041	28%	0.281	C	S	.	.	S	Bend	trans	171	174.4	-175.2	0	0	0	0	0	112	F124	G109-F124 VanDerWaalsContact C-CD2 3.5Å; G109-F124 VanDerWaalsContact CA-CE2 3.44Å
110	P	96.2	Very high	95.9	Very high	13 Å²	13	68.3 Å²	68.3	8%	0.084	30%	0.303	C	S	.	.			trans	-67.5	158.7	177.2	31.7	-37.5	0	0	0	111.6	V112 V119 F124 L267	P110-V112 HydrophobicContact CG-CG2 4.25Å; P110-V112 WeakPolarHBondContact O-CG2 3.24Å; P110-V112 PolarHBondContact O-N 3.44Å; P110-V119 HydrophobicContact CB-CG1 3.51Å; P110-V119 HydrophobicContact CG-CG1 3.82Å; P110-F124 HydrophobicContact CB-CD1 4.5Å; P110-L267 HydrophobicContact CB-CD2 3.58Å; P110-L267 HydrophobicContact CG-CD2 3.73Å
111	K	95.7	Very high	95.9	Very high	148 Å²	148	68.9 Å²	68.9	64%	0.643	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	119.8	170.7	-175.7	167.6	-174	167.2	0	110.2	R120 A122	K111-R120 HydrophobicContact CB-CB 4.5Å; K111-R120 PolarHBondContact N-O 2.94Å; K111-R120 PolarHBondContact O-N 3.19Å; K111-A122 HydrophobicContact CB-CB 3.95Å
112	V	95.4	Very high	95.7	Very high	38 Å²	38	71.9 Å²	71.9	23%	0.23	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	140.6	-174.1	-167.4	0	0	0	0	111.9	P110 F114 W173 L174 W175	P110-V112 HydrophobicContact CG-CG2 4.25Å; P110-V112 WeakPolarHBondContact O-CG2 3.24Å; P110-V112 PolarHBondContact O-N 3.44Å; V112-F114 HydrophobicContact CB-CE1 4.3Å; V112-F114 HydrophobicContact CB-CE2 4.33Å; V112-F114 HydrophobicContact CB-CZ 4.1Å; V112-F114 HydrophobicContact CG1-CD1 3.66Å; V112-F114 HydrophobicContact CG1-CD2 4.35Å; V112-F114 HydrophobicContact CG1-CE1 3.53Å; V112-F114 HydrophobicContact CG1-CE2 4.23Å; V112-F114 HydrophobicContact CG1-CG 4.09Å; V112-F114 HydrophobicContact CG1-CZ 3.83Å; V112-W173 HydrophobicContact CG1-CZ3 3.9Å; V112-L174 HydrophobicContact CB-CD2 4.16Å; V112-L174 HydrophobicContact CG1-CD2 3.63Å; V112-L174 HydrophobicContact CG2-CD2 3.37Å; V112-W175 HydrophobicContact CG2-CH2 4.21Å; V112-W175 HydrophobicContact CG2-CZ2 4.36Å
113	N	95.6	Very high	95.5	Very high	69 Å²	69	77.7 Å²	77.7	37%	0.369	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	96.9	162.5	-173.7	-45.4	0	0	0	108.8	K115 K116 K117 K118	N113-K115 PolarHBondContact OD1-N 3.05Å; N113-K116 HydrophobicContact CB-CB 4.44Å; N113-K116 PolarHBondContact O-N 3.21Å; N113-K116 WeakPolarHBondContact OD1-CB 3.47Å; N113-K116 PolarHBondContact OD1-N 3.21Å; N113-K117 PolarHBondContact O-N 2.66Å; N113-K118 PolarHBondContact N-O 2.93Å; N113-K118 PolarHBondContact O-N 3.46Å
114	F	93.9	Very high	95.5	Very high	81 Å²	81	77.3 Å²	77.3	36%	0.355	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-45.5	-176.9	-63.9	-67.9	0	0	0	112.7	V112 K116 K117 D171 W173 L174 W175	V112-F114 HydrophobicContact CB-CE1 4.3Å; V112-F114 HydrophobicContact CB-CE2 4.33Å; V112-F114 HydrophobicContact CB-CZ 4.1Å; V112-F114 HydrophobicContact CG1-CD1 3.66Å; V112-F114 HydrophobicContact CG1-CD2 4.35Å; V112-F114 HydrophobicContact CG1-CE1 3.53Å; V112-F114 HydrophobicContact CG1-CE2 4.23Å; V112-F114 HydrophobicContact CG1-CG 4.09Å; V112-F114 HydrophobicContact CG1-CZ 3.83Å; F114-K116 VanDerWaalsContact C-N 3.28Å; F114-K116 PolarHBondContact O-N 3.29Å; F114-K117 PolarHBondContact O-N 3.41Å; F114-D171 WeakPolarHBondContact CB-OD2 3.28Å; F114-D171 HydrophobicContact CD1-CB 3.42Å; F114-D171 VanDerWaalsContact CD1-CB 3.42Å; F114-D171 WeakPolarHBondContact CD1-OD2 3.47Å; F114-D171 HydrophobicContact CE1-CB 3.51Å; F114-D171 HydrophobicContact CG-CB 4.1Å; F114-D171 HydrophobicContact CZ-CB 4.27Å; F114-W173 HydrophobicContact CD1-CE3 4.23Å; F114-W173 HydrophobicContact CD1-CZ3 4.37Å; F114-L174 HydrophobicContact CE1-CB 4.23Å; F114-L174 HydrophobicContact CE1-CD2 4.4Å; F114-W175 HydrophobicContact CE1-CZ2 4.26Å; F114-W175 AromaticContact CE1-NE1 3.84Å; F114-W175 AromaticContact CZ-CE2 3.99Å; F114-W175 AromaticContact CZ-CZ2 3.93Å; F114-W175 HydrophobicContact CZ-CZ2 3.93Å; F114-W175 AromaticContact CZ-NE1 3.67Å
115	K	93.4	Very high	95.4	Very high	204 Å²	204	74.5 Å²	74.5	89%	0.887	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-38.6	179.7	-175.4	174.5	-177.8	175.3	0	112.9	N113	N113-K115 PolarHBondContact OD1-N 3.05Å
116	K	96	Very high	95.4	Very high	162 Å²	162	71.5 Å²	71.5	70%	0.704	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	2.7	179.2	-65.3	-171.8	176.5	-174.5	0	113.2	N113 F114 K118	N113-K116 HydrophobicContact CB-CB 4.44Å; N113-K116 PolarHBondContact O-N 3.21Å; N113-K116 WeakPolarHBondContact OD1-CB 3.47Å; N113-K116 PolarHBondContact OD1-N 3.21Å; F114-K116 VanDerWaalsContact C-N 3.28Å; F114-K116 PolarHBondContact O-N 3.29Å; K116-K118 VanDerWaalsContact C-N 3.25Å; K116-K118 HydrophobicContact CB-CB 4.45Å; K116-K118 PolarHBondContact O-N 2.87Å
117	K	96	Very high	95.4	Very high	129 Å²	129	71.5 Å²	71.5	56%	0.561	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.3	52.1	-173.2	-67.9	-168.6	169.5	-167.5	0	112.3	N113 F114 W173	N113-K117 PolarHBondContact O-N 2.66Å; F114-K117 PolarHBondContact O-N 3.41Å; K117-W173 VanDerWaalsContact CA-CZ2 3.43Å; K117-W173 HydrophobicContact CB-CD2 3.9Å; K117-W173 HydrophobicContact CB-CE3 4.24Å; K117-W173 HydrophobicContact CB-CH2 3.95Å; K117-W173 HydrophobicContact CB-CZ2 3.52Å; K117-W173 HydrophobicContact CB-CZ3 4.28Å; K117-W173 HydrophobicContact CD-CD2 3.99Å; K117-W173 HydrophobicContact CD-CG 3.78Å; K117-W173 HydrophobicContact CG-CD2 3.63Å; K117-W173 HydrophobicContact CG-CE3 4.03Å; K117-W173 HydrophobicContact CG-CG 3.94Å; K117-W173 HydrophobicContact CG-CZ2 4.23Å; K117-W173 WeakPolarHBondContact O-CH2 3.31Å; K117-W173 WeakPolarHBondContact O-CZ2 3.46Å
118	K	96.1	Very high	95.4	Very high	107 Å²	107	70.6 Å²	70.6	47%	0.465	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.2	-177.5	-173.9	167.8	-174.3	163.1	0	111.8	N113 K116 W173	N113-K118 PolarHBondContact N-O 2.93Å; N113-K118 PolarHBondContact O-N 3.46Å; K116-K118 VanDerWaalsContact C-N 3.25Å; K116-K118 HydrophobicContact CB-CB 4.45Å; K116-K118 PolarHBondContact O-N 2.87Å; K118-W173 VanDerWaalsContact N-CH2 3.29Å
119	V	96.8	Very high	95.4	Very high	19 Å²	19	72.2 Å²	72.2	12%	0.115	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	142.8	173.8	-170.9	0	0	0	0	109.6	P110 W173 L174 F254 L263 L267	P110-V119 HydrophobicContact CB-CG1 3.51Å; P110-V119 HydrophobicContact CG-CG1 3.82Å; V119-W173 HydrophobicContact CG2-CH2 3.62Å; V119-W173 HydrophobicContact CG2-CZ2 4.36Å; V119-W173 HydrophobicContact CG2-CZ3 4.34Å; V119-L174 HydrophobicContact CG2-CD1 3.87Å; V119-L174 HydrophobicContact CG2-CD2 4.04Å; V119-F254 HydrophobicContact CG2-CE1 4.12Å; V119-F254 HydrophobicContact CG2-CZ 4.13Å; V119-L263 HydrophobicContact CB-CD2 4.22Å; V119-L267 HydrophobicContact CG1-CD1 4.14Å; V119-L267 HydrophobicContact CG1-CD2 4.38Å
120	R	94.3	Very high	95.4	Very high	151 Å²	151	74.6 Å²	74.6	57%	0.57	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.8	135.7	171	-58.9	-174.6	-171	-163.7	-0.1	109.2	K111 A122	K111-R120 HydrophobicContact CB-CB 4.5Å; K111-R120 PolarHBondContact N-O 2.94Å; K111-R120 PolarHBondContact O-N 3.19Å; R120-A122 VanDerWaalsContact C-N 3.31Å; R120-A122 PolarHBondContact O-N 2.99Å
121	L	91.6	Very high	95.4	Very high	61 Å²	61	74 Å²	74	32%	0.319	37%	0.366	S	S	.	.			trans	-59.9	-42	175.8	-59.8	177.6	0	0	0	111.3	N123 F124 L267 I270	L121-N123 PolarHBondContact O-N 3.42Å; L121-F124 WeakPolarHBondContact O-CB 3.48Å; L121-F124 PolarHBondContact O-N 3.32Å; L121-L267 HydrophobicContact CD2-CD2 3.37Å; L121-L267 HydrophobicContact CD2-CG 4.04Å; L121-I270 HydrophobicContact CD1-CD1 3.98Å; L121-I270 HydrophobicContact CD2-CD1 3.87Å; L121-I270 HydrophobicContact CG-CD1 4.42Å
122	A	89.6	Confident	95.6	Very high	67 Å²	67	71.4 Å²	71.4	55%	0.554	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	-125.7	179.4	0	0	0	0	0	111.2	K111 R120 F124	K111-A122 HydrophobicContact CB-CB 3.95Å; R120-A122 VanDerWaalsContact C-N 3.31Å; R120-A122 PolarHBondContact O-N 2.99Å; A122-F124 VanDerWaalsContact C-N 3.31Å
123	N	91.6	Very high	95.7	Very high	126 Å²	126	76.5 Å²	76.5	67%	0.674	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	10.1	179	-61.7	-17.1	0	0	0	112.9	L121 N125 V279	L121-N123 PolarHBondContact O-N 3.42Å; N123-N125 PolarHBondContact O-N 2.9Å; N123-N125 VanDerWaalsContact O-N 3.14Å; N123-V279 HydrophobicContact CB-CG1 4.01Å; N123-V279 WeakPolarHBondContact O-CG1 3.25Å
124	F	96	Very high	95.8	Very high	11 Å²	11	73.5 Å²	73.5	5%	0.048	36%	0.359	C	S	.	.			trans	-66	115.3	179.3	-177.1	-136.1	0	0	0	110.3	G109 P110 L121 A122 G126 L127 V150 L267 I270 A271	G109-F124 VanDerWaalsContact C-CD2 3.5Å; G109-F124 VanDerWaalsContact CA-CE2 3.44Å; P110-F124 HydrophobicContact CB-CD1 4.5Å; L121-F124 WeakPolarHBondContact O-CB 3.48Å; L121-F124 PolarHBondContact O-N 3.32Å; A122-F124 VanDerWaalsContact C-N 3.31Å; F124-G126 VanDerWaalsContact CE2-O 3.3Å; F124-G126 WeakPolarHBondContact CE2-O 3.11Å; F124-L127 HydrophobicContact CE2-CD2 4.42Å; F124-V150 VanDerWaalsContact CZ-O 3.25Å; F124-V150 WeakPolarHBondContact CZ-O 3.07Å; F124-L267 HydrophobicContact CD1-CD2 4.22Å; F124-L267 HydrophobicContact CE1-CD2 4.33Å; F124-I270 HydrophobicContact CD1-CB 4.31Å; F124-I270 HydrophobicContact CD1-CG2 3.69Å; F124-I270 HydrophobicContact CE1-CB 4.15Å; F124-I270 HydrophobicContact CE1-CG2 3.77Å; F124-I270 HydrophobicContact CG-CG2 4.13Å; F124-I270 HydrophobicContact CZ-CG2 4.26Å; F124-A271 HydrophobicContact CE1-CB 4.11Å; F124-A271 HydrophobicContact CZ-CB 3.65Å
125	N	96.6	Very high	96	Very high	67 Å²	67	69.7 Å²	69.7	36%	0.358	34%	0.343	S	S	.	.			trans	-123.9	8.5	-175.1	59.5	-3	0	0	0	112.9	N123 G276 T277	N123-N125 PolarHBondContact O-N 2.9Å; N123-N125 VanDerWaalsContact O-N 3.14Å; N125-G276 VanDerWaalsContact OD1-CA 3.27Å; N125-G276 WeakPolarHBondContact OD1-CA 3.23Å; N125-T277 PolarHBondContact ND2-OG1 2.98Å; N125-T277 PolarHBondContact OD1-N 2.98Å
126	G	98.1	Very high	96.3	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.325	C	S	.	.			trans	133.5	177.4	174.8	0	0	0	0	0	113	F124 I270 G276	F124-G126 VanDerWaalsContact CE2-O 3.3Å; F124-G126 WeakPolarHBondContact CE2-O 3.11Å; G126-I270 WeakPolarHBondContact CA-O 3.45Å; G126-G276 VanDerWaalsContact O-CA 3.24Å; G126-G276 WeakPolarHBondContact O-CA 3.43Å
127	L	98.3	Very high	96.4	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.303	C	S	.	.	S	Bend	trans	-81.9	161.2	165.6	-62	-175.4	0	0	0	110.2	F124 P149 Q152 A271 F274 R275 G276	F124-L127 HydrophobicContact CE2-CD2 4.42Å; L127-P149 HydrophobicContact CD1-CB 4.07Å; L127-P149 HydrophobicContact CD1-CG 3.75Å; L127-Q152 HydrophobicContact CD2-CB 3.89Å; L127-A271 WeakPolarHBondContact CB-O 3.34Å; L127-A271 HydrophobicContact CD1-CB 4.47Å; L127-A271 HydrophobicContact CG-CB 4.16Å; L127-A271 WeakPolarHBondContact CG-O 3.22Å; L127-A271 PolarHBondContact N-O 3.4Å; L127-F274 HydrophobicContact CB-CD1 3.83Å; L127-F274 HydrophobicContact CB-CE1 4Å; L127-F274 HydrophobicContact CD1-CE1 4.08Å; L127-F274 CarbonylContact O-C 3.6Å; L127-F274 WeakPolarHBondContact O-CA 3.24Å; L127-R275 PolarHBondContact O-N 2.7Å; L127-G276 WeakPolarHBondContact O-CA 3.42Å; L127-G276 PolarHBondContact O-N 2.8Å
128	P	97.8	Very high	96.5	Very high	18 Å²	18	53.8 Å²	53.8	12%	0.117	28%	0.276	C	S	.	.			trans	-70.5	146.8	-179.9	26.4	-31.2	0	0	0	111.9	Y108 L130 S131	Y108-P128 HydrophobicContact CD1-CB 4.29Å; Y108-P128 HydrophobicContact CD1-CG 4.13Å; Y108-P128 HydrophobicContact CD2-CG 4.39Å; Y108-P128 HydrophobicContact CE1-CB 3.72Å; Y108-P128 HydrophobicContact CE1-CG 3.9Å; Y108-P128 HydrophobicContact CE2-CG 4.24Å; Y108-P128 HydrophobicContact CG-CG 4.35Å; P128-L130 VanDerWaalsContact C-N 3.31Å; P128-L130 PolarHBondContact O-N 3.2Å; P128-S131 WeakPolarHBondContact O-CB 3.33Å; P128-S131 PolarHBondContact O-N 2.91Å
129	G	97.7	Very high	96.6	Very high	42 Å²	42	51.6 Å²	51.6	43%	0.433	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-41.5	-175.4	0	0	0	0	0	114.5	S131 Q132 F274	G129-S131 PolarHBondContact O-N 3.27Å; G129-Q132 WeakPolarHBondContact O-CB 3.4Å; G129-Q132 PolarHBondContact O-N 2.82Å; G129-Q132 VanDerWaalsContact O-N 3.1Å; G129-F274 WeakPolarHBondContact CA-O 3.32Å; G129-F274 PolarHBondContact N-O 2.7Å
130	L	96.2	Very high	96.6	Very high	54 Å²	54	57.9 Å²	57.9	28%	0.283	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.9	179.3	-66	-179.8	0	0	0	113	E86 L87 S90 P128 Q132	E86-L130 HydrophobicContact CG-CD1 4.22Å; E86-L130 HydrophobicContact CG-CD2 4.08Å; E86-L130 WeakPolarHBondContact OE1-CD2 3.23Å; L87-L130 HydrophobicContact CD2-CB 3.75Å; L87-L130 HydrophobicContact CD2-CD1 4.15Å; S90-L130 VanDerWaalsContact CB-CD1 3.46Å; P128-L130 VanDerWaalsContact C-N 3.31Å; P128-L130 PolarHBondContact O-N 3.2Å; L130-Q132 VanDerWaalsContact C-N 3.29Å; L130-Q132 PolarHBondContact O-N 3.34Å
131	S	97.7	Very high	96.7	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.007	28%	0.278	C	S	.	.	H	α-helix	trans	-74.9	-16.6	179.1	-65.5	0	0	0	0	113.5	P128 G129 K133 L134 V135 Q152 Y247	P128-S131 WeakPolarHBondContact O-CB 3.33Å; P128-S131 PolarHBondContact O-N 2.91Å; G129-S131 PolarHBondContact O-N 3.27Å; S131-K133 PolarHBondContact O-N 3.26Å; S131-L134 PolarHBondContact O-N 2.77Å; S131-V135 WeakPolarHBondContact O-CG2 3.3Å; S131-V135 PolarHBondContact O-N 2.92Å; S131-Q152 PolarHBondContact OG-NE2 2.72Å; S131-Q152 PolarHBondContact OG-OE1 3.14Å; S131-Y247 PolarHBondContact OG-OH 3.47Å
132	Q	98.3	Very high	96.8	Very high	93 Å²	93	54.4 Å²	54.4	44%	0.435	29%	0.292	S	S	.	.	H	α-helix	trans	-58.2	-48.8	-177.7	-172.5	175.4	26.4	0	0	111.8	G129 L130 L134 V135 L136 F274	G129-Q132 WeakPolarHBondContact O-CB 3.4Å; G129-Q132 PolarHBondContact O-N 2.82Å; G129-Q132 VanDerWaalsContact O-N 3.1Å; L130-Q132 VanDerWaalsContact C-N 3.29Å; L130-Q132 PolarHBondContact O-N 3.34Å; Q132-L134 VanDerWaalsContact C-N 3.3Å; Q132-L134 PolarHBondContact O-N 2.92Å; Q132-V135 PolarHBondContact O-N 3.09Å; Q132-L136 HydrophobicContact CG-CD1 4.27Å; Q132-L136 WeakPolarHBondContact O-CG 3.41Å; Q132-L136 PolarHBondContact O-N 2.87Å; Q132-F274 HydrophobicContact CB-CB 3.99Å; Q132-F274 HydrophobicContact CB-CD1 3.74Å; Q132-F274 HydrophobicContact CB-CD2 3.85Å; Q132-F274 HydrophobicContact CB-CE1 4.14Å; Q132-F274 HydrophobicContact CB-CE2 4.25Å; Q132-F274 HydrophobicContact CB-CG 3.58Å; Q132-F274 HydrophobicContact CB-CZ 4.38Å; Q132-F274 HydrophobicContact CG-CB 4.43Å; Q132-F274 HydrophobicContact CG-CD1 4.41Å; Q132-F274 HydrophobicContact CG-CD2 3.62Å; Q132-F274 HydrophobicContact CG-CE2 3.89Å; Q132-F274 HydrophobicContact CG-CG 3.91Å; Q132-F274 HydrophobicContact CG-CZ 4.39Å
133	K	97.8	Very high	97	Very high	145 Å²	145	54.6 Å²	54.6	63%	0.63	28%	0.284	S	S	*	.	H	α-helix	trans	-64	-37.5	179.1	-66.6	-179.4	-175.6	171.3	0	111.6	S131 R137	S131-K133 PolarHBondContact O-N 3.26Å; K133-R137 WeakPolarHBondContact O-CB 3.3Å; K133-R137 PolarHBondContact O-N 2.84Å
134	L	98.6	Very high	97.3	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.026	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-47.7	178.1	-56.2	-176.3	0	0	0	111.1	F78 I79 L87 S131 Q132 L136 R137 M138	F78-L134 HydrophobicContact CE1-CB 4.31Å; F78-L134 HydrophobicContact CE1-CD2 4.09Å; F78-L134 HydrophobicContact CZ-CB 4.41Å; I79-L134 HydrophobicContact CG2-CD2 3.64Å; L87-L134 HydrophobicContact CD1-CD1 3.99Å; L87-L134 HydrophobicContact CD2-CD1 4.11Å; S131-L134 PolarHBondContact O-N 2.77Å; Q132-L134 VanDerWaalsContact C-N 3.3Å; Q132-L134 PolarHBondContact O-N 2.92Å; L134-L136 VanDerWaalsContact C-N 3.35Å; L134-L136 PolarHBondContact O-N 2.99Å; L134-R137 WeakPolarHBondContact O-CB 3.34Å; L134-R137 PolarHBondContact O-N 2.78Å; L134-R137 VanDerWaalsContact O-N 3.16Å; L134-M138 HydrophobicContact CB-CE 4.16Å; L134-M138 VanDerWaalsContact O-CG 3.24Å; L134-M138 WeakPolarHBondContact O-CG 3.32Å; L134-M138 PolarHBondContact O-N 2.84Å
135	V	98.5	Very high	97.3	Very high	2 Å²	2	55 Å²	55	1%	0.012	28%	0.282	C	S	.	.	H	α-helix	trans	-63.2	-41	178.9	173.9	0	0	0	0	111.4	S131 Q132 R137 M138 Q139 P149 Y247 F274	S131-V135 WeakPolarHBondContact O-CG2 3.3Å; S131-V135 PolarHBondContact O-N 2.92Å; Q132-V135 PolarHBondContact O-N 3.09Å; V135-R137 VanDerWaalsContact C-N 3.34Å; V135-R137 PolarHBondContact O-N 2.83Å; V135-M138 HydrophobicContact CG2-SD 4.39Å; V135-M138 WeakPolarHBondContact O-CB 3.37Å; V135-M138 PolarHBondContact O-N 2.81Å; V135-Q139 WeakPolarHBondContact O-CG 3.37Å; V135-Q139 PolarHBondContact O-N 2.89Å; V135-Q139 VanDerWaalsContact O-N 3.14Å; V135-P149 HydrophobicContact CG1-CG 4.04Å; V135-P149 HydrophobicContact CG2-CG 3.64Å; V135-Y247 HydrophobicContact CG2-CD1 4.41Å; V135-Y247 HydrophobicContact CG2-CE1 4.32Å; V135-F274 HydrophobicContact CB-CE1 4.42Å; V135-F274 HydrophobicContact CB-CZ 4.1Å; V135-F274 HydrophobicContact CG1-CZ 4.29Å; V135-F274 HydrophobicContact CG2-CE1 4.1Å; V135-F274 HydrophobicContact CG2-CZ 4.18Å
136	L	98.3	Very high	97.3	Very high	97 Å²	97	54 Å²	54	51%	0.508	29%	0.288	S	S	.	.	H	α-helix	trans	-62.5	-40.6	174.1	-70.6	172.2	0	0	0	112.1	Q132 L134 Q139	Q132-L136 HydrophobicContact CG-CD1 4.27Å; Q132-L136 WeakPolarHBondContact O-CG 3.41Å; Q132-L136 PolarHBondContact O-N 2.87Å; L134-L136 VanDerWaalsContact C-N 3.35Å; L134-L136 PolarHBondContact O-N 2.99Å; L136-Q139 PolarHBondContact O-N 2.72Å
137	R	98.5	Very high	97.3	Very high	64 Å²	64	54 Å²	54	24%	0.242	29%	0.288	C	S	.	.	H	α-helix	trans	-64.7	-41.8	174.8	-172.6	-176.1	-65	159.9	6.3	111.7	W75 F78 E83 K133 L134 V135 Q139 Q140	W75-R137 HydrophobicContact CH2-CG 4.02Å; F78-R137 HydrophobicContact CE2-CB 4.12Å; F78-R137 VanDerWaalsContact CE2-CD 3.48Å; F78-R137 HydrophobicContact CE2-CG 3.7Å; F78-R137 HydrophobicContact CZ-CB 4.22Å; F78-R137 HydrophobicContact CZ-CG 4.25Å; F78-R137 PolarHBondContact O-NH1 3.25Å; E83-R137 IonicContact OE1-CZ 3.48Å; E83-R137 IonicContact OE1-NH1 3.79Å; E83-R137 PolarHBondContact OE1-NH1 3.34Å; E83-R137 IonicContact OE1-NH2 2.69Å; E83-R137 PolarHBondContact OE1-NH2 2.77Å; E83-R137 IonicContact OE2-CZ 3.67Å; E83-R137 IonicContact OE2-NH1 3.35Å; E83-R137 PolarHBondContact OE2-NH1 2.83Å; E83-R137 IonicContact OE2-NH2 3.56Å; K133-R137 WeakPolarHBondContact O-CB 3.3Å; K133-R137 PolarHBondContact O-N 2.84Å; L134-R137 WeakPolarHBondContact O-CB 3.34Å; L134-R137 PolarHBondContact O-N 2.78Å; L134-R137 VanDerWaalsContact O-N 3.16Å; V135-R137 VanDerWaalsContact C-N 3.34Å; V135-R137 PolarHBondContact O-N 2.83Å; R137-Q139 VanDerWaalsContact C-N 3.28Å; R137-Q139 PolarHBondContact O-N 2.84Å; R137-Q140 WeakPolarHBondContact O-CB 3.46Å; R137-Q140 PolarHBondContact O-N 2.68Å; R137-Q140 VanDerWaalsContact O-N 3.13Å
138	M	98.4	Very high	97.3	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-55	-45.2	175.2	-68.8	165.4	-169.2	0	0	111	F78 L134 V135 Q140 E141 L144 F147 V180 V182 L218 Y247	F78-M138 HydrophobicContact CE1-CE 4.07Å; F78-M138 HydrophobicContact CE2-CG 4.23Å; F78-M138 HydrophobicContact CZ-CE 4.07Å; F78-M138 HydrophobicContact CZ-CG 3.78Å; L134-M138 HydrophobicContact CB-CE 4.16Å; L134-M138 VanDerWaalsContact O-CG 3.24Å; L134-M138 WeakPolarHBondContact O-CG 3.32Å; L134-M138 PolarHBondContact O-N 2.84Å; V135-M138 HydrophobicContact CG2-SD 4.39Å; V135-M138 WeakPolarHBondContact O-CB 3.37Å; V135-M138 PolarHBondContact O-N 2.81Å; M138-Q140 PolarHBondContact O-N 3.11Å; M138-Q140 VanDerWaalsContact O-N 3.1Å; M138-E141 WeakPolarHBondContact O-CB 3.42Å; M138-E141 PolarHBondContact O-N 2.83Å; M138-L144 HydrophobicContact CB-CD1 4.03Å; M138-L144 HydrophobicContact CG-CD1 4.34Å; M138-L144 WeakPolarHBondContact O-CB 3.46Å; M138-F147 HydrophobicContact SD-CD1 4.18Å; M138-F147 HydrophobicContact SD-CE1 4.08Å; M138-V180 HydrophobicContact CE-CG1 4.03Å; M138-V180 HydrophobicContact SD-CG1 3.92Å; M138-V182 HydrophobicContact CE-CG2 3.87Å; M138-L218 HydrophobicContact CE-CD1 3.74Å; M138-L218 HydrophobicContact CG-CD1 3.63Å; M138-L218 HydrophobicContact SD-CD1 4.25Å; M138-Y247 HydrophobicContact CE-CD2 3.87Å; M138-Y247 HydrophobicContact CE-CE2 3.76Å
139	Q	97.8	Very high	97.3	Very high	60 Å²	60	57.2 Å²	57.2	28%	0.28	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-13.4	-178	-69.4	174.6	2.5	0	0	114.7	V135 L136 R137 E141 F147	V135-Q139 WeakPolarHBondContact O-CG 3.37Å; V135-Q139 PolarHBondContact O-N 2.89Å; V135-Q139 VanDerWaalsContact O-N 3.14Å; L136-Q139 PolarHBondContact O-N 2.72Å; R137-Q139 VanDerWaalsContact C-N 3.28Å; R137-Q139 PolarHBondContact O-N 2.84Å; Q139-E141 VanDerWaalsContact C-N 3.31Å; Q139-F147 PolarHBondContact NE2-O 2.87Å
140	Q	96.2	Very high	97.3	Very high	152 Å²	152	55.2 Å²	55.2	71%	0.71	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-21.8	174.9	-62	176.6	-26	0	0	112.3	R137 M138	R137-Q140 WeakPolarHBondContact O-CB 3.46Å; R137-Q140 PolarHBondContact O-N 2.68Å; R137-Q140 VanDerWaalsContact O-N 3.13Å; M138-Q140 PolarHBondContact O-N 3.11Å; M138-Q140 VanDerWaalsContact O-N 3.1Å
141	E	96.2	Very high	97.4	Very high	42 Å²	42	53.2 Å²	53.2	20%	0.196	27%	0.27	C	S	.	.	S	Bend	trans	-78.5	127.7	174.9	172.2	56.4	-148	0	0	109.9	F73 W75 M138 Q139 N143 L144 Q145	F73-E141 HydrophobicContact CE1-CG 3.72Å; F73-E141 HydrophobicContact CE2-CG 4.13Å; F73-E141 WeakPolarHBondContact CE2-OE1 3.29Å; F73-E141 HydrophobicContact CZ-CG 3.5Å; W75-E141 HydrophobicContact CZ3-CB 4.1Å; M138-E141 WeakPolarHBondContact O-CB 3.42Å; M138-E141 PolarHBondContact O-N 2.83Å; Q139-E141 VanDerWaalsContact C-N 3.31Å; E141-N143 HydrophobicContact CG-CB 4.29Å; E141-N143 PolarHBondContact O-N 3.14Å; E141-N143 VanDerWaalsContact O-N 3.12Å; E141-N143 PolarHBondContact OE1-ND2 3.15Å; E141-L144 HydrophobicContact CB-CB 4.34Å; E141-L144 HydrophobicContact CG-CG 4.45Å; E141-L144 CarbonylContact O-C 3.55Å; E141-L144 WeakPolarHBondContact O-CA 3.47Å; E141-L144 PolarHBondContact O-N 3.02Å; E141-Q145 PolarHBondContact O-N 3.01Å
142	P	95.5	Very high	97.5	Very high	96 Å²	96	53.2 Å²	53.2	62%	0.623	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-51.1	-40	-178.9	-31.8	36.5	0	0	0	114.5	L144 Q145	P142-L144 PolarHBondContact O-N 2.79Å; P142-Q145 WeakPolarHBondContact O-CB 3.4Å; P142-Q145 PolarHBondContact O-N 2.72Å
143	N	92.6	Very high	97.5	Very high	71 Å²	71	49.3 Å²	49.3	38%	0.38	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-69.6	-18.6	-180	-63.3	-55.8	0	0	0	113.7	E141 R178	E141-N143 HydrophobicContact CG-CB 4.29Å; E141-N143 PolarHBondContact O-N 3.14Å; E141-N143 VanDerWaalsContact O-N 3.12Å; E141-N143 PolarHBondContact OE1-ND2 3.15Å; N143-R178 WeakPolarHBondContact O-CD 3.41Å
144	L	97.4	Very high	97.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-114.5	12.8	-179	-62.8	-178.7	0	0	0	112.1	M138 E141 P142 G146 F147 R178 V180 L218 A220	M138-L144 HydrophobicContact CB-CD1 4.03Å; M138-L144 HydrophobicContact CG-CD1 4.34Å; M138-L144 WeakPolarHBondContact O-CB 3.46Å; E141-L144 HydrophobicContact CB-CB 4.34Å; E141-L144 HydrophobicContact CG-CG 4.45Å; E141-L144 CarbonylContact O-C 3.55Å; E141-L144 WeakPolarHBondContact O-CA 3.47Å; E141-L144 PolarHBondContact O-N 3.02Å; P142-L144 PolarHBondContact O-N 2.79Å; L144-G146 PolarHBondContact O-N 3.37Å; L144-F147 HydrophobicContact CB-CB 4.4Å; L144-F147 WeakPolarHBondContact O-CB 3.47Å; L144-F147 PolarHBondContact O-N 2.87Å; L144-R178 HydrophobicContact CD2-CB 4.48Å; L144-R178 HydrophobicContact CD2-CG 4.4Å; L144-V180 HydrophobicContact CD1-CG2 4.41Å; L144-V180 HydrophobicContact CD2-CG2 3.74Å; L144-L218 HydrophobicContact CD1-CD2 4.04Å; L144-A220 HydrophobicContact CD2-CB 3.85Å
145	Q	96.5	Very high	97.5	Very high	145 Å²	145	43 Å²	43	68%	0.678	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	131	176.5	-172.9	-178.6	-6	0	0	110.7	E141 P142 F147 R178	E141-Q145 PolarHBondContact O-N 3.01Å; P142-Q145 WeakPolarHBondContact O-CB 3.4Å; P142-Q145 PolarHBondContact O-N 2.72Å; Q145-F147 PolarHBondContact O-N 3.31Å; Q145-R178 PolarHBondContact O-NH1 3.12Å
146	G	96.4	Very high	97.5	Very high	47 Å²	47	43.2 Å²	43.2	49%	0.485	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	13.1	-179	0	0	0	0	0	114.7	L144 Q148	L144-G146 PolarHBondContact O-N 3.37Å; G146-Q148 PolarHBondContact O-N 2.85Å
147	F	98.3	Very high	97.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.203	C	C	.	.			trans	-62	118	172.8	-179.8	-108.5	0	0	0	110.5	M138 Q139 L144 Q145 P149 R178 V180 E249	M138-F147 HydrophobicContact SD-CD1 4.18Å; M138-F147 HydrophobicContact SD-CE1 4.08Å; Q139-F147 PolarHBondContact NE2-O 2.87Å; L144-F147 HydrophobicContact CB-CB 4.4Å; L144-F147 WeakPolarHBondContact O-CB 3.47Å; L144-F147 PolarHBondContact O-N 2.87Å; Q145-F147 PolarHBondContact O-N 3.31Å; F147-P149 HydrophobicContact CD1-CG 4.44Å; F147-P149 HydrophobicContact CE1-CB 3.92Å; F147-P149 HydrophobicContact CE1-CG 3.91Å; F147-P149 HydrophobicContact CZ-CB 4.03Å; F147-R178 HydrophobicContact CD2-CB 3.97Å; F147-R178 HydrophobicContact CE2-CB 3.98Å; F147-V180 HydrophobicContact CD1-CG2 4.33Å; F147-V180 HydrophobicContact CD2-CG2 4.22Å; F147-V180 HydrophobicContact CE1-CB 4.13Å; F147-V180 HydrophobicContact CE1-CG2 3.87Å; F147-V180 HydrophobicContact CE2-CG2 3.76Å; F147-V180 HydrophobicContact CG-CG2 4.49Å; F147-V180 HydrophobicContact CZ-CB 3.92Å; F147-V180 HydrophobicContact CZ-CG2 3.56Å; F147-E249 HydrophobicContact CD2-CB 4.15Å; F147-E249 HydrophobicContact CD2-CG 4.24Å; F147-E249 VanDerWaalsContact CD2-OE2 3.31Å; F147-E249 WeakPolarHBondContact CD2-OE2 3.23Å; F147-E249 HydrophobicContact CE2-CB 3.86Å; F147-E249 HydrophobicContact CE2-CG 4.01Å
148	Q	98.1	Very high	97.5	Very high	86 Å²	86	38.9 Å²	38.9	40%	0.402	21%	0.206	S	C	.	.			trans	-125.5	96.3	-179.6	-70	-177	-6.5	0	0	109.3	G146 E249 L268 L272	G146-Q148 PolarHBondContact O-N 2.85Å; Q148-E249 WeakPolarHBondContact O-CB 3.25Å; Q148-L268 HydrophobicContact CB-CD2 3.97Å; Q148-L272 HydrophobicContact CB-CD1 4.46Å; Q148-L272 HydrophobicContact CG-CD1 4.33Å
149	P	98.4	Very high	97.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	141.1	-179.9	29	-31.9	0	0	0	111	L127 V135 F147 Y247 R248	L127-P149 HydrophobicContact CD1-CB 4.07Å; L127-P149 HydrophobicContact CD1-CG 3.75Å; V135-P149 HydrophobicContact CG1-CG 4.04Å; V135-P149 HydrophobicContact CG2-CG 3.64Å; F147-P149 HydrophobicContact CD1-CG 4.44Å; F147-P149 HydrophobicContact CE1-CB 3.92Å; F147-P149 HydrophobicContact CE1-CG 3.91Å; F147-P149 HydrophobicContact CZ-CB 4.03Å; P149-Y247 HydrophobicContact CB-CD1 4.2Å; P149-Y247 HydrophobicContact CG-CD1 4.19Å; P149-R248 CarbonylContact C-O 3.58Å; P149-R248 VanDerWaalsContact CA-O 3.27Å; P149-R248 WeakPolarHBondContact CA-O 3.3Å
150	V	98	Very high	97.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-12.5	174.1	75.4	0	0	0	0	111.7	F124 W175 R248 L250 L267 L268 A271	F124-V150 VanDerWaalsContact CZ-O 3.25Å; F124-V150 WeakPolarHBondContact CZ-O 3.07Å; V150-W175 HydrophobicContact CG1-CE3 4.32Å; V150-W175 HydrophobicContact CG1-CZ3 3.72Å; V150-R248 PolarHBondContact N-O 3.41Å; V150-L250 HydrophobicContact CB-CD1 4.44Å; V150-L250 HydrophobicContact CB-CD2 4.33Å; V150-L250 HydrophobicContact CB-CG 3.95Å; V150-L250 HydrophobicContact CG1-CD2 3.75Å; V150-L250 HydrophobicContact CG1-CG 3.76Å; V150-L250 HydrophobicContact CG2-CD1 4.24Å; V150-L250 HydrophobicContact CG2-CD2 4.27Å; V150-L250 HydrophobicContact CG2-CG 4.15Å; V150-L267 HydrophobicContact CG2-CB 3.5Å; V150-L267 HydrophobicContact CG2-CD1 4.48Å; V150-L267 HydrophobicContact CG2-CD2 4.44Å; V150-L267 HydrophobicContact CG2-CG 4.37Å; V150-L268 HydrophobicContact CB-CD2 4.46Å; V150-A271 HydrophobicContact CG2-CB 4.33Å
151	E	98.4	Very high	97.3	Very high	12 Å²	12	39.6 Å²	39.6	6%	0.056	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	142.8	-178.7	-173.4	-89.6	169.2	0	0	110.1	Y108 C153 W175 Y247 R248	Y108-E151 CarbonylContact O-C 3.56Å; Y108-E151 VanDerWaalsContact O-CA 3.23Å; Y108-E151 WeakPolarHBondContact O-CA 3.46Å; E151-C153 VanDerWaalsContact OE1-CB 3.28Å; E151-C153 WeakPolarHBondContact OE1-CB 3.32Å; E151-C153 PolarHBondContact OE1-N 3.02Å; E151-W175 HydrophobicContact CB-CH2 3.89Å; E151-W175 HydrophobicContact CB-CZ3 4.04Å; E151-W175 HydrophobicContact CG-CH2 4.07Å; E151-W175 HydrophobicContact CG-CZ2 4.47Å; E151-Y247 WeakPolarHBondContact O-CA 3.46Å; E151-R248 HydrophobicContact CB-CB 4.43Å; E151-R248 PolarHBondContact N-O 3.46Å; E151-R248 PolarHBondContact O-N 3.07Å; E151-R248 IonicContact OE1-NH1 3.36Å; E151-R248 PolarHBondContact OE1-NH1 3.49Å; E151-R248 VanDerWaalsContact OE1-NH1 3.09Å; E151-R248 WeakPolarHBondContact OE2-CD 3.41Å; E151-R248 VanDerWaalsContact OE2-CG 3.3Å; E151-R248 WeakPolarHBondContact OE2-CG 3.46Å; E151-R248 IonicContact OE2-CZ 2.66Å; E151-R248 IonicContact OE2-NE 3.63Å; E151-R248 IonicContact OE2-NH1 2.71Å; E151-R248 PolarHBondContact OE2-NH1 3.47Å
152	Q	98.6	Very high	97.3	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	125.2	168.4	172.9	-178.9	-21.1	0	0	109.1	Y108 L127 S131 N154 T246 Y247	Y108-Q152 WeakPolarHBondContact CB-O 3.47Å; Y108-Q152 HydrophobicContact CD2-CG 4.49Å; Y108-Q152 PolarHBondContact N-O 2.94Å; Y108-Q152 PolarHBondContact O-N 3.24Å; L127-Q152 HydrophobicContact CD2-CB 3.89Å; S131-Q152 PolarHBondContact OG-NE2 2.72Å; S131-Q152 PolarHBondContact OG-OE1 3.14Å; Q152-N154 PolarHBondContact NE2-OD1 2.83Å; Q152-T246 CarbonylContact C-O 3.6Å; Q152-T246 VanDerWaalsContact CA-O 3.25Å; Q152-T246 WeakPolarHBondContact CA-O 3.45Å; Q152-Y247 HydrophobicContact CB-CD1 3.99Å; Q152-Y247 HydrophobicContact CB-CE1 4.03Å; Q152-Y247 HydrophobicContact CG-CD1 4.15Å; Q152-Y247 HydrophobicContact CG-CE1 3.81Å
153	C	98.4	Very high	97.4	Very high	10 Å²	10	33 Å²	33	7%	0.068	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	117.2	170.8	-171.7	0	0	0	0	109.3	D107 E151 S245 T246	D107-C153 PolarHBondContact OD1-SG 2.89Å; E151-C153 VanDerWaalsContact OE1-CB 3.28Å; E151-C153 WeakPolarHBondContact OE1-CB 3.32Å; E151-C153 PolarHBondContact OE1-N 3.02Å; C153-S245 WeakPolarHBondContact O-CA 3.28Å; C153-T246 PolarHBondContact N-O 3.18Å; C153-T246 PolarHBondContact O-N 3.18Å
154	N	98.8	Very high	97.7	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	133.7	166.2	-53.5	-29.3	0	0	0	108.7	M91 W96 K105 Q106 Q152 C244 S245	M91-N154 HydrophobicContact SD-CB 4.36Å; W96-N154 HydrophobicContact CH2-CB 3.74Å; W96-N154 HydrophobicContact CZ3-CB 3.84Å; K105-N154 CarbonylContact C-O 3.58Å; K105-N154 WeakPolarHBondContact CA-O 3.25Å; K105-N154 WeakPolarHBondContact CB-O 3.47Å; Q106-N154 HydrophobicContact CB-CB 4.16Å; Q106-N154 PolarHBondContact N-O 2.86Å; Q106-N154 PolarHBondContact O-N 2.71Å; Q106-N154 PolarHBondContact OE1-ND2 3.36Å; Q106-N154 VanDerWaalsContact OE1-ND2 3.11Å; Q152-N154 PolarHBondContact NE2-OD1 2.83Å; N154-C244 CarbonylContact C-O 3.54Å; N154-C244 VanDerWaalsContact CA-O 3.27Å; N154-C244 WeakPolarHBondContact CA-O 3.35Å; N154-S245 WeakPolarHBondContact OD1-CB 3.46Å; N154-S245 PolarHBondContact OD1-OG 2.86Å
155	L	98.8	Very high	97.6	Very high	17 Å²	17	31.5 Å²	31.5	9%	0.089	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	130.9	176.3	-65	177.8	0	0	0	110	R104 K105 Y157 V243 C244	R104-L155 WeakPolarHBondContact O-CA 3.48Å; K105-L155 HydrophobicContact CB-CD2 3.64Å; L155-Y157 HydrophobicContact CB-CD2 4.24Å; L155-Y157 HydrophobicContact CB-CE2 3.44Å; L155-Y157 VanDerWaalsContact CB-CE2 3.44Å; L155-Y157 HydrophobicContact CD1-CE2 4.32Å; L155-Y157 WeakPolarHBondContact CD1-OH 3.38Å; L155-V243 VanDerWaalsContact O-CA 3.3Å; L155-V243 WeakPolarHBondContact O-CA 3.32Å; L155-C244 PolarHBondContact N-O 2.94Å; L155-C244 PolarHBondContact O-N 2.82Å
156	D	98.8	Very high	97.6	Very high	6 Å²	6	27.5 Å²	27.5	3%	0.032	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123.7	177.8	176.4	51.6	0	0	0	109.7	W96 R103 R104 R241 V243	W96-D156 HydrophobicContact CD2-CB 3.96Å; W96-D156 HydrophobicContact CE3-CB 3.7Å; W96-D156 HydrophobicContact CH2-CB 3.9Å; W96-D156 HydrophobicContact CZ2-CB 4.13Å; W96-D156 HydrophobicContact CZ3-CB 3.68Å; R103-D156 WeakPolarHBondContact CA-O 3.49Å; R104-D156 HydrophobicContact CB-CB 4.25Å; R104-D156 PolarHBondContact N-O 2.79Å; R104-D156 PolarHBondContact O-N 3.37Å; D156-R241 IonicContact OD1-CZ 3.76Å; D156-R241 IonicContact OD1-NE 2.73Å; D156-R241 PolarHBondContact OD1-NE 3.25Å; D156-R241 IonicContact OD1-NH2 2.79Å; D156-R241 PolarHBondContact OD1-NH2 2.78Å; D156-V243 HydrophobicContact CB-CG2 4.27Å; D156-V243 WeakPolarHBondContact OD1-CG2 3.44Å
157	Y	98.7	Very high	97.6	Very high	5 Å²	5	27.7 Å²	27.7	2%	0.02	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	132.8	-174.9	-62.1	-109.7	0	0	0	109.3	R103 L155 I233 I238 R241 R242	R103-Y157 VanDerWaalsContact CD-CZ 3.47Å; R103-Y157 HydrophobicContact CG-CD1 3.91Å; R103-Y157 HydrophobicContact CG-CE1 3.87Å; R103-Y157 HydrophobicContact CG-CG 4.48Å; L155-Y157 HydrophobicContact CB-CD2 4.24Å; L155-Y157 HydrophobicContact CB-CE2 3.44Å; L155-Y157 VanDerWaalsContact CB-CE2 3.44Å; L155-Y157 HydrophobicContact CD1-CE2 4.32Å; L155-Y157 WeakPolarHBondContact CD1-OH 3.38Å; Y157-I233 HydrophobicContact CE1-CB 4.47Å; Y157-I238 HydrophobicContact CD1-CD1 3.91Å; Y157-I238 HydrophobicContact CD1-CG1 4.16Å; Y157-I238 HydrophobicContact CG-CD1 4.13Å; Y157-R241 WeakPolarHBondContact O-CA 3.25Å; Y157-R242 WeakPolarHBondContact CB-O 3.49Å; Y157-R242 WeakPolarHBondContact CD2-O 3.44Å; Y157-R242 PolarHBondContact N-O 2.83Å; Y157-R242 PolarHBondContact O-N 2.97Å; Y157-R242 VanDerWaalsContact O-N 3.07Å
158	H	98	Very high	97.5	Very high	65 Å²	65	30 Å²	30	30%	0.301	15%	0.152	S	C	.	.			trans	-128.2	130.9	174.6	-108.3	-81.4	0	0	0	111.6	Q160 R161 G162 S163	H158-Q160 VanDerWaalsContact C-N 3.29Å; H158-Q160 PolarHBondContact ND1-OE1 3.4Å; H158-Q160 PolarHBondContact O-N 2.79Å; H158-R161 HydrophobicContact CB-CB 4.43Å; H158-R161 HydrophobicContact CB-CG 4.09Å; H158-R161 PolarHBondContact O-N 3.29Å; H158-R161 VanDerWaalsContact O-N 3.15Å; H158-G162 PolarHBondContact O-N 3.12Å; H158-S163 PolarHBondContact N-OG 2.86Å; H158-S163 WeakPolarHBondContact O-CB 3.31Å; H158-S163 PolarHBondContact O-N 2.66Å; H158-S163 PolarHBondContact O-OG 3.06Å
159	P	97.4	Very high	97.5	Very high	32 Å²	32	29.5 Å²	29.5	21%	0.208	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-62.3	-35.7	177.6	19.3	-28.8	0	0	0	112.3	R161 G162 I238	P159-R161 PolarHBondContact O-N 2.94Å; P159-R161 VanDerWaalsContact O-N 3.11Å; P159-G162 WeakPolarHBondContact O-CA 3.29Å; P159-G162 PolarHBondContact O-N 3Å; P159-I238 HydrophobicContact CB-CG2 4.46Å; P159-I238 WeakPolarHBondContact CB-O 3.48Å
160	Q	95.8	Very high	97.4	Very high	134 Å²	134	30.1 Å²	30.1	63%	0.626	16%	0.155	S	C	*	.	G	3₁₀ helix	trans	-65	-19.4	179.7	-59.6	78.9	10.8	0	0	112.9	H158	H158-Q160 VanDerWaalsContact C-N 3.29Å; H158-Q160 PolarHBondContact ND1-OE1 3.4Å; H158-Q160 PolarHBondContact O-N 2.79Å
161	R	95.1	Very high	97.4	Very high	62 Å²	62	32.7 Å²	32.7	23%	0.234	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-91.1	-12.1	173.1	-63.2	-71.8	-67	-170	-2.4	112	C22 L23 G102 H158 P159 S163	C22-R161 VanDerWaalsContact CB-O 3.25Å; C22-R161 WeakPolarHBondContact CB-O 3.43Å; L23-R161 PolarHBondContact N-O 2.75Å; G102-R161 WeakPolarHBondContact O-CB 3.27Å; H158-R161 HydrophobicContact CB-CB 4.43Å; H158-R161 HydrophobicContact CB-CG 4.09Å; H158-R161 PolarHBondContact O-N 3.29Å; H158-R161 VanDerWaalsContact O-N 3.15Å; P159-R161 PolarHBondContact O-N 2.94Å; P159-R161 VanDerWaalsContact O-N 3.11Å; R161-S163 VanDerWaalsContact C-N 3.32Å
162	G	96.4	Very high	97.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	44.9	-166.6	0	0	0	0	0	110.9	H158 P159 A164 R235	H158-G162 PolarHBondContact O-N 3.12Å; P159-G162 WeakPolarHBondContact O-CA 3.29Å; P159-G162 PolarHBondContact O-N 3Å; G162-A164 PolarHBondContact O-N 2.86Å; G162-R235 PolarHBondContact O-NE 3.32Å
163	S	97.6	Very high	97.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.191	C	C	.	.			trans	-63.4	131.8	-178.3	-57.4	0	0	0	0	109.8	S101 G102 H158 R161 I238	S101-S163 VanDerWaalsContact O-CA 3.28Å; S101-S163 WeakPolarHBondContact O-CA 3.37Å; G102-S163 PolarHBondContact O-OG 2.63Å; H158-S163 PolarHBondContact N-OG 2.86Å; H158-S163 WeakPolarHBondContact O-CB 3.31Å; H158-S163 PolarHBondContact O-N 2.66Å; H158-S163 PolarHBondContact O-OG 3.06Å; R161-S163 VanDerWaalsContact C-N 3.32Å; S163-I238 WeakPolarHBondContact O-CG1 3.34Å
164	A	97.8	Very high	97.2	Very high	13 Å²	13	35.7 Å²	35.7	11%	0.107	19%	0.188	C	C	.	.			trans	-150.5	173.5	177.7	0	0	0	0	0	107.6	S101 R103 G162 I233 R235	S101-A164 WeakPolarHBondContact CB-O 3.34Å; S101-A164 PolarHBondContact O-N 2.82Å; R103-A164 VanDerWaalsContact CD-O 3.25Å; R103-A164 WeakPolarHBondContact CD-O 3.5Å; R103-A164 WeakPolarHBondContact CG-O 3.39Å; R103-A164 PolarHBondContact NH1-O 2.72Å; G162-A164 PolarHBondContact O-N 2.86Å; A164-I233 CarbonylContact C-O 3.4Å; A164-I233 WeakPolarHBondContact CA-O 3.3Å; A164-I233 WeakPolarHBondContact CB-O 3.42Å; A164-R235 HydrophobicContact CB-CB 4.21Å
165	I	96.4	Very high	97.2	Very high	26 Å²	26	36.2 Å²	36.2	13%	0.133	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	124.3	161.3	-170.9	166	0	0	0	108.7	H168 A232 I233	I165-H168 VanDerWaalsContact CD1-CE1 3.42Å; I165-H168 WeakPolarHBondContact CD1-CE1 3.41Å; I165-A232 WeakPolarHBondContact O-CA 3.08Å; I165-A232 WeakPolarHBondContact O-CB 3.42Å; I165-I233 HydrophobicContact CG2-CB 3.76Å; I165-I233 HydrophobicContact CG2-CG1 3.66Å; I165-I233 VanDerWaalsContact CG2-N 3.29Å; I165-I233 PolarHBondContact N-O 2.88Å; I165-I233 PolarHBondContact O-N 2.96Å; I165-I233 VanDerWaalsContact O-N 3.09Å
166	D	95	Very high	97.2	Very high	60 Å²	60	35.5 Å²	35.5	32%	0.321	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	155.3	-176.6	-44.9	-21.2	0	0	0	111	R20 S101 H168	R20-D166 VanDerWaalsContact CD-OD2 3.22Å; R20-D166 WeakPolarHBondContact CD-OD2 3.37Å; R20-D166 VanDerWaalsContact CG-OD2 3.24Å; R20-D166 WeakPolarHBondContact CG-OD2 3.27Å; R20-D166 IonicContact CZ-OD2 3.09Å; R20-D166 IonicContact NE-OD2 2.67Å; R20-D166 PolarHBondContact NE-OD2 2.75Å; R20-D166 IonicContact NH2-OD2 2.76Å; S101-D166 PolarHBondContact OG-OD1 3.02Å; D166-H168 PolarHBondContact O-N 3.2Å; D166-H168 PolarHBondContact O-ND1 3.42Å
167	S	96.3	Very high	97.1	Very high	52 Å²	52	39 Å²	39	36%	0.364	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	123	176.3	-177.6	0	0	0	0	112.3	S193 K230 H231	S167-S193 PolarHBondContact OG-OG 3.19Å; S167-K230 WeakPolarHBondContact OG-CB 3.44Å; S167-K230 WeakPolarHBondContact OG-CD 3.39Å; S167-H231 WeakPolarHBondContact CA-O 3.26Å
168	H	97.2	Very high	97.1	Very high	49 Å²	49	40.6 Å²	40.6	23%	0.227	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	168.7	-177.5	66.7	-64.5	0	0	0	113.2	I165 D166 D170 K230 H231	I165-H168 VanDerWaalsContact CD1-CE1 3.42Å; I165-H168 WeakPolarHBondContact CD1-CE1 3.41Å; D166-H168 PolarHBondContact O-N 3.2Å; D166-H168 PolarHBondContact O-ND1 3.42Å; H168-D170 IonicContact CD2-OD1 3.36Å; H168-D170 IonicContact NE2-OD1 2.81Å; H168-K230 CarbonylContact O-C 3.57Å; H168-K230 WeakPolarHBondContact O-CA 3.5Å; H168-H231 AromaticContact CE1-CD2 3.59Å; H168-H231 AromaticContact CE1-CE1 3.96Å; H168-H231 AromaticContact CE1-NE2 3.26Å; H168-H231 PolarHBondContact CE1-NE2 2.88Å; H168-H231 VanDerWaalsContact CE1-NE2 3.26Å; H168-H231 PolarHBondContact N-O 2.96Å; H168-H231 VanDerWaalsContact N-O 3.11Å; H168-H231 PolarHBondContact ND1-O 3.4Å; H168-H231 VanDerWaalsContact ND1-O 3.1Å; H168-H231 AromaticContact NE2-CE1 3.79Å; H168-H231 AromaticContact NE2-NE2 3.27Å; H168-H231 PolarHBondContact NE2-NE2 2.81Å; H168-H231 PolarHBondContact O-N 3.44Å; H168-H231 PolarHBondContact O-ND1 3.41Å
169	L	97.6	Very high	97.1	Very high	74 Å²	74	37.8 Å²	37.8	39%	0.387	20%	0.196	S	C	.	.			trans	-110.9	144.4	163.8	-68.5	170.5	0	0	0	108.7	W229 K230	L169-W229 VanDerWaalsContact CD2-O 3.26Å; L169-W229 WeakPolarHBondContact CD2-O 3.26Å; L169-K230 HydrophobicContact CD2-CG 4.47Å; L169-K230 HydrophobicContact CG-CG 4.07Å
170	D	97.4	Very high	97.2	Very high	13 Å²	13	36.3 Å²	36.3	7%	0.07	19%	0.186	C	C	.	.			trans	-73.1	144.5	168.1	-87.8	18.6	0	0	0	110.1	H168 S172 L179 H231 R248	H168-D170 IonicContact CD2-OD1 3.36Å; H168-D170 IonicContact NE2-OD1 2.81Å; D170-S172 PolarHBondContact O-N 2.88Å; D170-S172 VanDerWaalsContact O-N 3.13Å; D170-L179 HydrophobicContact CB-CD1 3.74Å; D170-L179 HydrophobicContact CB-CD2 4.23Å; D170-H231 IonicContact OD1-CE1 3.32Å; D170-H231 IonicContact OD1-NE2 3.45Å; D170-R248 IonicContact OD1-NH2 2.9Å; D170-R248 IonicContact OD2-CZ 2.63Å; D170-R248 VanDerWaalsContact OD2-CZ 3.24Å; D170-R248 IonicContact OD2-NE 3.62Å; D170-R248 PolarHBondContact OD2-NE 3.4Å; D170-R248 IonicContact OD2-NH2 3.32Å; D170-R248 PolarHBondContact OD2-NH2 2.97Å
171	D	96.9	Very high	97.4	Very high	54 Å²	54	31 Å²	31	29%	0.289	16%	0.163	S	C	.	.			trans	-65	114.6	-174.1	-174.5	-76.9	0	0	0	111.9	F114 W173 L174 W175	F114-D171 WeakPolarHBondContact CB-OD2 3.28Å; F114-D171 HydrophobicContact CD1-CB 3.42Å; F114-D171 VanDerWaalsContact CD1-CB 3.42Å; F114-D171 WeakPolarHBondContact CD1-OD2 3.47Å; F114-D171 HydrophobicContact CE1-CB 3.51Å; F114-D171 HydrophobicContact CG-CB 4.1Å; F114-D171 HydrophobicContact CZ-CB 4.27Å; D171-W173 VanDerWaalsContact C-N 3.26Å; D171-W173 PolarHBondContact O-N 2.95Å; D171-W173 WeakPolarHBondContact OD1-CA 3.16Å; D171-W173 VanDerWaalsContact OD1-CB 3.26Å; D171-W173 WeakPolarHBondContact OD1-CB 3.43Å; D171-W173 PolarHBondContact OD1-N 2.95Å; D171-L174 PolarHBondContact OD1-N 2.76Å; D171-W175 WeakPolarHBondContact O-CB 3.23Å; D171-W175 PolarHBondContact O-N 3.09Å
172	S	96.6	Very high	97.5	Very high	65 Å²	65	28 Å²	28	46%	0.455	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-6.5	-176.8	-39.3	0	0	0	0	114.1	D170	D170-S172 PolarHBondContact O-N 2.88Å; D170-S172 VanDerWaalsContact O-N 3.13Å
173	W	97.6	Very high	97.7	Very high	22 Å²	22	28 Å²	28	8%	0.083	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-44.5	175.6	159.3	66.6	0	0	0	110.7	V112 F114 K117 K118 V119 D171 S251 E253 F254	V112-W173 HydrophobicContact CG1-CZ3 3.9Å; F114-W173 HydrophobicContact CD1-CE3 4.23Å; F114-W173 HydrophobicContact CD1-CZ3 4.37Å; K117-W173 VanDerWaalsContact CA-CZ2 3.43Å; K117-W173 HydrophobicContact CB-CD2 3.9Å; K117-W173 HydrophobicContact CB-CE3 4.24Å; K117-W173 HydrophobicContact CB-CH2 3.95Å; K117-W173 HydrophobicContact CB-CZ2 3.52Å; K117-W173 HydrophobicContact CB-CZ3 4.28Å; K117-W173 HydrophobicContact CD-CD2 3.99Å; K117-W173 HydrophobicContact CD-CG 3.78Å; K117-W173 HydrophobicContact CG-CD2 3.63Å; K117-W173 HydrophobicContact CG-CE3 4.03Å; K117-W173 HydrophobicContact CG-CG 3.94Å; K117-W173 HydrophobicContact CG-CZ2 4.23Å; K117-W173 WeakPolarHBondContact O-CH2 3.31Å; K117-W173 WeakPolarHBondContact O-CZ2 3.46Å; K118-W173 VanDerWaalsContact N-CH2 3.29Å; V119-W173 HydrophobicContact CG2-CH2 3.62Å; V119-W173 HydrophobicContact CG2-CZ2 4.36Å; V119-W173 HydrophobicContact CG2-CZ3 4.34Å; D171-W173 VanDerWaalsContact C-N 3.26Å; D171-W173 PolarHBondContact O-N 2.95Å; D171-W173 WeakPolarHBondContact OD1-CA 3.16Å; D171-W173 VanDerWaalsContact OD1-CB 3.26Å; D171-W173 WeakPolarHBondContact OD1-CB 3.43Å; D171-W173 PolarHBondContact OD1-N 2.95Å; W173-S251 WeakPolarHBondContact O-CB 3.48Å; W173-S251 PolarHBondContact O-OG 3.06Å; W173-E253 PolarHBondContact NE1-OE1 3.1Å; W173-F254 AromaticContact CE2-CZ 3.91Å; W173-F254 HydrophobicContact CH2-CZ 4.19Å; W173-F254 HydrophobicContact CZ2-CE2 4.17Å; W173-F254 AromaticContact CZ2-CZ 3.59Å; W173-F254 HydrophobicContact CZ2-CZ 3.59Å; W173-F254 AromaticContact NE1-CE2 3.97Å
174	L	97.8	Very high	97.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-40.7	179.6	-174.9	59.5	0	0	0	112.9	V112 F114 V119 D171 L250 S251 F254	V112-L174 HydrophobicContact CB-CD2 4.16Å; V112-L174 HydrophobicContact CG1-CD2 3.63Å; V112-L174 HydrophobicContact CG2-CD2 3.37Å; F114-L174 HydrophobicContact CE1-CB 4.23Å; F114-L174 HydrophobicContact CE1-CD2 4.4Å; V119-L174 HydrophobicContact CG2-CD1 3.87Å; V119-L174 HydrophobicContact CG2-CD2 4.04Å; D171-L174 PolarHBondContact OD1-N 2.76Å; L174-L250 HydrophobicContact CD1-CD2 3.74Å; L174-S251 PolarHBondContact O-N 2.91Å; L174-F254 HydrophobicContact CD1-CD1 4.3Å; L174-F254 HydrophobicContact CD1-CD2 3.9Å; L174-F254 HydrophobicContact CD1-CE1 3.92Å; L174-F254 HydrophobicContact CD1-CE2 3.49Å; L174-F254 VanDerWaalsContact CD1-CE2 3.49Å; L174-F254 HydrophobicContact CD1-CG 4.3Å; L174-F254 HydrophobicContact CD1-CZ 3.5Å
175	W	98.3	Very high	97.8	Very high	11 Å²	11	29.7 Å²	29.7	4%	0.042	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	138.4	-174.5	-49.2	139.2	0	0	0	111	V112 F114 V150 E151 D171 L179 R226 R248 E249 S251	V112-W175 HydrophobicContact CG2-CH2 4.21Å; V112-W175 HydrophobicContact CG2-CZ2 4.36Å; F114-W175 HydrophobicContact CE1-CZ2 4.26Å; F114-W175 AromaticContact CE1-NE1 3.84Å; F114-W175 AromaticContact CZ-CE2 3.99Å; F114-W175 AromaticContact CZ-CZ2 3.93Å; F114-W175 HydrophobicContact CZ-CZ2 3.93Å; F114-W175 AromaticContact CZ-NE1 3.67Å; V150-W175 HydrophobicContact CG1-CE3 4.32Å; V150-W175 HydrophobicContact CG1-CZ3 3.72Å; E151-W175 HydrophobicContact CB-CH2 3.89Å; E151-W175 HydrophobicContact CB-CZ3 4.04Å; E151-W175 HydrophobicContact CG-CH2 4.07Å; E151-W175 HydrophobicContact CG-CZ2 4.47Å; D171-W175 WeakPolarHBondContact O-CB 3.23Å; D171-W175 PolarHBondContact O-N 3.09Å; W175-L179 HydrophobicContact CB-CD2 4.42Å; W175-R226 VanDerWaalsContact C-NH2 3.3Å; W175-R226 PolarHBondContact O-NH2 2.67Å; W175-R248 HydrophobicContact CD2-CB 4.03Å; W175-R248 HydrophobicContact CD2-CG 4.45Å; W175-R248 HydrophobicContact CE3-CB 3.93Å; W175-R248 HydrophobicContact CG-CB 4.29Å; W175-R248 HydrophobicContact CG-CG 4.46Å; W175-E249 CarbonylContact C-O 2.97Å; W175-E249 WeakPolarHBondContact CA-O 3.32Å; W175-S251 WeakPolarHBondContact O-CB 3.33Å
176	G	97.8	Very high	97.9	Very high	3 Å²	3	28.8 Å²	28.8	3%	0.031	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-169.1	-177	0	0	0	0	0	113.3	R178 R226 E249 L250	G176-R178 VanDerWaalsContact C-N 3.31Å; G176-R178 PolarHBondContact O-N 3.43Å; G176-R226 PolarHBondContact O-NE 3.11Å; G176-R226 PolarHBondContact O-NH1 3.15Å; G176-R226 PolarHBondContact O-NH2 2.82Å; G176-E249 PolarHBondContact N-O 3Å; G176-L250 WeakPolarHBondContact CA-O 3.48Å
177	E	97.9	Very high	98	Very high	79 Å²	79	32.4 Å²	32.4	37%	0.369	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	-40.7	-161	-174.6	53.3	-160.2	0	0	115	G223 R226 H227 E249	E177-G223 WeakPolarHBondContact OE1-CA 3.46Å; E177-G223 PolarHBondContact OE1-N 2.92Å; E177-R226 WeakPolarHBondContact O-CD 3.44Å; E177-R226 WeakPolarHBondContact O-CG 3.36Å; E177-R226 IonicContact OE2-NH1 3.82Å; E177-R226 PolarHBondContact OE2-NH1 3.39Å; E177-H227 IonicContact OE1-NE2 3.99Å; E177-H227 IonicContact OE2-CD2 2.88Å; E177-H227 IonicContact OE2-CE1 3.86Å; E177-H227 IonicContact OE2-NE2 3.87Å; E177-H227 PolarHBondContact OE2-NE2 3.42Å; E177-E249 PolarHBondContact N-OE1 3.36Å
178	R	98.5	Very high	98.2	Very high	39 Å²	39	30.4 Å²	30.4	15%	0.147	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129.1	-172.9	-63.9	161.1	-69.2	-172.2	4.1	110.7	N143 L144 Q145 F147 G176 V180 L221 E249	N143-R178 WeakPolarHBondContact O-CD 3.41Å; L144-R178 HydrophobicContact CD2-CB 4.48Å; L144-R178 HydrophobicContact CD2-CG 4.4Å; Q145-R178 PolarHBondContact O-NH1 3.12Å; F147-R178 HydrophobicContact CD2-CB 3.97Å; F147-R178 HydrophobicContact CE2-CB 3.98Å; G176-R178 VanDerWaalsContact C-N 3.31Å; G176-R178 PolarHBondContact O-N 3.43Å; R178-V180 HydrophobicContact CB-CG2 4.37Å; R178-L221 WeakPolarHBondContact CA-O 3.41Å; R178-E249 WeakPolarHBondContact CB-OE1 3.44Å; R178-E249 IonicContact CZ-OE1 3.38Å; R178-E249 IonicContact CZ-OE2 2.84Å; R178-E249 PolarHBondContact N-OE1 2.86Å; R178-E249 IonicContact NE-OE1 2.78Å; R178-E249 PolarHBondContact NE-OE1 2.89Å; R178-E249 IonicContact NE-OE2 3.55Å; R178-E249 PolarHBondContact NE-OE2 2.9Å; R178-E249 IonicContact NH2-OE1 2.69Å; R178-E249 IonicContact NH2-OE2 3.65Å; R178-E249 PolarHBondContact NH2-OE2 2.64Å
179	L	98.7	Very high	98.2	Very high	6 Å²	6	29.5 Å²	29.5	3%	0.031	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	114.7	165.4	-54.4	176.2	0	0	0	107.5	D170 W175 A220 L221 R226 R248	D170-L179 HydrophobicContact CB-CD1 3.74Å; D170-L179 HydrophobicContact CB-CD2 4.23Å; W175-L179 HydrophobicContact CB-CD2 4.42Å; L179-A220 CarbonylContact O-C 3.44Å; L179-A220 WeakPolarHBondContact O-CA 3.49Å; L179-L221 HydrophobicContact CB-CB 4.42Å; L179-L221 PolarHBondContact N-O 3.46Å; L179-L221 PolarHBondContact O-N 2.95Å; L179-R226 HydrophobicContact CD1-CG 3.9Å; L179-R226 HydrophobicContact CG-CG 3.93Å; L179-R248 HydrophobicContact CD2-CG 4.04Å
180	V	98.9	Very high	98.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	129.3	-174.7	-178.5	0	0	0	0	109.1	M138 L144 F147 R178 L218 V219 A220 T246 Y247	M138-V180 HydrophobicContact CE-CG1 4.03Å; M138-V180 HydrophobicContact SD-CG1 3.92Å; L144-V180 HydrophobicContact CD1-CG2 4.41Å; L144-V180 HydrophobicContact CD2-CG2 3.74Å; F147-V180 HydrophobicContact CD1-CG2 4.33Å; F147-V180 HydrophobicContact CD2-CG2 4.22Å; F147-V180 HydrophobicContact CE1-CB 4.13Å; F147-V180 HydrophobicContact CE1-CG2 3.87Å; F147-V180 HydrophobicContact CE2-CG2 3.76Å; F147-V180 HydrophobicContact CG-CG2 4.49Å; F147-V180 HydrophobicContact CZ-CB 3.92Å; F147-V180 HydrophobicContact CZ-CG2 3.56Å; R178-V180 HydrophobicContact CB-CG2 4.37Å; V180-L218 HydrophobicContact CG1-CD1 3.59Å; V180-L218 HydrophobicContact CG1-CD2 3.96Å; V180-L218 HydrophobicContact CG1-CG 3.76Å; V180-V219 CarbonylContact C-O 3.53Å; V180-V219 WeakPolarHBondContact CA-O 3.48Å; V180-A220 HydrophobicContact CG2-CB 4.06Å; V180-T246 CarbonylContact O-C 3.51Å; V180-T246 WeakPolarHBondContact O-CA 3.29Å; V180-Y247 PolarHBondContact N-O 2.85Å; V180-Y247 VanDerWaalsContact N-O 3.09Å; V180-Y247 PolarHBondContact O-N 3.18Å
181	T	98.9	Very high	98.4	Very high	22 Å²	22	26.4 Å²	26.4	14%	0.135	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	128.7	-179.9	-62.3	0	0	0	0	110.8	L218 V219 C244 S245 T246	T181-L218 CarbonylContact O-C 3.59Å; T181-L218 WeakPolarHBondContact O-CA 3.41Å; T181-V219 PolarHBondContact N-O 2.81Å; T181-V219 PolarHBondContact O-N 2.84Å; T181-C244 HydrophobicContact CG2-CB 3.78Å; T181-S245 CarbonylContact C-O 3.55Å; T181-S245 VanDerWaalsContact CA-O 3.31Å; T181-S245 WeakPolarHBondContact CA-O 3.32Å; T181-T246 WeakPolarHBondContact OG1-CG2 3.43Å; T181-T246 PolarHBondContact OG1-OG1 2.84Å
182	V	98.9	Very high	98.4	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.006	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	124.9	170.4	-179.1	0	0	0	0	108.6	F78 I79 M138 M184 C217 L218 C244 S245 Y247	F78-V182 HydrophobicContact CD1-CG1 4.33Å; F78-V182 HydrophobicContact CD1-CG2 3.97Å; F78-V182 HydrophobicContact CE1-CG2 3.84Å; I79-V182 HydrophobicContact CD1-CG1 4.01Å; I79-V182 HydrophobicContact CG2-CG1 4.27Å; M138-V182 HydrophobicContact CE-CG2 3.87Å; V182-M184 HydrophobicContact CG1-CG 4.26Å; V182-C217 WeakPolarHBondContact CA-O 3.17Å; V182-L218 HydrophobicContact CG2-CD1 4.25Å; V182-C244 CarbonylContact O-C 3.51Å; V182-C244 WeakPolarHBondContact O-CA 3.38Å; V182-C244 VanDerWaalsContact O-CB 3.28Å; V182-C244 WeakPolarHBondContact O-CB 3.37Å; V182-S245 PolarHBondContact N-O 2.81Å; V182-S245 PolarHBondContact O-N 3.14Å; V182-Y247 HydrophobicContact CG2-CE2 4.06Å
183	N	98.9	Very high	98.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130.9	-178.7	-171.8	61.4	0	0	0	111.2	S186 L213 P214 R216 C217 R242	N183-S186 PolarHBondContact ND2-O 2.93Å; N183-L213 PolarHBondContact ND2-O 3.05Å; N183-P214 PolarHBondContact ND2-O 3.26Å; N183-R216 WeakPolarHBondContact O-CA 3.34Å; N183-R216 PolarHBondContact O-N 2.83Å; N183-C217 PolarHBondContact N-O 2.9Å; N183-R242 PolarHBondContact OD1-NE 3.4Å; N183-R242 PolarHBondContact OD1-NH2 2.84Å
184	M	98.8	Very high	98.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	160	-173.2	-65	167.5	-79.7	0	0	112.3	I79 E84 L87 I88 M91 V182 S186 V243 S245	I79-M184 HydrophobicContact CD1-CG 3.68Å; I79-M184 HydrophobicContact CD1-SD 4.23Å; E84-M184 HydrophobicContact CG-CB 4.14Å; E84-M184 HydrophobicContact CG-CG 4.16Å; E84-M184 WeakPolarHBondContact OE1-CA 3.47Å; L87-M184 HydrophobicContact CB-SD 4.18Å; L87-M184 HydrophobicContact CD1-SD 4.07Å; I88-M184 HydrophobicContact CD1-CB 4.1Å; I88-M184 HydrophobicContact CD1-SD 4.09Å; M91-M184 HydrophobicContact CE-CE 4.11Å; M91-M184 HydrophobicContact CE-SD 4.44Å; V182-M184 HydrophobicContact CG1-CG 4.26Å; M184-S186 PolarHBondContact O-N 2.96Å; M184-V243 WeakPolarHBondContact CA-O 3.4Å; M184-V243 HydrophobicContact CB-CB 4.47Å; M184-V243 WeakPolarHBondContact CB-O 3.46Å; M184-V243 HydrophobicContact CE-CG1 4.02Å; M184-V243 PolarHBondContact N-O 3.41Å; M184-V243 PolarHBondContact O-N 3.48Å; M184-V243 VanDerWaalsContact O-N 3.14Å; M184-V243 VanDerWaalsContact O-O 3.1Å; M184-S245 WeakPolarHBondContact CE-OG 3.46Å
185	L	98.8	Very high	98.1	Very high	47 Å²	47	27.6 Å²	27.6	25%	0.246	14%	0.136	C	C	.	.	S	Bend	trans	65.8	-45.5	179.9	-61.2	-178.8	0	0	0	116.1	E84 I88 R215 R241 V243	E84-L185 PolarHBondContact OE1-N 2.79Å; I88-L185 HydrophobicContact CD1-CD1 4Å; I88-L185 HydrophobicContact CD1-CD2 4.33Å; I88-L185 HydrophobicContact CD1-CG 3.89Å; I88-L185 HydrophobicContact CG1-CD1 4.31Å; I88-L185 HydrophobicContact CG1-CD2 3.83Å; I88-L185 HydrophobicContact CG1-CG 3.96Å; I88-L185 HydrophobicContact CG2-CD1 4.21Å; I88-L185 HydrophobicContact CG2-CD2 4.27Å; L185-R215 VanDerWaalsContact O-CD 3.3Å; L185-R215 WeakPolarHBondContact O-CD 3.49Å; L185-R241 VanDerWaalsContact CB-O 3.29Å; L185-R241 WeakPolarHBondContact CB-O 3.46Å; L185-R241 HydrophobicContact CD1-CG 4.04Å; L185-V243 HydrophobicContact CD1-CB 4.31Å; L185-V243 HydrophobicContact CD1-CG2 3.78Å
186	S	98.6	Very high	97.6	Very high	7 Å²	7	35.1 Å²	35.1	5%	0.049	17%	0.172	C	C	.	.	S	Bend	trans	-145.3	155.1	-178.5	-166.4	0	0	0	0	111.4	N183 M184 E240 R241	N183-S186 PolarHBondContact ND2-O 2.93Å; M184-S186 PolarHBondContact O-N 2.96Å; S186-E240 PolarHBondContact OG-OE2 2.82Å; S186-R241 WeakPolarHBondContact CB-O 3.37Å
187	E	98.6	Very high	97.2	Very high	137 Å²	137	35 Å²	35	64%	0.64	17%	0.172	S	C	*	.			trans	-73.3	162.9	172.6	64.5	-179.4	178.7	0	0	111.6	L213	E187-L213 CarbonylContact C-O 3.58Å; E187-L213 VanDerWaalsContact CA-O 3.23Å; E187-L213 WeakPolarHBondContact CA-O 3.47Å; E187-L213 WeakPolarHBondContact CB-O 3.46Å
188	T	98.8	Very high	96.8	Very high	9 Å²	9	31.6 Å²	31.6	6%	0.055	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	-177.2	174.5	-162.6	0	0	0	0	111.5	L213 I233 D237	T188-L213 HydrophobicContact CG2-CB 3.97Å; T188-L213 HydrophobicContact CG2-CD1 4.03Å; T188-L213 HydrophobicContact CG2-CG 4.36Å; T188-L213 PolarHBondContact N-O 3.27Å; T188-L213 PolarHBondContact O-N 3.31Å; T188-I233 HydrophobicContact CG2-CD1 4.08Å; T188-I233 WeakPolarHBondContact OG1-CG2 3.17Å; T188-D237 WeakPolarHBondContact CB-O 3.38Å; T188-D237 PolarHBondContact OG1-O 3.37Å
189	V	98.8	Very high	96.3	Very high	30 Å²	30	33.6 Å²	33.6	18%	0.182	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	124.6	170.7	-178.5	0	0	0	0	109.8	A210 I233 D237	V189-A210 HydrophobicContact CG1-CB 3.61Å; V189-I233 WeakPolarHBondContact O-CD1 3.3Å; V189-D237 HydrophobicContact CB-CB 4.14Å
190	L	98.8	Very high	95.8	Very high	13 Å²	13	39.5 Å²	39.5	7%	0.068	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	109	165.4	178.8	73.1	0	0	0	108.7	M192 V211 L213 L221 H231 I233	L190-M192 HydrophobicContact CD2-SD 3.92Å; L190-M192 HydrophobicContact CG-SD 3.95Å; L190-V211 HydrophobicContact CB-CB 4.21Å; L190-V211 PolarHBondContact N-O 2.85Å; L190-V211 PolarHBondContact O-N 3.17Å; L190-L213 HydrophobicContact CB-CD1 3.79Å; L190-L213 HydrophobicContact CB-CD2 4.5Å; L190-L213 HydrophobicContact CB-CG 4.05Å; L190-L221 HydrophobicContact CD2-CD1 4.23Å; L190-L221 HydrophobicContact CD2-CD2 4.15Å; L190-H231 HydrophobicContact CD1-CB 3.96Å; L190-I233 HydrophobicContact CB-CD1 4.17Å; L190-I233 HydrophobicContact CD1-CD1 3.87Å
191	T	98.7	Very high	95.1	Very high	10 Å²	10	45.8 Å²	45.8	6%	0.061	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	119.9	178	-65.1	0	0	0	0	109.7	H208 H231 A232 H234	T191-H208 HydrophobicContact CG2-CB 4.13Å; T191-H231 CarbonylContact O-C 3.51Å; T191-H231 VanDerWaalsContact O-CA 3.3Å; T191-H231 WeakPolarHBondContact O-CA 3.38Å; T191-A232 PolarHBondContact N-O 2.85Å; T191-A232 PolarHBondContact O-N 2.72Å; T191-H234 PolarHBondContact OG1-CE1 2.84Å
192	M	98.6	Very high	94.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	127.5	172.1	-52.6	-60.3	-64.2	0	0	108.9	F69 L190 H208 V209 V211 L221 A225 W229 K230 H231	F69-M192 HydrophobicContact CE1-CB 4.35Å; F69-M192 HydrophobicContact CE1-CG 4.03Å; F69-M192 HydrophobicContact CE2-CB 4.49Å; F69-M192 HydrophobicContact CZ-CB 3.63Å; F69-M192 HydrophobicContact CZ-CG 3.79Å; L190-M192 HydrophobicContact CD2-SD 3.92Å; L190-M192 HydrophobicContact CG-SD 3.95Å; M192-H208 CarbonylContact O-C 3.49Å; M192-H208 WeakPolarHBondContact O-CA 3.35Å; M192-V209 HydrophobicContact CB-CB 4.28Å; M192-V209 PolarHBondContact N-O 3.13Å; M192-V209 PolarHBondContact O-N 2.85Å; M192-V211 HydrophobicContact CG-CG2 3.94Å; M192-L221 HydrophobicContact CE-CD1 4.12Å; M192-L221 HydrophobicContact CE-CD2 4.31Å; M192-L221 HydrophobicContact SD-CD1 4.31Å; M192-L221 HydrophobicContact SD-CD2 4.38Å; M192-A225 HydrophobicContact CE-CB 4.21Å; M192-A225 WeakPolarHBondContact CE-O 3.41Å; M192-W229 HydrophobicContact CB-CB 4.29Å; M192-W229 HydrophobicContact CB-CE3 4.15Å; M192-W229 HydrophobicContact CE-CB 3.66Å; M192-K230 CarbonylContact C-O 3.53Å; M192-K230 WeakPolarHBondContact CA-O 3.45Å; M192-H231 HydrophobicContact CE-CB 4.14Å; M192-H231 HydrophobicContact SD-CB 3.68Å
193	S	97.6	Very high	93.9	Very high	8 Å²	8	48.6 Å²	48.6	6%	0.056	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	141.2	-170.9	57	0	0	0	0	113	S167 I207 H208 K230	S167-S193 PolarHBondContact OG-OG 3.19Å; S193-I207 CarbonylContact C-O 3.57Å; S193-I207 VanDerWaalsContact CA-O 3.29Å; S193-I207 WeakPolarHBondContact CA-O 3.17Å; S193-H208 VanDerWaalsContact CB-CD2 3.47Å; S193-H208 WeakPolarHBondContact CB-CD2 3.47Å; S193-K230 PolarHBondContact N-O 3.02Å; S193-K230 PolarHBondContact O-N 3Å; S193-K230 PolarHBondContact OG-O 3.24Å; S193-K230 VanDerWaalsContact OG-O 3.05Å
194	L	95.6	Very high	93.3	Very high	23 Å²	23	53.5 Å²	53.5	12%	0.12	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	115.3	174.2	-174.2	62.9	0	0	0	109.1	G197 L198 G206 I207 R228 W229	L194-G197 WeakPolarHBondContact CD2-O 3.38Å; L194-L198 HydrophobicContact CD2-CD2 3.73Å; L194-L198 HydrophobicContact CD2-CG 4.14Å; L194-G206 CarbonylContact O-C 3.54Å; L194-G206 WeakPolarHBondContact O-CA 3.28Å; L194-I207 PolarHBondContact N-O 3.06Å; L194-I207 PolarHBondContact O-N 3.17Å; L194-R228 HydrophobicContact CD1-CG 4.18Å; L194-W229 HydrophobicContact CB-CD2 4.22Å; L194-W229 HydrophobicContact CB-CE3 3.76Å; L194-W229 HydrophobicContact CB-CH2 3.95Å; L194-W229 HydrophobicContact CB-CZ2 4.39Å; L194-W229 HydrophobicContact CB-CZ3 3.61Å; L194-W229 HydrophobicContact CD2-CH2 4.16Å; L194-W229 HydrophobicContact CD2-CZ2 4.01Å
195	E	91.4	Very high	92.9	Very high	134 Å²	134	54.5 Å²	54.5	63%	0.626	29%	0.293	S	S	*	.	S	Bend	trans	-72.2	-36.2	-170.9	-70.9	176.1	-161	0	0	113.5	G197 K230	E195-G197 VanDerWaalsContact C-N 3.34Å; E195-K230 IonicContact OE1-NZ 3.65Å; E195-K230 PolarHBondContact OE1-NZ 3.35Å
196	E	88.4	Confident	92.5	Very high	169 Å²	169	52.7 Å²	52.7	79%	0.79	29%	0.285	S	S	*	.	S	Bend	trans	-85.7	-7.7	-176.5	-62.8	-178.9	177.7	0	0	113.3
197	G	89.8	Confident	92.3	Very high	2 Å²	2	52.3 Å²	52.3	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	72.5	-158.1	-176.9	0	0	0	0	0	114.4	L194 E195 G205	L194-G197 WeakPolarHBondContact CD2-O 3.38Å; E195-G197 VanDerWaalsContact C-N 3.34Å; G197-G205 WeakPolarHBondContact CA-O 3.08Å; G197-G205 PolarHBondContact N-O 3.07Å
198	L	89.9	Confident	92.2	Very high	6 Å²	6	48.3 Å²	48.3	3%	0.031	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	78.2	177.3	-63.4	171.1	0	0	0	108.4	F67 L194 E200 R201 G202 L203 I207 W229	F67-L198 HydrophobicContact CD2-CD1 3.86Å; F67-L198 HydrophobicContact CE2-CD1 3.69Å; F67-L198 HydrophobicContact CG-CD1 4.36Å; F67-L198 HydrophobicContact CZ-CD1 4.06Å; L194-L198 HydrophobicContact CD2-CD2 3.73Å; L194-L198 HydrophobicContact CD2-CG 4.14Å; L198-E200 WeakPolarHBondContact CD2-OE1 3.36Å; L198-E200 PolarHBondContact O-N 2.92Å; L198-R201 HydrophobicContact CB-CB 4.18Å; L198-R201 HydrophobicContact CB-CG 4.26Å; L198-R201 WeakPolarHBondContact O-CA 3.19Å; L198-R201 PolarHBondContact O-N 3.34Å; L198-G202 PolarHBondContact O-N 2.86Å; L198-L203 CarbonylContact C-O 3.49Å; L198-L203 HydrophobicContact CB-CB 4.32Å; L198-L203 PolarHBondContact N-O 2.78Å; L198-L203 PolarHBondContact O-N 2.86Å; L198-L203 VanDerWaalsContact O-N 3.1Å; L198-I207 HydrophobicContact CB-CD1 3.9Å; L198-I207 HydrophobicContact CD1-CD1 3.86Å; L198-I207 HydrophobicContact CG-CD1 3.6Å; L198-W229 HydrophobicContact CD1-CZ2 4.38Å
199	P	87.4	Confident	92.2	Very high	82 Å²	82	47.9 Å²	47.9	53%	0.532	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-57.6	-33.9	-177	-24.4	34.5	0	0	0	113.2	R201 G202	P199-R201 PolarHBondContact O-N 2.83Å; P199-R201 VanDerWaalsContact O-N 3.14Å; P199-G202 PolarHBondContact O-N 3.3Å
200	E	88.1	Confident	92.2	Very high	129 Å²	129	47.7 Å²	47.7	60%	0.603	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-63.3	-16.2	176	72.6	-76.6	-175.2	0	0	113.5	L198	L198-E200 WeakPolarHBondContact CD2-OE1 3.36Å; L198-E200 PolarHBondContact O-N 2.92Å
201	R	84.7	Confident	92.2	Very high	133 Å²	133	47.1 Å²	47.1	50%	0.502	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-108.3	8.6	174.6	-58.1	-170.6	176.2	-87.5	-2.2	112.9	L198 P199 L203	L198-R201 HydrophobicContact CB-CB 4.18Å; L198-R201 HydrophobicContact CB-CG 4.26Å; L198-R201 WeakPolarHBondContact O-CA 3.19Å; L198-R201 PolarHBondContact O-N 3.34Å; P199-R201 PolarHBondContact O-N 2.83Å; P199-R201 VanDerWaalsContact O-N 3.14Å; R201-L203 HydrophobicContact CB-CD1 4.49Å; R201-L203 HydrophobicContact CB-CG 4.42Å; R201-L203 PolarHBondContact O-N 3.05Å
202	G	85.9	Confident	92.1	Very high	59 Å²	59	54.4 Å²	54.4	61%	0.608	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	7.4	-175.2	0	0	0	0	0	114.5	L198 P199 V204	L198-G202 PolarHBondContact O-N 2.86Å; P199-G202 PolarHBondContact O-N 3.3Å; G202-V204 PolarHBondContact O-N 3.5Å
203	L	86.9	Confident	92.2	Very high	22 Å²	22	54.6 Å²	54.6	12%	0.115	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	78.2	178.7	-62.2	175.4	0	0	0	109.6	F46 F67 L198 R201 I207	F46-L203 HydrophobicContact CE2-CD1 4.12Å; F46-L203 HydrophobicContact CZ-CD1 3.69Å; F46-L203 HydrophobicContact CZ-CD2 3.97Å; F67-L203 HydrophobicContact CD1-CD1 3.99Å; F67-L203 HydrophobicContact CE1-CD1 4.05Å; L198-L203 CarbonylContact C-O 3.49Å; L198-L203 HydrophobicContact CB-CB 4.32Å; L198-L203 PolarHBondContact N-O 2.78Å; L198-L203 PolarHBondContact O-N 2.86Å; L198-L203 VanDerWaalsContact O-N 3.1Å; R201-L203 HydrophobicContact CB-CD1 4.49Å; R201-L203 HydrophobicContact CB-CG 4.42Å; R201-L203 PolarHBondContact O-N 3.05Å; L203-I207 HydrophobicContact CB-CD1 3.72Å; L203-I207 HydrophobicContact CB-CG1 4.33Å; L203-I207 HydrophobicContact CD1-CD1 3.86Å; L203-I207 HydrophobicContact CG-CD1 4.45Å
204	V	86.4	Confident	92.2	Very high	104 Å²	104	55.7 Å²	55.7	63%	0.63	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	129.4	176.7	-177	0	0	0	0	109.6	H44 G202	H44-V204 PolarHBondContact NE2-O 3.32Å; G202-V204 PolarHBondContact O-N 3.5Å
205	G	88.4	Confident	92.4	Very high	20 Å²	20	59.3 Å²	59.3	21%	0.206	31%	0.307	C	S	.	.	S	Bend	trans	106.1	178.5	-175.8	0	0	0	0	0	112.6	T42 G197	T42-G205 CarbonylContact O-C 3.49Å; T42-G205 WeakPolarHBondContact O-CA 3.3Å; G197-G205 WeakPolarHBondContact CA-O 3.08Å; G197-G205 PolarHBondContact N-O 3.07Å
206	G	92.1	Very high	92.7	Very high	9 Å²	9	54.8 Å²	54.8	9%	0.093	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	146	-176.4	0	0	0	0	0	111.7	T42 V43 H44 L194	T42-G206 PolarHBondContact O-N 3.11Å; V43-G206 CarbonylContact C-O 3.51Å; V43-G206 VanDerWaalsContact CA-O 3.26Å; V43-G206 WeakPolarHBondContact CA-O 3.44Å; H44-G206 PolarHBondContact N-O 3.24Å; L194-G206 CarbonylContact O-C 3.54Å; L194-G206 WeakPolarHBondContact O-CA 3.28Å
207	I	94.4	Very high	93.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129	173.8	-62.8	168.5	0	0	0	108.8	H44 F46 F67 S193 L194 L198 L203 V209 W229	H44-I207 HydrophobicContact CB-CG1 4.34Å; H44-I207 WeakPolarHBondContact O-CA 3.46Å; F46-I207 HydrophobicContact CD2-CG2 3.74Å; F46-I207 HydrophobicContact CE2-CG2 3.83Å; F67-I207 HydrophobicContact CE1-CG2 4.35Å; F67-I207 HydrophobicContact CZ-CG2 4.05Å; S193-I207 CarbonylContact C-O 3.57Å; S193-I207 VanDerWaalsContact CA-O 3.29Å; S193-I207 WeakPolarHBondContact CA-O 3.17Å; L194-I207 PolarHBondContact N-O 3.06Å; L194-I207 PolarHBondContact O-N 3.17Å; L198-I207 HydrophobicContact CB-CD1 3.9Å; L198-I207 HydrophobicContact CD1-CD1 3.86Å; L198-I207 HydrophobicContact CG-CD1 3.6Å; L203-I207 HydrophobicContact CB-CD1 3.72Å; L203-I207 HydrophobicContact CB-CG1 4.33Å; L203-I207 HydrophobicContact CD1-CD1 3.86Å; L203-I207 HydrophobicContact CG-CD1 4.45Å; I207-V209 HydrophobicContact CG2-CG2 4.16Å; I207-W229 HydrophobicContact CB-CH2 4.22Å; I207-W229 HydrophobicContact CB-CZ3 4.19Å; I207-W229 HydrophobicContact CG2-CH2 3.81Å; I207-W229 HydrophobicContact CG2-CZ3 3.88Å
208	H	96.4	Very high	93.6	Very high	52 Å²	52	46.6 Å²	46.6	24%	0.241	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.2	170.8	-68.7	177.9	0	0	0	110.1	V43 H44 H45 F46 T191 M192 S193	V43-H208 HydrophobicContact CG1-CB 4.48Å; H44-H208 PolarHBondContact O-N 3.23Å; H45-H208 WeakPolarHBondContact CA-O 3.46Å; H45-H208 AromaticContact CE1-ND1 3.64Å; F46-H208 PolarHBondContact N-O 3.23Å; T191-H208 HydrophobicContact CG2-CB 4.13Å; M192-H208 CarbonylContact O-C 3.49Å; M192-H208 WeakPolarHBondContact O-CA 3.35Å; S193-H208 VanDerWaalsContact CB-CD2 3.47Å; S193-H208 WeakPolarHBondContact CB-CD2 3.47Å
209	V	97.8	Very high	94.1	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	116.3	171.8	-173.9	0	0	0	0	108.3	F46 A55 F67 F69 M192 I207 W229	F46-V209 HydrophobicContact CB-CG2 4.24Å; F46-V209 WeakPolarHBondContact O-CA 3.2Å; A55-V209 HydrophobicContact CB-CG1 3.83Å; A55-V209 HydrophobicContact CB-CG2 3.9Å; F67-V209 HydrophobicContact CZ-CG2 3.84Å; F69-V209 HydrophobicContact CD1-CG1 4.26Å; F69-V209 HydrophobicContact CD2-CB 4.39Å; F69-V209 HydrophobicContact CD2-CG1 4.29Å; F69-V209 HydrophobicContact CD2-CG2 3.89Å; F69-V209 HydrophobicContact CE1-CG1 4.27Å; F69-V209 HydrophobicContact CE2-CB 4Å; F69-V209 HydrophobicContact CE2-CG1 4.29Å; F69-V209 HydrophobicContact CE2-CG2 3.66Å; F69-V209 HydrophobicContact CG-CG1 4.27Å; F69-V209 HydrophobicContact CZ-CB 4.11Å; F69-V209 HydrophobicContact CZ-CG1 4.3Å; F69-V209 HydrophobicContact CZ-CG2 4.28Å; M192-V209 HydrophobicContact CB-CB 4.28Å; M192-V209 PolarHBondContact N-O 3.13Å; M192-V209 PolarHBondContact O-N 2.85Å; I207-V209 HydrophobicContact CG2-CG2 4.16Å; V209-W229 HydrophobicContact CG2-CH2 4.09Å; V209-W229 HydrophobicContact CG2-CZ3 3.85Å
210	A	98.3	Very high	94.6	Very high	27 Å²	27	42.6 Å²	42.6	22%	0.223	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.1	178.2	0	0	0	0	0	110.4	F46 L47 Y48 V189	F46-A210 PolarHBondContact O-N 3.36Å; L47-A210 HydrophobicContact CD1-CB 4.31Å; Y48-A210 PolarHBondContact N-O 3.17Å; V189-A210 HydrophobicContact CG1-CB 3.61Å
211	V	98.7	Very high	95.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	113	172.2	-177.2	0	0	0	0	108.3	Y48 V72 L190 M192 L213	Y48-V211 HydrophobicContact CD1-CG1 4.01Å; Y48-V211 HydrophobicContact CD1-CG2 4.24Å; Y48-V211 HydrophobicContact CG-CG2 4.07Å; V72-V211 HydrophobicContact CG1-CG1 4.17Å; L190-V211 HydrophobicContact CB-CB 4.21Å; L190-V211 PolarHBondContact N-O 2.85Å; L190-V211 PolarHBondContact O-N 3.17Å; M192-V211 HydrophobicContact CG-CG2 3.94Å; V211-L213 HydrophobicContact CG1-CD2 4.02Å
212	R	98.5	Very high	95.8	Very high	164 Å²	164	33 Å²	33	62%	0.619	18%	0.179	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72	130.9	176.3	-66.8	-177.2	-177.2	-177	2.6	109.8	L47 P214	L47-R212 HydrophobicContact CD1-CG 4.08Å; R212-P214 WeakPolarHBondContact O-CD 3.34Å
213	L	98.8	Very high	96.3	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.016	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	96.2	177.7	-59.5	-171.7	0	0	0	109.2	L74 N183 E187 T188 L190 V211 V219	L74-L213 HydrophobicContact CD1-CD2 4.03Å; N183-L213 PolarHBondContact ND2-O 3.05Å; E187-L213 CarbonylContact C-O 3.58Å; E187-L213 VanDerWaalsContact CA-O 3.23Å; E187-L213 WeakPolarHBondContact CA-O 3.47Å; E187-L213 WeakPolarHBondContact CB-O 3.46Å; T188-L213 HydrophobicContact CG2-CB 3.97Å; T188-L213 HydrophobicContact CG2-CD1 4.03Å; T188-L213 HydrophobicContact CG2-CG 4.36Å; T188-L213 PolarHBondContact N-O 3.27Å; T188-L213 PolarHBondContact O-N 3.31Å; L190-L213 HydrophobicContact CB-CD1 3.79Å; L190-L213 HydrophobicContact CB-CD2 4.5Å; L190-L213 HydrophobicContact CB-CG 4.05Å; V211-L213 HydrophobicContact CG1-CD2 4.02Å; L213-V219 HydrophobicContact CD1-CG1 4.1Å; L213-V219 HydrophobicContact CD2-CB 3.78Å; L213-V219 HydrophobicContact CD2-CG1 3.82Å; L213-V219 HydrophobicContact CD2-CG2 4.06Å
214	P	98.6	Very high	96.8	Very high	32 Å²	32	34.7 Å²	34.7	21%	0.208	18%	0.177	C	C	.	.			trans	-60.1	157.1	173.6	-24.2	35	0	0	0	112	E76 N183 R212 C217	E76-P214 HydrophobicContact CG-CG 4.19Å; N183-P214 PolarHBondContact ND2-O 3.26Å; R212-P214 WeakPolarHBondContact O-CD 3.34Å; P214-C217 HydrophobicContact CB-CB 4.49Å; P214-C217 WeakPolarHBondContact O-CB 3.14Å; P214-C217 PolarHBondContact O-N 2.89Å; P214-C217 PolarHBondContact O-SG 3.09Å
215	R	98.7	Very high	97.4	Very high	99 Å²	99	29.7 Å²	29.7	37%	0.374	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	142.6	169.5	-168.4	-169.9	162.6	-177.9	-8.2	109.9	E84 L185 C217	E84-R215 VanDerWaalsContact CD-NE 3.28Å; E84-R215 VanDerWaalsContact OE1-CG 3.3Å; E84-R215 WeakPolarHBondContact OE1-CG 3.4Å; E84-R215 IonicContact OE1-CZ 2.86Å; E84-R215 IonicContact OE1-NE 3.91Å; E84-R215 PolarHBondContact OE1-NE 3.23Å; E84-R215 IonicContact OE2-CZ 3.53Å; E84-R215 IonicContact OE2-NE 3.96Å; E84-R215 PolarHBondContact OE2-NE 2.86Å; E84-R215 IonicContact OE2-NH2 3.01Å; E84-R215 PolarHBondContact OE2-NH2 2.84Å; L185-R215 VanDerWaalsContact O-CD 3.3Å; L185-R215 WeakPolarHBondContact O-CD 3.49Å; R215-C217 PolarHBondContact O-N 2.81Å
216	R	98.8	Very high	97.8	Very high	38 Å²	38	29.3 Å²	29.3	14%	0.143	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	12.9	-178.5	-56.5	176.9	-58.9	-104	1.5	115.6	N77 F78 I79 E81 E84 N183	N77-R216 CarbonylContact C-O 3.25Å; N77-R216 PolarHBondContact OD1-NH2 3.37Å; F78-R216 PolarHBondContact N-O 3.21Å; I79-R216 HydrophobicContact CD1-CB 4.37Å; I79-R216 HydrophobicContact CD1-CG 4.28Å; I79-R216 HydrophobicContact CG1-CB 3.62Å; I79-R216 HydrophobicContact CG1-CG 3.86Å; I79-R216 PolarHBondContact N-O 3.32Å; I79-R216 WeakPolarHBondContact O-CB 3.29Å; I79-R216 WeakPolarHBondContact O-CD 3.3Å; E81-R216 IonicContact OE1-CZ 3.59Å; E81-R216 IonicContact OE1-NH1 3.42Å; E81-R216 PolarHBondContact OE1-NH1 2.83Å; E81-R216 IonicContact OE1-NH2 2.81Å; E84-R216 HydrophobicContact CB-CG 4.3Å; E84-R216 HydrophobicContact CG-CG 4.43Å; N183-R216 WeakPolarHBondContact O-CA 3.34Å; N183-R216 PolarHBondContact O-N 2.83Å
217	C	98.9	Very high	98.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.152	C	C	.	.			trans	-80.6	159.4	174.9	81.9	0	0	0	0	111.9	L74 W75 V182 N183 P214 R215	L74-C217 HydrophobicContact CD1-CB 4.07Å; W75-C217 CarbonylContact O-C 3.53Å; W75-C217 VanDerWaalsContact O-CA 3.24Å; W75-C217 WeakPolarHBondContact O-CA 3.46Å; V182-C217 WeakPolarHBondContact CA-O 3.17Å; N183-C217 PolarHBondContact N-O 2.9Å; P214-C217 HydrophobicContact CB-CB 4.49Å; P214-C217 WeakPolarHBondContact O-CB 3.14Å; P214-C217 PolarHBondContact O-N 2.89Å; P214-C217 PolarHBondContact O-SG 3.09Å; R215-C217 PolarHBondContact O-N 2.81Å
218	L	98.8	Very high	98.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	134.9	160.2	175.8	154.2	0	0	0	108.7	F73 L74 W75 F78 M138 L144 V180 T181 V182 A220	F73-L218 HydrophobicContact CD1-CD2 4.19Å; F73-L218 HydrophobicContact CE1-CD2 4.22Å; L74-L218 WeakPolarHBondContact CA-O 3.39Å; W75-L218 HydrophobicContact CB-CB 4.34Å; W75-L218 PolarHBondContact N-O 2.94Å; W75-L218 PolarHBondContact O-N 2.57Å; F78-L218 HydrophobicContact CB-CB 3.67Å; F78-L218 HydrophobicContact CD1-CB 3.73Å; F78-L218 HydrophobicContact CD1-CD1 3.83Å; F78-L218 HydrophobicContact CD1-CG 4.44Å; F78-L218 HydrophobicContact CD2-CB 4.09Å; F78-L218 HydrophobicContact CD2-CD1 3.95Å; F78-L218 HydrophobicContact CE1-CB 4.44Å; F78-L218 HydrophobicContact CE1-CD1 3.69Å; F78-L218 HydrophobicContact CE2-CD1 3.78Å; F78-L218 HydrophobicContact CG-CB 3.54Å; F78-L218 HydrophobicContact CG-CD1 3.98Å; F78-L218 HydrophobicContact CG-CG 4.43Å; F78-L218 HydrophobicContact CZ-CD1 3.67Å; M138-L218 HydrophobicContact CE-CD1 3.74Å; M138-L218 HydrophobicContact CG-CD1 3.63Å; M138-L218 HydrophobicContact SD-CD1 4.25Å; L144-L218 HydrophobicContact CD1-CD2 4.04Å; V180-L218 HydrophobicContact CG1-CD1 3.59Å; V180-L218 HydrophobicContact CG1-CD2 3.96Å; V180-L218 HydrophobicContact CG1-CG 3.76Å; T181-L218 CarbonylContact O-C 3.59Å; T181-L218 WeakPolarHBondContact O-CA 3.41Å; V182-L218 HydrophobicContact CG2-CD1 4.25Å; L218-A220 HydrophobicContact CD2-CB 4.42Å
219	V	98.8	Very high	98.3	Very high	3 Å²	3	35 Å²	35	2%	0.018	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.2	168.7	61.4	0	0	0	0	109.6	V72 F73 L74 V180 T181 L213 L221	V72-V219 HydrophobicContact CG1-CG2 4.1Å; F73-V219 CarbonylContact O-C 3.53Å; F73-V219 VanDerWaalsContact O-CA 3.29Å; F73-V219 WeakPolarHBondContact O-CA 3.43Å; L74-V219 HydrophobicContact CD1-CB 4.22Å; V180-V219 CarbonylContact C-O 3.53Å; V180-V219 WeakPolarHBondContact CA-O 3.48Å; T181-V219 PolarHBondContact N-O 2.81Å; T181-V219 PolarHBondContact O-N 2.84Å; L213-V219 HydrophobicContact CD1-CG1 4.1Å; L213-V219 HydrophobicContact CD2-CB 3.78Å; L213-V219 HydrophobicContact CD2-CG1 3.82Å; L213-V219 HydrophobicContact CD2-CG2 4.06Å; V219-L221 HydrophobicContact CG2-CD2 4.36Å
220	A	98.7	Very high	98.3	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.008	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	127.9	170.6	0	0	0	0	0	110.2	F73 L144 L179 V180 L218	F73-A220 HydrophobicContact CB-CB 4.3Å; F73-A220 HydrophobicContact CD1-CB 4.34Å; F73-A220 PolarHBondContact N-O 3.23Å; F73-A220 PolarHBondContact O-N 3.45Å; L144-A220 HydrophobicContact CD2-CB 3.85Å; L179-A220 CarbonylContact O-C 3.44Å; L179-A220 WeakPolarHBondContact O-CA 3.49Å; V180-A220 HydrophobicContact CG2-CB 4.06Å; L218-A220 HydrophobicContact CD2-CB 4.42Å
221	L	98.8	Very high	98.3	Very high	8 Å²	8	38 Å²	38	4%	0.042	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132	170.6	-55.2	179.6	0	0	0	109.3	G71 V72 R178 L179 L190 M192 V219 A225 R226	G71-L221 CarbonylContact O-C 3.52Å; G71-L221 WeakPolarHBondContact O-CA 3.38Å; V72-L221 HydrophobicContact CG1-CD2 4.48Å; V72-L221 HydrophobicContact CG2-CD2 3.92Å; R178-L221 WeakPolarHBondContact CA-O 3.41Å; L179-L221 HydrophobicContact CB-CB 4.42Å; L179-L221 PolarHBondContact N-O 3.46Å; L179-L221 PolarHBondContact O-N 2.95Å; L190-L221 HydrophobicContact CD2-CD1 4.23Å; L190-L221 HydrophobicContact CD2-CD2 4.15Å; M192-L221 HydrophobicContact CE-CD1 4.12Å; M192-L221 HydrophobicContact CE-CD2 4.31Å; M192-L221 HydrophobicContact SD-CD1 4.31Å; M192-L221 HydrophobicContact SD-CD2 4.38Å; V219-L221 HydrophobicContact CG2-CD2 4.36Å; L221-A225 HydrophobicContact CD2-CB 4.45Å; L221-R226 HydrophobicContact CB-CB 4.18Å
222	Y	98.4	Very high	98.3	Very high	53 Å²	53	38 Å²	38	21%	0.208	17%	0.167	C	C	.	.			trans	-150.4	173.3	175.3	57	-83.6	0	0	0	109.8	G71 F73 E224 A225 R226	G71-Y222 CarbonylContact C-O 3.51Å; G71-Y222 WeakPolarHBondContact CA-O 3.49Å; G71-Y222 PolarHBondContact O-N 3.35Å; G71-Y222 VanDerWaalsContact O-O 3.13Å; F73-Y222 HydrophobicContact CB-CE1 3.86Å; Y222-E224 PolarHBondContact O-N 3.3Å; Y222-A225 PolarHBondContact O-N 3.17Å; Y222-R226 VanDerWaalsContact CA-CB 3.5Å; Y222-R226 PolarHBondContact O-N 2.81Å
223	G	97.8	Very high	98.3	Very high	25 Å²	25	30.5 Å²	30.5	26%	0.258	14%	0.139	S	C	.	.	H	α-helix	trans	55.2	-139.3	179.3	0	0	0	0	0	112.8	E177 A225 R226 H227	E177-G223 WeakPolarHBondContact OE1-CA 3.46Å; E177-G223 PolarHBondContact OE1-N 2.92Å; G223-A225 VanDerWaalsContact C-N 3.32Å; G223-A225 PolarHBondContact O-N 3.26Å; G223-R226 PolarHBondContact O-N 3.2Å; G223-R226 VanDerWaalsContact O-N 3.11Å; G223-H227 PolarHBondContact O-CD2 3.5Å; G223-H227 PolarHBondContact O-N 3.24Å
224	E	96.6	Very high	98.3	Very high	90 Å²	90	32.9 Å²	32.9	42%	0.421	15%	0.15	S	C	.	.	H	α-helix	trans	-58.2	-42.2	-177.9	-71.5	-156.9	109.7	0	0	112.7	Y222 R226 H227 R228 W229	Y222-E224 PolarHBondContact O-N 3.3Å; E224-R226 PolarHBondContact O-N 3.42Å; E224-R226 VanDerWaalsContact O-N 3.17Å; E224-H227 PolarHBondContact O-N 3.46Å; E224-R228 WeakPolarHBondContact O-CA 3.19Å; E224-R228 WeakPolarHBondContact O-CB 3.4Å; E224-R228 PolarHBondContact O-N 3.37Å; E224-R228 WeakPolarHBondContact OE1-CD 3.45Å; E224-R228 IonicContact OE1-CZ 3.84Å; E224-R228 IonicContact OE1-NH1 3.24Å; E224-R228 PolarHBondContact OE1-NH1 3.25Å; E224-W229 PolarHBondContact O-N 2.95Å
225	A	98.2	Very high	98.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-57	-34.2	179.1	0	0	0	0	0	112.5	F69 G71 V72 M192 L221 Y222 G223	F69-A225 HydrophobicContact CE1-CB 4.47Å; G71-A225 WeakPolarHBondContact O-CB 3.15Å; V72-A225 HydrophobicContact CG2-CB 3.93Å; M192-A225 HydrophobicContact CE-CB 4.21Å; M192-A225 WeakPolarHBondContact CE-O 3.41Å; L221-A225 HydrophobicContact CD2-CB 4.45Å; Y222-A225 PolarHBondContact O-N 3.17Å; G223-A225 VanDerWaalsContact C-N 3.32Å; G223-A225 PolarHBondContact O-N 3.26Å
226	R	97.9	Very high	98.1	Very high	12 Å²	12	36.2 Å²	36.2	5%	0.045	16%	0.163	C	C	.	.	H	α-helix	trans	-82.2	-36.4	179.4	179.5	-107.1	170.3	166.9	-15.9	113.5	W175 G176 E177 L179 L221 Y222 G223 E224	W175-R226 VanDerWaalsContact C-NH2 3.3Å; W175-R226 PolarHBondContact O-NH2 2.67Å; G176-R226 PolarHBondContact O-NE 3.11Å; G176-R226 PolarHBondContact O-NH1 3.15Å; G176-R226 PolarHBondContact O-NH2 2.82Å; E177-R226 WeakPolarHBondContact O-CD 3.44Å; E177-R226 WeakPolarHBondContact O-CG 3.36Å; E177-R226 IonicContact OE2-NH1 3.82Å; E177-R226 PolarHBondContact OE2-NH1 3.39Å; L179-R226 HydrophobicContact CD1-CG 3.9Å; L179-R226 HydrophobicContact CG-CG 3.93Å; L221-R226 HydrophobicContact CB-CB 4.18Å; Y222-R226 VanDerWaalsContact CA-CB 3.5Å; Y222-R226 PolarHBondContact O-N 2.81Å; G223-R226 PolarHBondContact O-N 3.2Å; G223-R226 VanDerWaalsContact O-N 3.11Å; E224-R226 PolarHBondContact O-N 3.42Å; E224-R226 VanDerWaalsContact O-N 3.17Å
227	H	97.7	Very high	98.1	Very high	78 Å²	78	36.2 Å²	36.2	36%	0.361	17%	0.166	S	C	.	.	H	α-helix	trans	-101.2	-29	-169.7	-70.9	-77.5	0	0	0	115	E177 G223 E224	E177-H227 IonicContact OE1-NE2 3.99Å; E177-H227 IonicContact OE2-CD2 2.88Å; E177-H227 IonicContact OE2-CE1 3.86Å; E177-H227 IonicContact OE2-NE2 3.87Å; E177-H227 PolarHBondContact OE2-NE2 3.42Å; G223-H227 PolarHBondContact O-CD2 3.5Å; G223-H227 PolarHBondContact O-N 3.24Å; E224-H227 PolarHBondContact O-N 3.46Å
228	R	97.3	Very high	98.1	Very high	94 Å²	94	36.5 Å²	36.5	36%	0.355	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-36.5	-171.9	-175.7	178.8	175.2	-169.2	-1.6	112.1	L194 E224	L194-R228 HydrophobicContact CD1-CG 4.18Å; E224-R228 WeakPolarHBondContact O-CA 3.19Å; E224-R228 WeakPolarHBondContact O-CB 3.4Å; E224-R228 PolarHBondContact O-N 3.37Å; E224-R228 WeakPolarHBondContact OE1-CD 3.45Å; E224-R228 IonicContact OE1-CZ 3.84Å; E224-R228 IonicContact OE1-NH1 3.24Å; E224-R228 PolarHBondContact OE1-NH1 3.25Å
229	W	98.3	Very high	98	Very high	7 Å²	7	43.7 Å²	43.7	3%	0.027	20%	0.202	C	C	.	.	S	Bend	trans	-94.6	121.9	-175	-65.7	80.2	0	0	0	110.9	F67 F69 L169 M192 L194 L198 I207 V209 E224	F67-W229 HydrophobicContact CE2-CH2 4.05Å; F67-W229 HydrophobicContact CE2-CZ2 4.06Å; F67-W229 AromaticContact CZ-CH2 3.94Å; F67-W229 HydrophobicContact CZ-CH2 3.94Å; F67-W229 HydrophobicContact CZ-CZ2 4.43Å; F69-W229 HydrophobicContact CD2-CH2 4.44Å; F69-W229 HydrophobicContact CD2-CZ2 4.13Å; F69-W229 AromaticContact CE2-CD2 3.56Å; F69-W229 HydrophobicContact CE2-CD2 3.56Å; F69-W229 AromaticContact CE2-CE2 3.46Å; F69-W229 VanDerWaalsContact CE2-CE2 3.46Å; F69-W229 AromaticContact CE2-CE3 3.79Å; F69-W229 HydrophobicContact CE2-CE3 3.79Å; F69-W229 HydrophobicContact CE2-CG 4.14Å; F69-W229 AromaticContact CE2-CH2 3.88Å; F69-W229 HydrophobicContact CE2-CH2 3.88Å; F69-W229 AromaticContact CE2-CZ2 3.64Å; F69-W229 HydrophobicContact CE2-CZ2 3.64Å; F69-W229 AromaticContact CE2-CZ3 3.95Å; F69-W229 HydrophobicContact CE2-CZ3 3.95Å; F69-W229 AromaticContact CE2-NE1 3.93Å; F69-W229 AromaticContact CZ-CD2 3.98Å; F69-W229 HydrophobicContact CZ-CD2 3.98Å; F69-W229 HydrophobicContact CZ-CE3 4.22Å; F69-W229 HydrophobicContact CZ-CG 4.18Å; L169-W229 VanDerWaalsContact CD2-O 3.26Å; L169-W229 WeakPolarHBondContact CD2-O 3.26Å; M192-W229 HydrophobicContact CB-CB 4.29Å; M192-W229 HydrophobicContact CB-CE3 4.15Å; M192-W229 HydrophobicContact CE-CB 3.66Å; L194-W229 HydrophobicContact CB-CD2 4.22Å; L194-W229 HydrophobicContact CB-CE3 3.76Å; L194-W229 HydrophobicContact CB-CH2 3.95Å; L194-W229 HydrophobicContact CB-CZ2 4.39Å; L194-W229 HydrophobicContact CB-CZ3 3.61Å; L194-W229 HydrophobicContact CD2-CH2 4.16Å; L194-W229 HydrophobicContact CD2-CZ2 4.01Å; L198-W229 HydrophobicContact CD1-CZ2 4.38Å; I207-W229 HydrophobicContact CB-CH2 4.22Å; I207-W229 HydrophobicContact CB-CZ3 4.19Å; I207-W229 HydrophobicContact CG2-CH2 3.81Å; I207-W229 HydrophobicContact CG2-CZ3 3.88Å; V209-W229 HydrophobicContact CG2-CH2 4.09Å; V209-W229 HydrophobicContact CG2-CZ3 3.85Å; E224-W229 PolarHBondContact O-N 2.95Å
230	K	98.6	Very high	98	Very high	69 Å²	69	49.5 Å²	49.5	30%	0.3	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	138.1	172.8	-65.6	177.4	-177.1	176.6	0	109.3	S167 H168 L169 M192 S193 E195	S167-K230 WeakPolarHBondContact OG-CB 3.44Å; S167-K230 WeakPolarHBondContact OG-CD 3.39Å; H168-K230 CarbonylContact O-C 3.57Å; H168-K230 WeakPolarHBondContact O-CA 3.5Å; L169-K230 HydrophobicContact CD2-CG 4.47Å; L169-K230 HydrophobicContact CG-CG 4.07Å; M192-K230 CarbonylContact C-O 3.53Å; M192-K230 WeakPolarHBondContact CA-O 3.45Å; S193-K230 PolarHBondContact N-O 3.02Å; S193-K230 PolarHBondContact O-N 3Å; S193-K230 PolarHBondContact OG-O 3.24Å; S193-K230 VanDerWaalsContact OG-O 3.05Å; E195-K230 IonicContact OE1-NZ 3.65Å; E195-K230 PolarHBondContact OE1-NZ 3.35Å
231	H	98.6	Very high	98	Very high	22 Å²	22	52.5 Å²	52.5	10%	0.102	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	146.9	-179.4	63.8	-85.8	0	0	0	112.1	S167 H168 D170 L190 T191 M192	S167-H231 WeakPolarHBondContact CA-O 3.26Å; H168-H231 AromaticContact CE1-CD2 3.59Å; H168-H231 AromaticContact CE1-CE1 3.96Å; H168-H231 AromaticContact CE1-NE2 3.26Å; H168-H231 PolarHBondContact CE1-NE2 2.88Å; H168-H231 VanDerWaalsContact CE1-NE2 3.26Å; H168-H231 PolarHBondContact N-O 2.96Å; H168-H231 VanDerWaalsContact N-O 3.11Å; H168-H231 PolarHBondContact ND1-O 3.4Å; H168-H231 VanDerWaalsContact ND1-O 3.1Å; H168-H231 AromaticContact NE2-CE1 3.79Å; H168-H231 AromaticContact NE2-NE2 3.27Å; H168-H231 PolarHBondContact NE2-NE2 2.81Å; H168-H231 PolarHBondContact O-N 3.44Å; H168-H231 PolarHBondContact O-ND1 3.41Å; D170-H231 IonicContact OD1-CE1 3.32Å; D170-H231 IonicContact OD1-NE2 3.45Å; L190-H231 HydrophobicContact CD1-CB 3.96Å; T191-H231 CarbonylContact O-C 3.51Å; T191-H231 VanDerWaalsContact O-CA 3.3Å; T191-H231 WeakPolarHBondContact O-CA 3.38Å; M192-H231 HydrophobicContact CE-CB 4.14Å; M192-H231 HydrophobicContact SD-CB 3.68Å
232	A	98.4	Very high	98	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	158.8	-177.5	0	0	0	0	0	111.4	I165 T191	I165-A232 WeakPolarHBondContact O-CA 3.08Å; I165-A232 WeakPolarHBondContact O-CB 3.42Å; T191-A232 PolarHBondContact N-O 2.85Å; T191-A232 PolarHBondContact O-N 2.72Å
233	I	98.5	Very high	98	Very high	6 Å²	6	49.8 Å²	49.8	3%	0.031	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	118	161.9	-52.1	-67.8	0	0	0	106.1	Y157 A164 I165 T188 V189 L190 I238	Y157-I233 HydrophobicContact CE1-CB 4.47Å; A164-I233 CarbonylContact C-O 3.4Å; A164-I233 WeakPolarHBondContact CA-O 3.3Å; A164-I233 WeakPolarHBondContact CB-O 3.42Å; I165-I233 HydrophobicContact CG2-CB 3.76Å; I165-I233 HydrophobicContact CG2-CG1 3.66Å; I165-I233 VanDerWaalsContact CG2-N 3.29Å; I165-I233 PolarHBondContact N-O 2.88Å; I165-I233 PolarHBondContact O-N 2.96Å; I165-I233 VanDerWaalsContact O-N 3.09Å; T188-I233 HydrophobicContact CG2-CD1 4.08Å; T188-I233 WeakPolarHBondContact OG1-CG2 3.17Å; V189-I233 WeakPolarHBondContact O-CD1 3.3Å; L190-I233 HydrophobicContact CB-CD1 4.17Å; L190-I233 HydrophobicContact CD1-CD1 3.87Å; I233-I238 HydrophobicContact CG2-CD1 3.59Å; I233-I238 HydrophobicContact CG2-CG1 4.02Å
234	H	97.9	Very high	98.1	Very high	54 Å²	54	48.7 Å²	48.7	25%	0.25	22%	0.217	C	C	.	.			trans	-82.5	162.9	-178.1	-54.8	154.6	0	0	0	111.7	T191 E236 D237	T191-H234 PolarHBondContact OG1-CE1 2.84Å; H234-E236 VanDerWaalsContact C-N 3.29Å; H234-E236 HydrophobicContact CB-CG 4.06Å; H234-E236 VanDerWaalsContact CB-OE2 3.29Å; H234-E236 WeakPolarHBondContact CB-OE2 3.09Å; H234-E236 IonicContact CG-OE1 2.95Å; H234-E236 IonicContact ND1-OE1 3.57Å; H234-E236 PolarHBondContact O-N 2.86Å; H234-D237 WeakPolarHBondContact CB-OD2 3.48Å; H234-D237 IonicContact CG-OD2 3.88Å; H234-D237 IonicContact ND1-OD2 2.95Å; H234-D237 PolarHBondContact O-N 3.3Å
235	R	96.5	Very high	98.2	Very high	78 Å²	78	44.5 Å²	44.5	29%	0.294	20%	0.198	S	C	.	.	S	Bend	trans	-65.9	-38.3	-175.3	179.9	179.6	-69.1	176	-0.8	110.9	R21 L23 E26 G162 A164 D237 I238	R21-R235 PolarHBondContact O-NH2 3.05Å; L23-R235 VanDerWaalsContact CD2-NH1 3.27Å; E26-R235 IonicContact OE1-CZ 2.64Å; E26-R235 IonicContact OE1-NH1 3.56Å; E26-R235 PolarHBondContact OE1-NH1 2.92Å; E26-R235 IonicContact OE1-NH2 3.68Å; E26-R235 PolarHBondContact OE1-NH2 2.74Å; E26-R235 IonicContact OE2-NH1 3.88Å; E26-R235 PolarHBondContact OE2-NH1 2.78Å; G162-R235 PolarHBondContact O-NE 3.32Å; A164-R235 HydrophobicContact CB-CB 4.21Å; R235-D237 PolarHBondContact O-N 3.11Å; R235-I238 PolarHBondContact O-N 3.1Å
236	E	97.2	Very high	98.2	Very high	122 Å²	122	45.4 Å²	45.4	57%	0.57	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-24.1	177.5	57.7	-92.5	-141.6	0	0	113.5	H234 I238 Q239	H234-E236 VanDerWaalsContact C-N 3.29Å; H234-E236 HydrophobicContact CB-CG 4.06Å; H234-E236 VanDerWaalsContact CB-OE2 3.29Å; H234-E236 WeakPolarHBondContact CB-OE2 3.09Å; H234-E236 IonicContact CG-OE1 2.95Å; H234-E236 IonicContact ND1-OE1 3.57Å; H234-E236 PolarHBondContact O-N 2.86Å; E236-I238 VanDerWaalsContact C-N 3.28Å; E236-I238 PolarHBondContact O-N 3.28Å; E236-Q239 PolarHBondContact O-NE2 2.88Å
237	D	98.3	Very high	98.3	Very high	38 Å²	38	44.8 Å²	44.8	20%	0.203	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	3.3	179.1	-59	-45.9	0	0	0	112.6	T188 V189 H234 R235	T188-D237 WeakPolarHBondContact CB-O 3.38Å; T188-D237 PolarHBondContact OG1-O 3.37Å; V189-D237 HydrophobicContact CB-CB 4.14Å; H234-D237 WeakPolarHBondContact CB-OD2 3.48Å; H234-D237 IonicContact CG-OD2 3.88Å; H234-D237 IonicContact ND1-OD2 2.95Å; H234-D237 PolarHBondContact O-N 3.3Å; R235-D237 PolarHBondContact O-N 3.11Å
238	I	98.5	Very high	98.3	Very high	6 Å²	6	43 Å²	43	3%	0.031	19%	0.191	C	C	.	.			trans	-108.8	91.4	172	-58.1	-59.1	0	0	0	108.2	Y157 P159 S163 I233 R235 E236 E240 R242	Y157-I238 HydrophobicContact CD1-CD1 3.91Å; Y157-I238 HydrophobicContact CD1-CG1 4.16Å; Y157-I238 HydrophobicContact CG-CD1 4.13Å; P159-I238 HydrophobicContact CB-CG2 4.46Å; P159-I238 WeakPolarHBondContact CB-O 3.48Å; S163-I238 WeakPolarHBondContact O-CG1 3.34Å; I233-I238 HydrophobicContact CG2-CD1 3.59Å; I233-I238 HydrophobicContact CG2-CG1 4.02Å; R235-I238 PolarHBondContact O-N 3.1Å; E236-I238 VanDerWaalsContact C-N 3.28Å; E236-I238 PolarHBondContact O-N 3.28Å; I238-E240 WeakPolarHBondContact CG2-O 3.49Å; I238-R242 HydrophobicContact CD1-CB 4.31Å
239	Q	97.9	Very high	98.4	Very high	152 Å²	152	39.3 Å²	39.3	71%	0.71	18%	0.178	S	C	*	.			trans	-87.6	-33	-178.9	-63.2	-77.8	-33.1	0	0	112	E236	E236-Q239 PolarHBondContact O-NE2 2.88Å
240	E	98.4	Very high	98.4	Very high	125 Å²	125	39.2 Å²	39.2	58%	0.584	18%	0.177	S	C	*	.	S	Bend	trans	-134.5	-179.1	179.9	-60.4	-178.9	111.2	0	0	110.8	S186 I238 R242	S186-E240 PolarHBondContact OG-OE2 2.82Å; I238-E240 WeakPolarHBondContact CG2-O 3.49Å; E240-R242 PolarHBondContact O-N 3.05Å
241	R	98.6	Very high	98.4	Very high	63 Å²	63	36.5 Å²	36.5	24%	0.238	17%	0.167	C	C	.	.			trans	-60.9	124.1	172.1	-176	-176.3	179.2	-158.7	-0.4	108.6	D92 D156 Y157 L185 S186	D92-R241 IonicContact OD1-CZ 3.86Å; D92-R241 IonicContact OD1-NH1 3.85Å; D92-R241 IonicContact OD1-NH2 3.08Å; D92-R241 PolarHBondContact OD1-NH2 2.81Å; D92-R241 IonicContact OD2-CZ 3.53Å; D92-R241 IonicContact OD2-NH1 3.64Å; D92-R241 PolarHBondContact OD2-NH1 3.16Å; D92-R241 IonicContact OD2-NH2 3.67Å; D92-R241 PolarHBondContact OD2-NH2 3.27Å; D156-R241 IonicContact OD1-CZ 3.76Å; D156-R241 IonicContact OD1-NE 2.73Å; D156-R241 PolarHBondContact OD1-NE 3.25Å; D156-R241 IonicContact OD1-NH2 2.79Å; D156-R241 PolarHBondContact OD1-NH2 2.78Å; Y157-R241 WeakPolarHBondContact O-CA 3.25Å; L185-R241 VanDerWaalsContact CB-O 3.29Å; L185-R241 WeakPolarHBondContact CB-O 3.46Å; L185-R241 HydrophobicContact CD1-CG 4.04Å; S186-R241 WeakPolarHBondContact CB-O 3.37Å
242	R	98.8	Very high	98.3	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.015	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	134.6	177	176.1	-169.5	177.3	-95.6	-0.8	108.8	Y157 N183 I238 E240 C244	Y157-R242 WeakPolarHBondContact CB-O 3.49Å; Y157-R242 WeakPolarHBondContact CD2-O 3.44Å; Y157-R242 PolarHBondContact N-O 2.83Å; Y157-R242 PolarHBondContact O-N 2.97Å; Y157-R242 VanDerWaalsContact O-N 3.07Å; N183-R242 PolarHBondContact OD1-NE 3.4Å; N183-R242 PolarHBondContact OD1-NH2 2.84Å; I238-R242 HydrophobicContact CD1-CB 4.31Å; E240-R242 PolarHBondContact O-N 3.05Å; R242-C244 PolarHBondContact NH1-SG 3.37Å; R242-C244 VanDerWaalsContact NH1-SG 3.4Å
243	V	98.9	Very high	98.3	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	143.9	171.4	175.7	0	0	0	0	108.5	I88 M91 W96 L155 D156 M184 L185	I88-V243 HydrophobicContact CD1-CB 3.66Å; I88-V243 HydrophobicContact CD1-CG1 3.74Å; I88-V243 HydrophobicContact CD1-CG2 3.99Å; M91-V243 HydrophobicContact SD-CG1 3.91Å; W96-V243 HydrophobicContact CH2-CG1 4.05Å; W96-V243 HydrophobicContact CZ2-CG1 4.46Å; L155-V243 VanDerWaalsContact O-CA 3.3Å; L155-V243 WeakPolarHBondContact O-CA 3.32Å; D156-V243 HydrophobicContact CB-CG2 4.27Å; D156-V243 WeakPolarHBondContact OD1-CG2 3.44Å; M184-V243 WeakPolarHBondContact CA-O 3.4Å; M184-V243 HydrophobicContact CB-CB 4.47Å; M184-V243 WeakPolarHBondContact CB-O 3.46Å; M184-V243 HydrophobicContact CE-CG1 4.02Å; M184-V243 PolarHBondContact N-O 3.41Å; M184-V243 PolarHBondContact O-N 3.48Å; M184-V243 VanDerWaalsContact O-N 3.14Å; M184-V243 VanDerWaalsContact O-O 3.1Å; L185-V243 HydrophobicContact CD1-CB 4.31Å; L185-V243 HydrophobicContact CD1-CG2 3.78Å
244	C	98.8	Very high	98.3	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.02	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	151.2	169.2	67.3	0	0	0	0	111.6	N154 L155 T181 V182 R242	N154-C244 CarbonylContact C-O 3.54Å; N154-C244 VanDerWaalsContact CA-O 3.27Å; N154-C244 WeakPolarHBondContact CA-O 3.35Å; L155-C244 PolarHBondContact N-O 2.94Å; L155-C244 PolarHBondContact O-N 2.82Å; T181-C244 HydrophobicContact CG2-CB 3.78Å; V182-C244 CarbonylContact O-C 3.51Å; V182-C244 WeakPolarHBondContact O-CA 3.38Å; V182-C244 VanDerWaalsContact O-CB 3.28Å; V182-C244 WeakPolarHBondContact O-CB 3.37Å; R242-C244 PolarHBondContact NH1-SG 3.37Å; R242-C244 VanDerWaalsContact NH1-SG 3.4Å
245	S	98.9	Very high	98.2	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.014	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	113.8	172	-64.2	0	0	0	0	108.9	M91 C153 N154 T181 V182 M184	M91-S245 VanDerWaalsContact CE-OG 3.31Å; M91-S245 WeakPolarHBondContact CE-OG 3.33Å; C153-S245 WeakPolarHBondContact O-CA 3.28Å; N154-S245 WeakPolarHBondContact OD1-CB 3.46Å; N154-S245 PolarHBondContact OD1-OG 2.86Å; T181-S245 CarbonylContact C-O 3.55Å; T181-S245 VanDerWaalsContact CA-O 3.31Å; T181-S245 WeakPolarHBondContact CA-O 3.32Å; V182-S245 PolarHBondContact N-O 2.81Å; V182-S245 PolarHBondContact O-N 3.14Å; M184-S245 WeakPolarHBondContact CE-OG 3.46Å
246	T	98.9	Very high	98.3	Very high	18 Å²	18	43.3 Å²	43.3	11%	0.11	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	128.1	176.6	-59.9	0	0	0	0	109.6	Q152 C153 V180 T181 R248	Q152-T246 CarbonylContact C-O 3.6Å; Q152-T246 VanDerWaalsContact CA-O 3.25Å; Q152-T246 WeakPolarHBondContact CA-O 3.45Å; C153-T246 PolarHBondContact N-O 3.18Å; C153-T246 PolarHBondContact O-N 3.18Å; V180-T246 CarbonylContact O-C 3.51Å; V180-T246 WeakPolarHBondContact O-CA 3.29Å; T181-T246 WeakPolarHBondContact OG1-CG2 3.43Å; T181-T246 PolarHBondContact OG1-OG1 2.84Å; T246-R248 HydrophobicContact CG2-CG 4.48Å
247	Y	98.9	Very high	98.2	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	135.7	-179.5	-59.9	-92.5	0	0	0	110	S131 V135 M138 P149 E151 Q152 V180 V182	S131-Y247 PolarHBondContact OG-OH 3.47Å; V135-Y247 HydrophobicContact CG2-CD1 4.41Å; V135-Y247 HydrophobicContact CG2-CE1 4.32Å; M138-Y247 HydrophobicContact CE-CD2 3.87Å; M138-Y247 HydrophobicContact CE-CE2 3.76Å; P149-Y247 HydrophobicContact CB-CD1 4.2Å; P149-Y247 HydrophobicContact CG-CD1 4.19Å; E151-Y247 WeakPolarHBondContact O-CA 3.46Å; Q152-Y247 HydrophobicContact CB-CD1 3.99Å; Q152-Y247 HydrophobicContact CB-CE1 4.03Å; Q152-Y247 HydrophobicContact CG-CD1 4.15Å; Q152-Y247 HydrophobicContact CG-CE1 3.81Å; V180-Y247 PolarHBondContact N-O 2.85Å; V180-Y247 VanDerWaalsContact N-O 3.09Å; V180-Y247 PolarHBondContact O-N 3.18Å; V182-Y247 HydrophobicContact CG2-CE2 4.06Å
248	R	98.8	Very high	98.1	Very high	39 Å²	39	42 Å²	42	15%	0.147	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	132	-179.1	-56.6	-177.5	178.1	112	-6.2	111	P149 V150 E151 D170 W175 L179 T246	P149-R248 CarbonylContact C-O 3.58Å; P149-R248 VanDerWaalsContact CA-O 3.27Å; P149-R248 WeakPolarHBondContact CA-O 3.3Å; V150-R248 PolarHBondContact N-O 3.41Å; E151-R248 HydrophobicContact CB-CB 4.43Å; E151-R248 PolarHBondContact N-O 3.46Å; E151-R248 PolarHBondContact O-N 3.07Å; E151-R248 IonicContact OE1-NH1 3.36Å; E151-R248 PolarHBondContact OE1-NH1 3.49Å; E151-R248 VanDerWaalsContact OE1-NH1 3.09Å; E151-R248 WeakPolarHBondContact OE2-CD 3.41Å; E151-R248 VanDerWaalsContact OE2-CG 3.3Å; E151-R248 WeakPolarHBondContact OE2-CG 3.46Å; E151-R248 IonicContact OE2-CZ 2.66Å; E151-R248 IonicContact OE2-NE 3.63Å; E151-R248 IonicContact OE2-NH1 2.71Å; E151-R248 PolarHBondContact OE2-NH1 3.47Å; D170-R248 IonicContact OD1-NH2 2.9Å; D170-R248 IonicContact OD2-CZ 2.63Å; D170-R248 VanDerWaalsContact OD2-CZ 3.24Å; D170-R248 IonicContact OD2-NE 3.62Å; D170-R248 PolarHBondContact OD2-NE 3.4Å; D170-R248 IonicContact OD2-NH2 3.32Å; D170-R248 PolarHBondContact OD2-NH2 2.97Å; W175-R248 HydrophobicContact CD2-CB 4.03Å; W175-R248 HydrophobicContact CD2-CG 4.45Å; W175-R248 HydrophobicContact CE3-CB 3.93Å; W175-R248 HydrophobicContact CG-CB 4.29Å; W175-R248 HydrophobicContact CG-CG 4.46Å; L179-R248 HydrophobicContact CD2-CG 4.04Å; T246-R248 HydrophobicContact CG2-CG 4.48Å
249	E	98.2	Very high	98.1	Very high	18 Å²	18	51.5 Å²	51.5	8%	0.084	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	168.4	170.8	66.8	-174.5	172.8	0	0	111.6	F147 Q148 W175 G176 E177 R178	F147-E249 HydrophobicContact CD2-CB 4.15Å; F147-E249 HydrophobicContact CD2-CG 4.24Å; F147-E249 VanDerWaalsContact CD2-OE2 3.31Å; F147-E249 WeakPolarHBondContact CD2-OE2 3.23Å; F147-E249 HydrophobicContact CE2-CB 3.86Å; F147-E249 HydrophobicContact CE2-CG 4.01Å; Q148-E249 WeakPolarHBondContact O-CB 3.25Å; W175-E249 CarbonylContact C-O 2.97Å; W175-E249 WeakPolarHBondContact CA-O 3.32Å; G176-E249 PolarHBondContact N-O 3Å; E177-E249 PolarHBondContact N-OE1 3.36Å; R178-E249 WeakPolarHBondContact CB-OE1 3.44Å; R178-E249 IonicContact CZ-OE1 3.38Å; R178-E249 IonicContact CZ-OE2 2.84Å; R178-E249 PolarHBondContact N-OE1 2.86Å; R178-E249 IonicContact NE-OE1 2.78Å; R178-E249 PolarHBondContact NE-OE1 2.89Å; R178-E249 IonicContact NE-OE2 3.55Å; R178-E249 PolarHBondContact NE-OE2 2.9Å; R178-E249 IonicContact NH2-OE1 2.69Å; R178-E249 IonicContact NH2-OE2 3.65Å; R178-E249 PolarHBondContact NH2-OE2 2.64Å
250	L	98.5	Very high	98.1	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	144.1	177.4	-75.8	170.8	0	0	0	111.9	V150 L174 G176 F254 L255 L267 L268	V150-L250 HydrophobicContact CB-CD1 4.44Å; V150-L250 HydrophobicContact CB-CD2 4.33Å; V150-L250 HydrophobicContact CB-CG 3.95Å; V150-L250 HydrophobicContact CG1-CD2 3.75Å; V150-L250 HydrophobicContact CG1-CG 3.76Å; V150-L250 HydrophobicContact CG2-CD1 4.24Å; V150-L250 HydrophobicContact CG2-CD2 4.27Å; V150-L250 HydrophobicContact CG2-CG 4.15Å; L174-L250 HydrophobicContact CD1-CD2 3.74Å; G176-L250 WeakPolarHBondContact CA-O 3.48Å; L250-F254 HydrophobicContact CB-CB 4Å; L250-F254 HydrophobicContact CD1-CB 3.98Å; L250-F254 HydrophobicContact CD2-CB 3.88Å; L250-F254 HydrophobicContact CD2-CD1 4.4Å; L250-F254 HydrophobicContact CD2-CD2 4.46Å; L250-F254 HydrophobicContact CD2-CG 4.02Å; L250-F254 HydrophobicContact CG-CB 4.17Å; L250-L255 HydrophobicContact CB-CD2 4.14Å; L250-L267 HydrophobicContact CD1-CB 4.47Å; L250-L267 HydrophobicContact CD2-CD1 4.18Å; L250-L268 HydrophobicContact CD1-CD1 4.09Å; L250-L268 HydrophobicContact CD1-CD2 4.27Å; L250-L268 HydrophobicContact CD1-CG 3.83Å
251	S	98.2	Very high	98	Very high	12 Å²	12	43.6 Å²	43.6	8%	0.084	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-68	163.2	170.4	82.7	0	0	0	0	111.8	W173 L174 W175 E253 F254 L255	W173-S251 WeakPolarHBondContact O-CB 3.48Å; W173-S251 PolarHBondContact O-OG 3.06Å; L174-S251 PolarHBondContact O-N 2.91Å; W175-S251 WeakPolarHBondContact O-CB 3.33Å; S251-E253 PolarHBondContact O-N 3.14Å; S251-E253 PolarHBondContact OG-N 3.23Å; S251-F254 PolarHBondContact O-N 3.41Å; S251-L255 PolarHBondContact O-N 2.89Å
252	A	97.4	Very high	98	Very high	78 Å²	78	47.1 Å²	47.1	65%	0.645	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-23.1	177.9	0	0	0	0	0	113.9	F254 L255 G258	A252-F254 PolarHBondContact O-N 2.92Å; A252-L255 PolarHBondContact O-N 2.64Å; A252-G258 WeakPolarHBondContact O-CA 3.03Å
253	E	97.6	Very high	98	Very high	39 Å²	39	48.9 Å²	48.9	18%	0.182	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-27	176	-175.7	166	128.4	0	0	112.6	W173 S251 G258 R259 Q260	W173-E253 PolarHBondContact NE1-OE1 3.1Å; S251-E253 PolarHBondContact O-N 3.14Å; S251-E253 PolarHBondContact OG-N 3.23Å; E253-G258 CarbonylContact O-C 3.48Å; E253-G258 VanDerWaalsContact O-C 3.25Å; E253-G258 WeakPolarHBondContact O-CA 3.47Å; E253-R259 HydrophobicContact CG-CB 4.41Å; E253-R259 PolarHBondContact O-N 2.73Å; E253-R259 VanDerWaalsContact O-N 3.12Å; E253-R259 IonicContact OE2-CZ 3.71Å; E253-R259 IonicContact OE2-NE 3.71Å; E253-R259 IonicContact OE2-NH2 2.75Å; E253-R259 PolarHBondContact OE2-NH2 3.46Å; E253-Q260 HydrophobicContact CG-CB 4.33Å; E253-Q260 HydrophobicContact CG-CG 4.01Å; E253-Q260 WeakPolarHBondContact O-CA 3.43Å; E253-Q260 WeakPolarHBondContact O-CB 3.21Å; E253-Q260 PolarHBondContact O-N 3.22Å
254	F	98.3	Very high	97.9	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.009	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-5	-176.4	-64.4	-97	0	0	0	113.4	V119 W173 L174 L250 S251 A252 Q260 L263 G264	V119-F254 HydrophobicContact CG2-CE1 4.12Å; V119-F254 HydrophobicContact CG2-CZ 4.13Å; W173-F254 AromaticContact CE2-CZ 3.91Å; W173-F254 HydrophobicContact CH2-CZ 4.19Å; W173-F254 HydrophobicContact CZ2-CE2 4.17Å; W173-F254 AromaticContact CZ2-CZ 3.59Å; W173-F254 HydrophobicContact CZ2-CZ 3.59Å; W173-F254 AromaticContact NE1-CE2 3.97Å; L174-F254 HydrophobicContact CD1-CD1 4.3Å; L174-F254 HydrophobicContact CD1-CD2 3.9Å; L174-F254 HydrophobicContact CD1-CE1 3.92Å; L174-F254 HydrophobicContact CD1-CE2 3.49Å; L174-F254 VanDerWaalsContact CD1-CE2 3.49Å; L174-F254 HydrophobicContact CD1-CG 4.3Å; L174-F254 HydrophobicContact CD1-CZ 3.5Å; L250-F254 HydrophobicContact CB-CB 4Å; L250-F254 HydrophobicContact CD1-CB 3.98Å; L250-F254 HydrophobicContact CD2-CB 3.88Å; L250-F254 HydrophobicContact CD2-CD1 4.4Å; L250-F254 HydrophobicContact CD2-CD2 4.46Å; L250-F254 HydrophobicContact CD2-CG 4.02Å; L250-F254 HydrophobicContact CG-CB 4.17Å; S251-F254 PolarHBondContact O-N 3.41Å; A252-F254 PolarHBondContact O-N 2.92Å; F254-Q260 HydrophobicContact CD1-CB 3.45Å; F254-Q260 VanDerWaalsContact CD1-CB 3.45Å; F254-Q260 HydrophobicContact CD1-CG 4.3Å; F254-Q260 HydrophobicContact CE1-CB 3.61Å; F254-Q260 HydrophobicContact CE1-CG 3.96Å; F254-Q260 HydrophobicContact CG-CB 3.94Å; F254-Q260 HydrophobicContact CZ-CB 4.2Å; F254-Q260 HydrophobicContact CZ-CG 4.19Å; F254-L263 HydrophobicContact CE1-CD2 4.06Å; F254-L263 HydrophobicContact CE1-CG 4.46Å; F254-G264 WeakPolarHBondContact O-CA 3.29Å
255	L	97.6	Very high	97.9	Very high	65 Å²	65	51 Å²	51	34%	0.34	30%	0.295	S	S	.	.	S	Bend	trans	-85.2	172.3	176.1	-66.6	-177.9	0	0	0	111.1	L250 S251 A252 A257 G258 A261	L250-L255 HydrophobicContact CB-CD2 4.14Å; S251-L255 PolarHBondContact O-N 2.89Å; A252-L255 PolarHBondContact O-N 2.64Å; L255-A257 PolarHBondContact O-N 3.31Å; L255-G258 WeakPolarHBondContact O-CA 3.33Å; L255-G258 PolarHBondContact O-N 2.86Å; L255-A261 WeakPolarHBondContact O-CB 3.39Å
256	P	97.3	Very high	97.9	Very high	120 Å²	120	55.5 Å²	55.5	78%	0.779	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	140.6	174.1	-28.6	36.9	0	0	0	112	G258	P256-G258 PolarHBondContact O-N 3.18Å
257	A	95.4	Very high	97.8	Very high	115 Å²	115	54.6 Å²	54.6	95%	0.95	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	-4	-169.5	0	0	0	0	0	116.3	L255	L255-A257 PolarHBondContact O-N 3.31Å
258	G	97.1	Very high	97.8	Very high	18 Å²	18	55.6 Å²	55.6	19%	0.186	31%	0.314	C	S	.	.	S	Bend	trans	-75.9	156.6	171.3	0	0	0	0	0	113.4	A252 E253 L255 P256 Q260 A261	A252-G258 WeakPolarHBondContact O-CA 3.03Å; E253-G258 CarbonylContact O-C 3.48Å; E253-G258 VanDerWaalsContact O-C 3.25Å; E253-G258 WeakPolarHBondContact O-CA 3.47Å; L255-G258 WeakPolarHBondContact O-CA 3.33Å; L255-G258 PolarHBondContact O-N 2.86Å; P256-G258 PolarHBondContact O-N 3.18Å; G258-Q260 PolarHBondContact O-N 2.81Å; G258-A261 VanDerWaalsContact O-CB 3.32Å; G258-A261 WeakPolarHBondContact O-CB 3.28Å; G258-A261 PolarHBondContact O-N 3.47Å
259	R	97.3	Very high	97.8	Very high	204 Å²	204	59.5 Å²	59.5	77%	0.77	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-21.9	-179.3	-65.7	-176.5	-66.4	-179.8	-1.2	113.9	E253	E253-R259 HydrophobicContact CG-CB 4.41Å; E253-R259 PolarHBondContact O-N 2.73Å; E253-R259 VanDerWaalsContact O-N 3.12Å; E253-R259 IonicContact OE2-CZ 3.71Å; E253-R259 IonicContact OE2-NE 3.71Å; E253-R259 IonicContact OE2-NH2 2.75Å; E253-R259 PolarHBondContact OE2-NH2 3.46Å
260	Q	97.5	Very high	97.8	Very high	81 Å²	81	60.7 Å²	60.7	38%	0.379	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	22.3	179.5	-62.8	-68.6	-24.3	0	0	111.6	E253 F254 G258 E262 L263 G264	E253-Q260 HydrophobicContact CG-CB 4.33Å; E253-Q260 HydrophobicContact CG-CG 4.01Å; E253-Q260 WeakPolarHBondContact O-CA 3.43Å; E253-Q260 WeakPolarHBondContact O-CB 3.21Å; E253-Q260 PolarHBondContact O-N 3.22Å; F254-Q260 HydrophobicContact CD1-CB 3.45Å; F254-Q260 VanDerWaalsContact CD1-CB 3.45Å; F254-Q260 HydrophobicContact CD1-CG 4.3Å; F254-Q260 HydrophobicContact CE1-CB 3.61Å; F254-Q260 HydrophobicContact CE1-CG 3.96Å; F254-Q260 HydrophobicContact CG-CB 3.94Å; F254-Q260 HydrophobicContact CZ-CB 4.2Å; F254-Q260 HydrophobicContact CZ-CG 4.19Å; G258-Q260 PolarHBondContact O-N 2.81Å; Q260-E262 VanDerWaalsContact C-N 3.29Å; Q260-E262 PolarHBondContact O-N 2.81Å; Q260-L263 PolarHBondContact O-N 2.96Å; Q260-G264 PolarHBondContact O-N 3.06Å
261	A	97.9	Very high	97.8	Very high	30 Å²	30	60.5 Å²	60.5	25%	0.248	34%	0.343	C	S	.	.	H	α-helix	trans	-53.1	-41.3	-174.9	0	0	0	0	0	113.7	L255 G258 L263 G264 A265	L255-A261 WeakPolarHBondContact O-CB 3.39Å; G258-A261 VanDerWaalsContact O-CB 3.32Å; G258-A261 WeakPolarHBondContact O-CB 3.28Å; G258-A261 PolarHBondContact O-N 3.47Å; A261-L263 VanDerWaalsContact C-N 3.34Å; A261-L263 PolarHBondContact O-N 3.45Å; A261-G264 PolarHBondContact O-N 3.43Å; A261-A265 WeakPolarHBondContact O-CB 3.26Å; A261-A265 PolarHBondContact O-N 3.21Å
262	E	98	Very high	97.7	Very high	137 Å²	137	62.6 Å²	62.6	64%	0.64	35%	0.353	S	S	*	.	H	α-helix	trans	-63.6	-40.6	179.2	-167.1	-164.1	152	0	0	112	Q260 K266	Q260-E262 VanDerWaalsContact C-N 3.29Å; Q260-E262 PolarHBondContact O-N 2.81Å; E262-K266 WeakPolarHBondContact O-CG 3.49Å; E262-K266 PolarHBondContact O-N 3.1Å; E262-K266 WeakPolarHBondContact OE1-CE 3.29Å; E262-K266 IonicContact OE1-NZ 3.39Å; E262-K266 PolarHBondContact OE1-NZ 2.93Å
263	L	97.9	Very high	97.8	Very high	42 Å²	42	61.8 Å²	61.8	22%	0.22	34%	0.34	C	S	.	.	H	α-helix	trans	-69.9	-40.5	176.6	177.1	57.3	0	0	0	111.1	V119 F254 Q260 A261 K266 L267	V119-L263 HydrophobicContact CB-CD2 4.22Å; F254-L263 HydrophobicContact CE1-CD2 4.06Å; F254-L263 HydrophobicContact CE1-CG 4.46Å; Q260-L263 PolarHBondContact O-N 2.96Å; A261-L263 VanDerWaalsContact C-N 3.34Å; A261-L263 PolarHBondContact O-N 3.45Å; L263-K266 PolarHBondContact O-N 3.47Å; L263-L267 HydrophobicContact CD1-CD1 4.4Å; L263-L267 HydrophobicContact CD1-CG 4.36Å; L263-L267 HydrophobicContact CG-CD1 4.16Å; L263-L267 VanDerWaalsContact O-CG 3.29Å; L263-L267 WeakPolarHBondContact O-CG 3.43Å; L263-L267 PolarHBondContact O-N 2.95Å
264	G	98.3	Very high	97.8	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-61.7	-43.2	175.5	0	0	0	0	0	113	F254 Q260 A261 K266 L267 L268	F254-G264 WeakPolarHBondContact O-CA 3.29Å; Q260-G264 PolarHBondContact O-N 3.06Å; A261-G264 PolarHBondContact O-N 3.43Å; G264-K266 PolarHBondContact O-N 3.5Å; G264-L267 WeakPolarHBondContact O-CB 3.4Å; G264-L267 PolarHBondContact O-N 2.96Å; G264-L268 WeakPolarHBondContact O-CG 3.35Å; G264-L268 PolarHBondContact O-N 3.18Å
265	A	98.3	Very high	97.7	Very high	46 Å²	46	70.7 Å²	70.7	38%	0.38	37%	0.373	S	S	.	.	H	α-helix	trans	-57.8	-48.8	174.3	0	0	0	0	0	111.6	A261 L267 L268 D269	A261-A265 WeakPolarHBondContact O-CB 3.26Å; A261-A265 PolarHBondContact O-N 3.21Å; A265-L267 VanDerWaalsContact C-N 3.29Å; A265-L267 PolarHBondContact O-N 3.43Å; A265-L268 PolarHBondContact O-N 3.31Å; A265-D269 WeakPolarHBondContact O-CB 3.48Å; A265-D269 VanDerWaalsContact O-CG 3.31Å; A265-D269 PolarHBondContact O-N 3.18Å
266	K	98.2	Very high	97.6	Very high	97 Å²	97	68.2 Å²	68.2	42%	0.422	36%	0.363	S	S	.	.	H	α-helix	trans	-59.1	-39.7	176.3	-70.9	172.8	-172.3	169.1	0	112.7	E262 L263 G264 I270	E262-K266 WeakPolarHBondContact O-CG 3.49Å; E262-K266 PolarHBondContact O-N 3.1Å; E262-K266 WeakPolarHBondContact OE1-CE 3.29Å; E262-K266 IonicContact OE1-NZ 3.39Å; E262-K266 PolarHBondContact OE1-NZ 2.93Å; L263-K266 PolarHBondContact O-N 3.47Å; G264-K266 PolarHBondContact O-N 3.5Å; K266-I270 WeakPolarHBondContact O-CD1 3.47Å; K266-I270 WeakPolarHBondContact O-CG1 2.94Å; K266-I270 PolarHBondContact O-N 3.17Å
267	L	98.3	Very high	97.5	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-66	-43.9	178.2	-75.5	167.6	0	0	0	111.7	P110 V119 L121 F124 V150 L250 L263 G264 A265 I270 A271	P110-L267 HydrophobicContact CB-CD2 3.58Å; P110-L267 HydrophobicContact CG-CD2 3.73Å; V119-L267 HydrophobicContact CG1-CD1 4.14Å; V119-L267 HydrophobicContact CG1-CD2 4.38Å; L121-L267 HydrophobicContact CD2-CD2 3.37Å; L121-L267 HydrophobicContact CD2-CG 4.04Å; F124-L267 HydrophobicContact CD1-CD2 4.22Å; F124-L267 HydrophobicContact CE1-CD2 4.33Å; V150-L267 HydrophobicContact CG2-CB 3.5Å; V150-L267 HydrophobicContact CG2-CD1 4.48Å; V150-L267 HydrophobicContact CG2-CD2 4.44Å; V150-L267 HydrophobicContact CG2-CG 4.37Å; L250-L267 HydrophobicContact CD1-CB 4.47Å; L250-L267 HydrophobicContact CD2-CD1 4.18Å; L263-L267 HydrophobicContact CD1-CD1 4.4Å; L263-L267 HydrophobicContact CD1-CG 4.36Å; L263-L267 HydrophobicContact CG-CD1 4.16Å; L263-L267 VanDerWaalsContact O-CG 3.29Å; L263-L267 WeakPolarHBondContact O-CG 3.43Å; L263-L267 PolarHBondContact O-N 2.95Å; G264-L267 WeakPolarHBondContact O-CB 3.4Å; G264-L267 PolarHBondContact O-N 2.96Å; A265-L267 VanDerWaalsContact C-N 3.29Å; A265-L267 PolarHBondContact O-N 3.43Å; L267-I270 PolarHBondContact O-N 3.07Å; L267-A271 VanDerWaalsContact O-CB 3.27Å; L267-A271 WeakPolarHBondContact O-CB 3.36Å; L267-A271 PolarHBondContact O-N 2.96Å
268	L	98.3	Very high	97.4	Very high	21 Å²	21	62.1 Å²	62.1	11%	0.11	31%	0.312	C	S	.	.	H	α-helix	trans	-65.7	-42.9	177.1	-71.8	169.3	0	0	0	111.7	Q148 V150 L250 G264 A265 I270 A271 L272	Q148-L268 HydrophobicContact CB-CD2 3.97Å; V150-L268 HydrophobicContact CB-CD2 4.46Å; L250-L268 HydrophobicContact CD1-CD1 4.09Å; L250-L268 HydrophobicContact CD1-CD2 4.27Å; L250-L268 HydrophobicContact CD1-CG 3.83Å; G264-L268 WeakPolarHBondContact O-CG 3.35Å; G264-L268 PolarHBondContact O-N 3.18Å; A265-L268 PolarHBondContact O-N 3.31Å; L268-I270 PolarHBondContact O-N 3.23Å; L268-A271 PolarHBondContact O-N 2.87Å; L268-L272 WeakPolarHBondContact O-CB 3.33Å; L268-L272 WeakPolarHBondContact O-CG 3.25Å; L268-L272 PolarHBondContact O-N 2.93Å
269	D	98.2	Very high	96.9	Very high	120 Å²	120	65 Å²	65	64%	0.642	33%	0.326	S	S	*	.	H	α-helix	trans	-56.3	-39.7	176.5	-75.3	-13.3	0	0	0	111.6	A265 T273	A265-D269 WeakPolarHBondContact O-CB 3.48Å; A265-D269 VanDerWaalsContact O-CG 3.31Å; A265-D269 PolarHBondContact O-N 3.18Å; D269-T273 WeakPolarHBondContact O-CG2 3.17Å
270	I	98.1	Very high	96.9	Very high	43 Å²	43	58.1 Å²	58.1	22%	0.221	30%	0.304	C	S	.	.	H	α-helix	trans	-72.9	-52.9	175.7	-67.1	165.3	0	0	0	110.6	L121 F124 G126 K266 L267 L268 L272 T273	L121-I270 HydrophobicContact CD1-CD1 3.98Å; L121-I270 HydrophobicContact CD2-CD1 3.87Å; L121-I270 HydrophobicContact CG-CD1 4.42Å; F124-I270 HydrophobicContact CD1-CB 4.31Å; F124-I270 HydrophobicContact CD1-CG2 3.69Å; F124-I270 HydrophobicContact CE1-CB 4.15Å; F124-I270 HydrophobicContact CE1-CG2 3.77Å; F124-I270 HydrophobicContact CG-CG2 4.13Å; F124-I270 HydrophobicContact CZ-CG2 4.26Å; G126-I270 WeakPolarHBondContact CA-O 3.45Å; K266-I270 WeakPolarHBondContact O-CD1 3.47Å; K266-I270 WeakPolarHBondContact O-CG1 2.94Å; K266-I270 PolarHBondContact O-N 3.17Å; L267-I270 PolarHBondContact O-N 3.07Å; L268-I270 PolarHBondContact O-N 3.23Å; I270-L272 VanDerWaalsContact C-N 3.29Å; I270-L272 PolarHBondContact O-N 3.46Å; I270-T273 WeakPolarHBondContact O-CB 3.38Å; I270-T273 WeakPolarHBondContact O-CG2 3.26Å; I270-T273 PolarHBondContact O-N 3.49Å; I270-T273 VanDerWaalsContact O-N 3.16Å; I270-T273 PolarHBondContact O-OG1 2.77Å
271	A	98.1	Very high	96.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-54	-47.4	-175.2	0	0	0	0	0	111.7	F124 L127 V150 L267 L268 T273 F274	F124-A271 HydrophobicContact CE1-CB 4.11Å; F124-A271 HydrophobicContact CZ-CB 3.65Å; L127-A271 WeakPolarHBondContact CB-O 3.34Å; L127-A271 HydrophobicContact CD1-CB 4.47Å; L127-A271 HydrophobicContact CG-CB 4.16Å; L127-A271 WeakPolarHBondContact CG-O 3.22Å; L127-A271 PolarHBondContact N-O 3.4Å; V150-A271 HydrophobicContact CG2-CB 4.33Å; L267-A271 VanDerWaalsContact O-CB 3.27Å; L267-A271 WeakPolarHBondContact O-CB 3.36Å; L267-A271 PolarHBondContact O-N 2.96Å; L268-A271 PolarHBondContact O-N 2.87Å; A271-T273 PolarHBondContact O-N 3.08Å; A271-F274 PolarHBondContact O-N 3.27Å
272	L	97.6	Very high	96.8	Very high	57 Å²	57	58.4 Å²	58.4	30%	0.298	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	5.4	-173.4	-58.2	178.3	0	0	0	113.6	Q148 L268 I270 F274	Q148-L272 HydrophobicContact CB-CD1 4.46Å; Q148-L272 HydrophobicContact CG-CD1 4.33Å; L268-L272 WeakPolarHBondContact O-CB 3.33Å; L268-L272 WeakPolarHBondContact O-CG 3.25Å; L268-L272 PolarHBondContact O-N 2.93Å; I270-L272 VanDerWaalsContact C-N 3.29Å; I270-L272 PolarHBondContact O-N 3.46Å; L272-F274 HydrophobicContact CB-CE2 4.31Å; L272-F274 HydrophobicContact CD2-CE2 4.01Å; L272-F274 HydrophobicContact CD2-CZ 3.99Å; L272-F274 WeakPolarHBondContact O-CD2 3.49Å
273	T	97.8	Very high	96.7	Very high	61 Å²	61	53.8 Å²	53.8	37%	0.374	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-25.4	165	64.4	0	0	0	0	112.6	D269 I270 A271 R275	D269-T273 WeakPolarHBondContact O-CG2 3.17Å; I270-T273 WeakPolarHBondContact O-CB 3.38Å; I270-T273 WeakPolarHBondContact O-CG2 3.26Å; I270-T273 PolarHBondContact O-N 3.49Å; I270-T273 VanDerWaalsContact O-N 3.16Å; I270-T273 PolarHBondContact O-OG1 2.77Å; A271-T273 PolarHBondContact O-N 3.08Å; T273-R275 WeakPolarHBondContact O-CG 3.45Å; T273-R275 PolarHBondContact O-N 3.42Å; T273-R275 PolarHBondContact OG1-N 3.27Å
274	F	97.9	Very high	96.7	Very high	20 Å²	20	54.5 Å²	54.5	9%	0.088	29%	0.287	C	S	.	.			trans	53.6	33	-174	-63.8	-84.1	0	0	0	114.6	L127 G129 Q132 V135 A271 L272	L127-F274 HydrophobicContact CB-CD1 3.83Å; L127-F274 HydrophobicContact CB-CE1 4Å; L127-F274 HydrophobicContact CD1-CE1 4.08Å; L127-F274 CarbonylContact O-C 3.6Å; L127-F274 WeakPolarHBondContact O-CA 3.24Å; G129-F274 WeakPolarHBondContact CA-O 3.32Å; G129-F274 PolarHBondContact N-O 2.7Å; Q132-F274 HydrophobicContact CB-CB 3.99Å; Q132-F274 HydrophobicContact CB-CD1 3.74Å; Q132-F274 HydrophobicContact CB-CD2 3.85Å; Q132-F274 HydrophobicContact CB-CE1 4.14Å; Q132-F274 HydrophobicContact CB-CE2 4.25Å; Q132-F274 HydrophobicContact CB-CG 3.58Å; Q132-F274 HydrophobicContact CB-CZ 4.38Å; Q132-F274 HydrophobicContact CG-CB 4.43Å; Q132-F274 HydrophobicContact CG-CD1 4.41Å; Q132-F274 HydrophobicContact CG-CD2 3.62Å; Q132-F274 HydrophobicContact CG-CE2 3.89Å; Q132-F274 HydrophobicContact CG-CG 3.91Å; Q132-F274 HydrophobicContact CG-CZ 4.39Å; V135-F274 HydrophobicContact CB-CE1 4.42Å; V135-F274 HydrophobicContact CB-CZ 4.1Å; V135-F274 HydrophobicContact CG1-CZ 4.29Å; V135-F274 HydrophobicContact CG2-CE1 4.1Å; V135-F274 HydrophobicContact CG2-CZ 4.18Å; A271-F274 PolarHBondContact O-N 3.27Å; L272-F274 HydrophobicContact CB-CE2 4.31Å; L272-F274 HydrophobicContact CD2-CE2 4.01Å; L272-F274 HydrophobicContact CD2-CZ 3.99Å; L272-F274 WeakPolarHBondContact O-CD2 3.49Å
275	R	96.1	Very high	96.5	Very high	208 Å²	208	58.1 Å²	58.1	79%	0.785	31%	0.306	S	S	*	.			trans	-108.6	16.9	178.4	-64.2	177.6	-172.1	-172.3	0.8	113.2	L127 T273	L127-R275 PolarHBondContact O-N 2.7Å; T273-R275 WeakPolarHBondContact O-CG 3.45Å; T273-R275 PolarHBondContact O-N 3.42Å; T273-R275 PolarHBondContact OG1-N 3.27Å
276	G	95.4	Very high	96.4	Very high	12 Å²	12	59 Å²	59	12%	0.124	30%	0.301	C	S	.	.			trans	-72.3	149.1	-169.5	0	0	0	0	0	114.4	N125 G126 L127	N125-G276 VanDerWaalsContact OD1-CA 3.27Å; N125-G276 WeakPolarHBondContact OD1-CA 3.23Å; G126-G276 VanDerWaalsContact O-CA 3.24Å; G126-G276 WeakPolarHBondContact O-CA 3.43Å; L127-G276 WeakPolarHBondContact O-CA 3.42Å; L127-G276 PolarHBondContact O-N 2.8Å
277	T	95	Very high	96.3	Very high	76 Å²	76	56.1 Å²	56.1	47%	0.466	29%	0.292	S	S	.	.			trans	-117.3	153.1	164.9	54.2	0	0	0	0	108.6	N125	N125-T277 PolarHBondContact ND2-OG1 2.98Å; N125-T277 PolarHBondContact OD1-N 2.98Å
278	P	93.8	Very high	96.1	Very high	31 Å²	31	60.8 Å²	60.8	20%	0.201	32%	0.316	C	S	.	.			trans	-64.4	143	-179.3	24.9	-29.5	0	0	0	111.2	D94 Q106 D107 Y108	D94-P278 HydrophobicContact CB-CG 3.92Å; Q106-P278 HydrophobicContact CB-CB 3.97Å; Q106-P278 HydrophobicContact CG-CB 4.36Å; D107-P278 CarbonylContact O-C 3.41Å; D107-P278 WeakPolarHBondContact O-CA 3.24Å; Y108-P278 HydrophobicContact CE1-CB 4.11Å; Y108-P278 HydrophobicContact CE1-CG 4.43Å; Y108-P278 HydrophobicContact CE2-CB 3.95Å; Y108-P278 WeakPolarHBondContact OH-CD 3.42Å
279	V	87.1	Confident	95.9	Very high	80 Å²	80	64.4 Å²	64.4	49%	0.485	34%	0.335	S	S	.	.			trans	-104.9	0	-175.3	-61	0	0	0	0	114.9	D107 N123	D107-V279 HydrophobicContact CB-CG2 4.22Å; D107-V279 WeakPolarHBondContact O-CG2 3.42Å; D107-V279 PolarHBondContact O-N 3.46Å; N123-V279 HydrophobicContact CB-CG1 4.01Å; N123-V279 WeakPolarHBondContact O-CG1 3.25Å

Retrieved 279 of 279 residues in 95.2 ms (Link to these results)

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