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Mei-P26

AlphaFold DB , UniProt , Accession A0A075BLR3, Species DROME (Drosophila melanogaster, Fruit fly), Gene mei-P26, Length 319 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	P	34.1	Very low	35.2	Very low	174 Å²	174	129.1 Å²	129.1	100%	1.13	80%	0.8	S	S	*	*				0	112.6	0	19	3.1	0	0	0	110.7	A3	P1-A3 PolarHBondContact O-N 3.2Å
2	P	33.8	Very low	35	Very low	130 Å²	130	131.1 Å²	131.1	84%	0.844	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-75.5	129.2	-179.2	30.7	-29.8	0	0	0	109.6
3	A	31.5	Very low	35	Very low	100 Å²	100	128.9 Å²	128.9	83%	0.826	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-74.1	123.3	170.6	0	0	0	0	0	108.8	P1	P1-A3 PolarHBondContact O-N 3.2Å
4	T	35.1	Very low	35.1	Very low	136 Å²	136	132.3 Å²	132.3	83%	0.834	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-68.6	124.9	177.5	43.3	0	0	0	0	111
5	S	35.8	Very low	35.2	Very low	108 Å²	108	131.6 Å²	131.6	76%	0.755	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-63	141.3	166	-36.1	0	0	0	0	110.4
6	P	30.4	Very low	35	Very low	123 Å²	123	127.4 Å²	127.4	80%	0.799	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-69.7	137.9	175.8	27.2	-31.1	0	0	0	111.1
7	S	32.3	Very low	34.6	Very low	80 Å²	80	124.2 Å²	124.2	56%	0.559	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-72.7	151.8	174.6	54.5	0	0	0	0	111.2	Q9	S7-Q9 PolarHBondContact O-N 2.93Å
8	L	43.6	Very low	34.5	Very low	144 Å²	144	125.2 Å²	125.2	75%	0.754	79%	0.789	S	S	*	*	G	3₁₀ helix	trans	-61.3	12.6	176.7	-100.1	121.9	0	0	0	115.3	Y154	L8-Y154 HydrophobicContact CD1-CD1 4.05Å; L8-Y154 HydrophobicContact CD1-CE1 3.8Å; L8-Y154 HydrophobicContact CD2-CD1 4.07Å; L8-Y154 HydrophobicContact CD2-CE1 3.9Å; L8-Y154 HydrophobicContact CG-CE1 4.11Å
9	Q	39.2	Very low	34.2	Very low	175 Å²	175	128.4 Å²	128.4	82%	0.818	79%	0.793	S	S	*	*	G	3₁₀ helix	trans	-87.3	3	-179.6	-77.6	-177.4	-26.2	0	0	114.3	S7	S7-Q9 PolarHBondContact O-N 2.93Å
10	S	32.7	Very low	33.9	Very low	95 Å²	95	129.8 Å²	129.8	66%	0.664	80%	0.795	S	S	*	*	G	3₁₀ helix	trans	-105.4	15.5	-174.1	63.8	0	0	0	0	116.2
11	L	38.3	Very low	33.8	Very low	155 Å²	155	132.4 Å²	132.4	81%	0.812	80%	0.801	S	S	*	*			trans	-119.5	101.4	171.3	-70	168.8	0	0	0	109.2
12	N	32.9	Very low	33.4	Very low	153 Å²	153	127.2 Å²	127.2	82%	0.818	78%	0.779	S	S	*	*			trans	-65.4	129.8	175.4	-75.7	-25.2	0	0	0	109.9
13	P	35.9	Very low	33.5	Very low	103 Å²	103	129.1 Å²	129.1	67%	0.669	78%	0.781	S	S	*	*			trans	-65.7	138.6	161.3	26.6	-29.6	0	0	0	109.1	V15	P13-V15 PolarHBondContact O-N 3.41Å
14	I	36.5	Very low	33.3	Very low	176 Å²	176	131 Å²	131	90%	0.903	78%	0.777	S	S	*	*			trans	-70.3	99.3	168.3	-63.1	174.6	0	0	0	106.2	G16	I14-G16 PolarHBondContact O-N 3.45Å
15	V	35.9	Very low	33.2	Very low	122 Å²	122	131.2 Å²	131.2	74%	0.739	77%	0.774	S	S	*	*			trans	-74.3	105.4	175.2	-179.1	0	0	0	0	108.1	P13 G17	P13-V15 PolarHBondContact O-N 3.41Å; V15-G17 PolarHBondContact O-N 3.28Å
16	G	31.8	Very low	32.9	Very low	64 Å²	64	136 Å²	136	66%	0.66	78%	0.781	S	S	*	*			trans	-74.4	110.6	158.8	0	0	0	0	0	108.2	I14	I14-G16 PolarHBondContact O-N 3.45Å
17	G	27.7	Very low	32.7	Very low	73 Å²	73	138.3 Å²	138.3	75%	0.753	78%	0.781	S	S	*	*			trans	-62	136	-178.8	0	0	0	0	0	112.3	V15	V15-G17 PolarHBondContact O-N 3.28Å
18	V	33.2	Very low	32.7	Very low	143 Å²	143	139.3 Å²	139.3	87%	0.867	79%	0.794	S	S	*	*			trans	-120.7	112.4	164.9	-168.8	0	0	0	0	106.3
19	E	28.3	Very low	32.1	Very low	185 Å²	185	139.2 Å²	139.2	86%	0.864	80%	0.799	S	S	*	*			trans	-71.8	136.8	169	-77.1	-175.9	156.6	0	0	109.9
20	D	29.1	Very low	31.8	Very low	157 Å²	157	135.2 Å²	135.2	84%	0.84	80%	0.796	S	S	*	*			trans	-65.5	119.6	177.6	-170	12.4	0	0	0	111
21	M	31	Very low	31.7	Very low	184 Å²	184	134.9 Å²	134.9	91%	0.906	80%	0.799	S	S	*	*			trans	-141.1	97.7	160.2	-81.2	-145.9	-123.9	0	0	110.8
22	G	27.1	Very low	31.4	Very low	66 Å²	66	134.3 Å²	134.3	68%	0.68	80%	0.804	S	S	*	*				66.1	104	126.6	0	0	0	0	0	117.6	N24	G22-N24 PolarHBondContact O-N 3.1Å
23	L	35.3	Very low	31.4	Very low	170 Å²	170	129.7 Å²	129.7	89%	0.89	79%	0.793	S	S	*	*			trans	-52.2	118.7	154.7	-79.9	97.5	0	0	0	110
24	N	27.4	Very low	31.3	Very low	138 Å²	138	132 Å²	132	74%	0.738	81%	0.805	S	S	*	*			trans	-169.2	127.8	144.1	-91.1	-31.9	0	0	0	111.8	G22	G22-N24 PolarHBondContact O-N 3.1Å
25	N	32.4	Very low	31.1	Very low	142 Å²	142	129.5 Å²	129.5	76%	0.759	80%	0.799	S	S	*	*			trans	34.8	103.1	155	-74.5	-13.3	0	0	0	119.5
26	F	29.6	Very low	30.9	Very low	207 Å²	207	128.6 Å²	128.6	91%	0.908	80%	0.798	S	S	*	*			trans	-116.1	100.8	152.8	-73.5	-76.6	0	0	0	110.8	A28	F26-A28 PolarHBondContact O-N 2.77Å
27	H	27.7	Very low	31	Very low	173 Å²	173	130.8 Å²	130.8	80%	0.801	80%	0.798	S	S	*	*			trans	-66.4	116.7	155	-92.1	-87.9	0	0	0	108.1	V29	H27-V29 PolarHBondContact O-N 2.77Å
28	A	32.1	Very low	31.5	Very low	100 Å²	100	132.5 Å²	132.5	83%	0.826	79%	0.794	S	S	*	*			trans	-69.3	114.9	167.9	0	0	0	0	0	109.3	F26	F26-A28 PolarHBondContact O-N 2.77Å
29	V	30.6	Very low	31.6	Very low	142 Å²	142	131.9 Å²	131.9	86%	0.861	79%	0.79	S	S	*	*			trans	-85.9	107.4	164.9	178.6	0	0	0	0	107.1	H27	H27-V29 PolarHBondContact O-N 2.77Å
30	A	32.2	Very low	32.1	Very low	92 Å²	92	125.2 Å²	125.2	76%	0.76	77%	0.772	S	S	*	*			trans	-82.9	131.6	174.6	0	0	0	0	0	110.6
31	A	31	Very low	33	Very low	88 Å²	88	128.9 Å²	128.9	73%	0.727	77%	0.774	S	S	*	*			trans	-80.8	146	163.5	0	0	0	0	0	109.9	G33	A31-G33 PolarHBondContact O-N 3.29Å
32	P	32.1	Very low	34.3	Very low	142 Å²	142	125.7 Å²	125.7	92%	0.922	76%	0.76	S	S	*	*			trans	-83.8	102.7	-171	32.5	-31.2	0	0	0	110.7
33	G	31.7	Very low	36.8	Very low	57 Å²	57	132.1 Å²	132.1	59%	0.588	77%	0.77	S	S	*	*			trans	-134.3	116.7	163.8	0	0	0	0	0	107.5	A31 T35	A31-G33 PolarHBondContact O-N 3.29Å; G33-T35 PolarHBondContact O-N 3.41Å
34	T	34.8	Very low	39.3	Very low	150 Å²	150	125.3 Å²	125.3	92%	0.92	74%	0.738	S	S	*	*			trans	-44.9	99.6	-173.8	36.4	0	0	0	0	113.4	S36	T34-S36 PolarHBondContact O-N 3.2Å
35	T	31.3	Very low	42.4	Very low	124 Å²	124	122.3 Å²	122.3	76%	0.761	73%	0.725	S	S	*	*			trans	-80.2	103.7	161.2	39.1	0	0	0	0	108	G33 V37	G33-T35 PolarHBondContact O-N 3.41Å; T35-V37 VanDerWaalsContact C-N 3.32Å; T35-V37 PolarHBondContact O-N 2.58Å
36	S	32	Very low	45.2	Very low	104 Å²	104	119.1 Å²	119.1	73%	0.727	71%	0.712	S	S	*	*			trans	-65.6	97.7	162.8	52.2	0	0	0	0	107.7	T34 V38	T34-S36 PolarHBondContact O-N 3.2Å; S36-V38 PolarHBondContact O-N 2.66Å
37	V	34	Very low	48.3	Very low	109 Å²	109	109.4 Å²	109.4	66%	0.661	67%	0.669	S	S	*	*			trans	-65.2	104	166.6	-174.1	0	0	0	0	106.5	T35 T39	T35-V37 VanDerWaalsContact C-N 3.32Å; T35-V37 PolarHBondContact O-N 2.58Å; V37-T39 HydrophobicContact CB-CG2 4.4Å; V37-T39 HydrophobicContact CG1-CG2 3.52Å; V37-T39 PolarHBondContact O-N 2.95Å
38	V	38.5	Very low	51.4	Low	110 Å²	110	105.4 Å²	105.4	67%	0.667	65%	0.651	S	S	*	*			trans	-73.2	84.3	171.5	-178.3	0	0	0	0	107.6	S36 G40	S36-V38 PolarHBondContact O-N 2.66Å; V38-G40 PolarHBondContact O-N 3.19Å
39	T	36.5	Very low	54.3	Low	129 Å²	129	103 Å²	103	79%	0.791	62%	0.624	S	S	*	*			trans	-83.1	83.7	168.7	54.5	0	0	0	0	109.1	V37	V37-T39 HydrophobicContact CB-CG2 4.4Å; V37-T39 HydrophobicContact CG1-CG2 3.52Å; V37-T39 PolarHBondContact O-N 2.95Å
40	G	38.1	Very low	57.3	Low	46 Å²	46	103.4 Å²	103.4	47%	0.474	61%	0.61	S	S	.	*	S	Bend	trans	-175	124.9	169.5	0	0	0	0	0	109.1	V38 N42	V38-G40 PolarHBondContact O-N 3.19Å; G40-N42 VanDerWaalsContact C-N 3.32Å; G40-N42 PolarHBondContact O-N 3.05Å
41	R	48.1	Very low	60.2	Low	233 Å²	233	100.4 Å²	100.4	88%	0.879	58%	0.583	S	S	*	*			trans	-59.5	103.5	161.2	-96.2	-178.2	173.1	161.8	-1.3	105.9	K43	R41-K43 PolarHBondContact O-N 2.93Å
42	N	58.1	Low	63.3	Low	117 Å²	117	101.4 Å²	101.4	63%	0.626	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-59.3	127.1	165.1	-80.9	-20.3	0	0	0	106.3	G40 A44	G40-N42 VanDerWaalsContact C-N 3.32Å; G40-N42 PolarHBondContact O-N 3.05Å; N42-A44 PolarHBondContact O-N 3.27Å; N42-A44 VanDerWaalsContact O-N 3.11Å
43	K	78.9	Confident	66.4	Low	202 Å²	202	95.9 Å²	95.9	88%	0.878	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-64.1	117.8	-179.8	-174.5	178.6	178.4	-177.7	0	107.3	R41 T45	R41-K43 PolarHBondContact O-N 2.93Å; K43-T45 PolarHBondContact O-N 3.24Å
44	A	87.5	Confident	69.6	Low	27 Å²	27	94.3 Å²	94.3	22%	0.223	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-52.7	136.7	179.9	0	0	0	0	0	111.1	N42 E278 E280	N42-A44 PolarHBondContact O-N 3.27Å; N42-A44 VanDerWaalsContact O-N 3.11Å; A44-E278 CarbonylContact C-O 3.57Å; A44-E278 WeakPolarHBondContact CA-O 3.45Å; A44-E278 HydrophobicContact CB-CB 4.02Å; A44-E280 HydrophobicContact CB-CB 3.93Å
45	T	92.8	Very high	72.6	Confident	75 Å²	75	89.8 Å²	89.8	46%	0.46	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	130.2	-179.3	-62.3	0	0	0	0	109.6	K43 M47 E278 F279 E280	K43-T45 PolarHBondContact O-N 3.24Å; T45-M47 PolarHBondContact O-N 3Å; T45-E278 PolarHBondContact N-O 2.92Å; T45-F279 HydrophobicContact CG2-CD1 4.01Å; T45-F279 HydrophobicContact CG2-CE1 4.12Å; T45-F279 CarbonylContact O-C 3.58Å; T45-F279 VanDerWaalsContact O-CA 3.22Å; T45-F279 WeakPolarHBondContact O-CA 3.36Å; T45-E280 PolarHBondContact O-N 3.43Å
46	P	92.5	Very high	75.8	Confident	75 Å²	75	89 Å²	89	49%	0.487	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	125.2	-176.4	27.7	-33.9	0	0	0	112.1	E280 P282	P46-E280 CarbonylContact C-O 3.53Å; P46-E280 WeakPolarHBondContact CA-O 3.29Å; P46-P282 HydrophobicContact CB-CG 4.18Å
47	M	93.1	Very high	78.9	Confident	2 Å²	2	84.8 Å²	84.8	1%	0.01	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-82.1	146.9	167.9	-64	-176.5	-77.9	0	0	111.1	T45 F264 V266 F279 E280 C281 P282 L313 N314 L316	T45-M47 PolarHBondContact O-N 3Å; M47-F264 HydrophobicContact CE-CD1 3.73Å; M47-F264 HydrophobicContact CE-CE1 4.12Å; M47-V266 HydrophobicContact CE-CG2 3.92Å; M47-V266 HydrophobicContact SD-CG2 4.33Å; M47-F279 HydrophobicContact CE-CB 4.12Å; M47-F279 HydrophobicContact CG-CB 3.83Å; M47-F279 HydrophobicContact SD-CB 3.97Å; M47-E280 PolarHBondContact N-O 3.39Å; M47-C281 HydrophobicContact CE-CB 4.34Å; M47-P282 WeakPolarHBondContact O-CD 3.5Å; M47-L313 HydrophobicContact CB-CB 4.35Å; M47-L313 HydrophobicContact CB-CD2 4.04Å; M47-L313 HydrophobicContact CE-CD1 4.17Å; M47-L313 HydrophobicContact SD-CB 4.28Å; M47-L313 HydrophobicContact SD-CD1 4.06Å; M47-N314 WeakPolarHBondContact CA-OD1 3.48Å; M47-L316 HydrophobicContact CG-CD2 3.93Å; M47-L316 HydrophobicContact SD-CD2 3.75Å
48	Q	92.6	Very high	82	Confident	89 Å²	89	84.4 Å²	84.4	42%	0.416	45%	0.452	S	S	.	.			trans	-107.8	137.5	175.9	-57.8	-57.2	-36.7	0	0	110.3	R50 H283 L313 N314	Q48-R50 PolarHBondContact O-N 3.18Å; Q48-H283 PolarHBondContact OE1-NE2 3.37Å; Q48-L313 CarbonylContact O-C 3.57Å; Q48-L313 VanDerWaalsContact O-CA 3.3Å; Q48-L313 WeakPolarHBondContact O-CA 3.33Å; Q48-N314 HydrophobicContact CB-CB 4.44Å; Q48-N314 PolarHBondContact N-OD1 2.87Å; Q48-N314 PolarHBondContact O-N 2.84Å; Q48-N314 PolarHBondContact O-OD1 3.21Å
49	I	93.4	Very high	84.8	Confident	51 Å²	51	81.6 Å²	81.6	26%	0.262	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	121.4	175.9	-63.2	172	0	0	0	108.5	K52 H283 V284 L311 L313	I49-K52 HydrophobicContact CG2-CB 4.02Å; I49-H283 HydrophobicContact CD1-CB 4.08Å; I49-V284 HydrophobicContact CD1-CB 4.22Å; I49-V284 HydrophobicContact CD1-CG2 3.35Å; I49-L311 HydrophobicContact CD1-CD2 4.28Å; I49-L313 HydrophobicContact CB-CD2 4.5Å; I49-L313 HydrophobicContact CG1-CD2 3.69Å
50	R	93.9	Very high	87.8	Confident	149 Å²	149	83.2 Å²	83.2	56%	0.562	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	-49.7	171.5	-65	-166.8	67.7	79.3	-1.1	111	Q48 V312 N314	Q48-R50 PolarHBondContact O-N 3.18Å; R50-V312 HydrophobicContact CB-CG1 4.48Å; R50-V312 PolarHBondContact N-O 2.99Å; R50-N314 HydrophobicContact CG-CB 4.29Å
51	C	93.9	Very high	90.6	Very high	29 Å²	29	81.9 Å²	81.9	20%	0.196	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	153.3	170.8	74.7	0	0	0	0	111	V312	C51-V312 PolarHBondContact N-O 3.25Å; C51-V312 PolarHBondContact O-N 3.47Å; C51-V312 WeakPolarHBondContact SG-CB 3.36Å; C51-V312 WeakPolarHBondContact SG-CG2 3.38Å
52	K	95.8	Very high	93	Very high	109 Å²	109	73.5 Å²	73.5	47%	0.474	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	125.1	176.5	169.9	-177.9	173.1	-174.6	0	107.1	I49 H309 V310 L311	I49-K52 HydrophobicContact CG2-CB 4.02Å; K52-H309 HydrophobicContact CG-CB 4.27Å; K52-V310 WeakPolarHBondContact CA-O 3.35Å; K52-L311 HydrophobicContact CB-CD2 4.01Å; K52-L311 HydrophobicContact CD-CD2 3.94Å; K52-L311 HydrophobicContact CG-CD2 3.81Å
53	F	97.8	Very high	94.9	Very high	26 Å²	26	67.9 Å²	67.9	11%	0.114	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	162	-177.1	64.2	-88.4	0	0	0	111	F63 I77 F90 G94 H309 V310 V312	F53-F63 HydrophobicContact CE2-CZ 4.42Å; F53-I77 HydrophobicContact CE1-CD1 3.89Å; F53-I77 HydrophobicContact CZ-CB 4.34Å; F53-I77 HydrophobicContact CZ-CD1 3.78Å; F53-I77 HydrophobicContact CZ-CG2 4.26Å; F53-F90 AromaticContact CD2-CD1 3.85Å; F53-F90 HydrophobicContact CD2-CD1 3.85Å; F53-F90 AromaticContact CD2-CE1 3.96Å; F53-F90 HydrophobicContact CD2-CE1 3.96Å; F53-F90 HydrophobicContact CD2-CG 4.25Å; F53-F90 HydrophobicContact CD2-CZ 4.44Å; F53-F90 HydrophobicContact CE2-CB 4.02Å; F53-F90 AromaticContact CE2-CD1 3.58Å; F53-F90 HydrophobicContact CE2-CD1 3.58Å; F53-F90 AromaticContact CE2-CD2 3.76Å; F53-F90 HydrophobicContact CE2-CD2 3.76Å; F53-F90 AromaticContact CE2-CE1 3.94Å; F53-F90 HydrophobicContact CE2-CE1 3.94Å; F53-F90 HydrophobicContact CE2-CE2 4.11Å; F53-F90 AromaticContact CE2-CG 3.5Å; F53-F90 HydrophobicContact CE2-CG 3.5Å; F53-F90 HydrophobicContact CE2-CZ 4.21Å; F53-F90 HydrophobicContact CZ-CB 4.15Å; F53-F90 HydrophobicContact CZ-CD1 4.48Å; F53-F90 HydrophobicContact CZ-CD2 4.45Å; F53-F90 HydrophobicContact CZ-CG 4.12Å; F53-G94 VanDerWaalsContact CD1-CA 3.42Å; F53-G94 VanDerWaalsContact CE1-CA 3.43Å; F53-H309 CarbonylContact O-C 3.52Å; F53-H309 WeakPolarHBondContact O-CA 3.49Å; F53-H309 WeakPolarHBondContact O-CB 3.45Å; F53-V310 HydrophobicContact CD1-CB 4.2Å; F53-V310 HydrophobicContact CD1-CG1 4.5Å; F53-V310 HydrophobicContact CD2-CB 4.33Å; F53-V310 HydrophobicContact CE1-CB 3.68Å; F53-V310 HydrophobicContact CE1-CG1 3.63Å; F53-V310 HydrophobicContact CE1-CG2 4.48Å; F53-V310 HydrophobicContact CE2-CB 3.82Å; F53-V310 HydrophobicContact CE2-CG1 4.41Å; F53-V310 HydrophobicContact CE2-CG2 3.8Å; F53-V310 HydrophobicContact CZ-CB 3.48Å; F53-V310 VanDerWaalsContact CZ-CB 3.48Å; F53-V310 HydrophobicContact CZ-CG1 3.59Å; F53-V310 HydrophobicContact CZ-CG2 3.78Å; F53-V310 PolarHBondContact N-O 2.9Å; F53-V310 PolarHBondContact O-N 3.43Å; F53-V312 HydrophobicContact CE1-CG2 4.34Å
54	G	97.8	Very high	95.8	Very high	25 Å²	25	60.5 Å²	60.5	26%	0.258	33%	0.334	S	S	.	.			trans	97.8	148.3	-168.4	0	0	0	0	0	112.7	G61 H308	G54-G61 WeakPolarHBondContact CA-O 3.46Å; G54-H308 CarbonylContact C-O 3.03Å; G54-H308 WeakPolarHBondContact CA-O 3.42Å
55	S	97.8	Very high	96.3	Very high	55 Å²	55	60.3 Å²	60.3	39%	0.385	33%	0.331	S	S	.	.			trans	-151.3	165.9	167.7	53.4	0	0	0	0	109.4	G57 Q62 F63 H308	S55-G57 PolarHBondContact O-N 3.01Å; S55-Q62 CarbonylContact O-C 3.44Å; S55-Q62 WeakPolarHBondContact O-CA 3.39Å; S55-Q62 WeakPolarHBondContact O-CB 3.49Å; S55-F63 PolarHBondContact O-N 2.79Å; S55-H308 WeakPolarHBondContact CA-O 3.49Å; S55-H308 PolarHBondContact N-O 2.85Å; S55-H308 VanDerWaalsContact N-O 3.09Å
56	L	98.4	Very high	96.5	Very high	107 Å²	107	56.8 Å²	56.8	56%	0.56	31%	0.309	S	S	*	.	B	Isolated β-bridge	trans	-63.4	128.9	176.2	172	64	0	0	0	110.6	F63 H308	L56-F63 WeakPolarHBondContact CA-O 3.42Å; L56-H308 HydrophobicContact CB-CB 4.23Å; L56-H308 WeakPolarHBondContact CD1-CE1 3.44Å
57	G	98.3	Very high	96.7	Very high	16 Å²	16	55 Å²	55	17%	0.165	29%	0.294	C	S	.	.	S	Bend	trans	157.6	-167.3	170.5	0	0	0	0	0	113.9	S55 F63 N84	S55-G57 PolarHBondContact O-N 3.01Å; G57-F63 PolarHBondContact N-O 3.47Å; G57-F63 VanDerWaalsContact N-O 3.15Å; G57-F63 CarbonylContact O-C 3.48Å; G57-N84 PolarHBondContact O-ND2 3.11Å
58	T	98.1	Very high	96.8	Very high	100 Å²	100	55 Å²	55	61%	0.613	30%	0.295	S	S	*	.	S	Bend	trans	-117.2	-9.4	-176.5	60.9	0	0	0	0	112.9	R86	T58-R86 PolarHBondContact O-NH1 2.9Å; T58-R86 PolarHBondContact O-NH2 2.89Å
59	A	98.4	Very high	97.1	Very high	52 Å²	52	51.4 Å²	51.4	43%	0.43	28%	0.278	S	S	.	.	S	Bend	trans	-70.8	168.3	177.5	0	0	0	0	0	111.1	G61 Q62 R86	A59-G61 PolarHBondContact O-N 3.3Å; A59-Q62 HydrophobicContact CB-CG 4.17Å; A59-Q62 VanDerWaalsContact N-OE1 3.08Å; A59-Q62 WeakPolarHBondContact O-CB 3.22Å; A59-Q62 PolarHBondContact O-N 3.4Å; A59-R86 PolarHBondContact O-NH2 2.86Å
60	K	97.9	Very high	97.4	Very high	163 Å²	163	49.5 Å²	49.5	71%	0.709	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	131.4	175.7	-73.3	-176.6	-179.6	-177.9	0	110.8	Q62 L96	K60-Q62 PolarHBondContact O-N 3.21Å; K60-L96 HydrophobicContact CB-CD2 3.59Å; K60-L96 HydrophobicContact CD-CD2 4.29Å; K60-L96 HydrophobicContact CG-CD2 4.09Å
61	G	97.6	Very high	97.6	Very high	18 Å²	18	43.5 Å²	43.5	19%	0.186	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	9.1	-177.8	0	0	0	0	0	114.5	G54 A59 E88	G54-G61 WeakPolarHBondContact CA-O 3.46Å; A59-G61 PolarHBondContact O-N 3.3Å; G61-E88 VanDerWaalsContact CA-OE2 3.31Å; G61-E88 WeakPolarHBondContact CA-OE2 3.31Å; G61-E88 PolarHBondContact N-OE2 2.82Å
62	Q	98.6	Very high	97.7	Very high	56 Å²	56	42.4 Å²	42.4	26%	0.262	24%	0.242	S	C	.	.			trans	-108.8	147.1	170.6	-61.4	-173	-40.8	0	0	110	S55 A59 K60 R86	S55-Q62 CarbonylContact O-C 3.44Å; S55-Q62 WeakPolarHBondContact O-CA 3.39Å; S55-Q62 WeakPolarHBondContact O-CB 3.49Å; A59-Q62 HydrophobicContact CB-CG 4.17Å; A59-Q62 VanDerWaalsContact N-OE1 3.08Å; A59-Q62 WeakPolarHBondContact O-CB 3.22Å; A59-Q62 PolarHBondContact O-N 3.4Å; K60-Q62 PolarHBondContact O-N 3.21Å; Q62-R86 PolarHBondContact O-NH2 2.91Å
63	F	98.6	Very high	97.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-118.1	149.2	-177.2	-53.4	-51.8	0	0	0	112.2	F53 S55 L56 G57 P66 V79 D81 E88 F90 H308 V310	F53-F63 HydrophobicContact CE2-CZ 4.42Å; S55-F63 PolarHBondContact O-N 2.79Å; L56-F63 WeakPolarHBondContact CA-O 3.42Å; G57-F63 PolarHBondContact N-O 3.47Å; G57-F63 VanDerWaalsContact N-O 3.15Å; G57-F63 CarbonylContact O-C 3.48Å; F63-P66 HydrophobicContact CB-CB 4.11Å; F63-P66 HydrophobicContact CB-CG 3.77Å; F63-P66 HydrophobicContact CD2-CG 4.41Å; F63-P66 HydrophobicContact CG-CB 4.33Å; F63-P66 HydrophobicContact CG-CG 4.19Å; F63-V79 HydrophobicContact CD1-CG1 4.16Å; F63-V79 HydrophobicContact CE1-CB 4.13Å; F63-V79 HydrophobicContact CE1-CG1 3.9Å; F63-V79 HydrophobicContact CE1-CG2 4.41Å; F63-V79 HydrophobicContact CZ-CB 4.41Å; F63-V79 HydrophobicContact CZ-CG1 4.27Å; F63-V79 HydrophobicContact CZ-CG2 4.19Å; F63-D81 WeakPolarHBondContact CA-OD1 3.26Å; F63-D81 HydrophobicContact CD1-CB 4.38Å; F63-E88 HydrophobicContact CE1-CB 4.38Å; F63-F90 AromaticContact CE1-CE2 3.63Å; F63-F90 HydrophobicContact CE1-CE2 3.63Å; F63-F90 AromaticContact CE1-CZ 3.57Å; F63-F90 HydrophobicContact CE1-CZ 3.57Å; F63-F90 HydrophobicContact CZ-CE1 4.42Å; F63-F90 AromaticContact CZ-CE2 3.5Å; F63-F90 HydrophobicContact CZ-CE2 3.5Å; F63-F90 AromaticContact CZ-CZ 3.43Å; F63-F90 HydrophobicContact CZ-CZ 3.43Å; F63-F90 VanDerWaalsContact CZ-CZ 3.43Å; F63-H308 HydrophobicContact CB-CB 4.38Å; F63-H308 WeakPolarHBondContact CD2-O 3.16Å; F63-H308 PolarHBondContact O-ND1 3.14Å; F63-V310 HydrophobicContact CE2-CG2 4.17Å; F63-V310 HydrophobicContact CZ-CG2 4.42Å
64	N	97.9	Very high	97.5	Very high	47 Å²	47	45.2 Å²	45.2	25%	0.251	27%	0.266	S	S	.	.	S	Bend	trans	-127.9	101.6	170.2	-170.8	-7.9	0	0	0	110	D81 N83 N84	N64-D81 PolarHBondContact N-OD1 2.87Å; N64-N83 HydrophobicContact CB-CB 3.89Å; N64-N83 VanDerWaalsContact O-CB 3.29Å; N64-N83 WeakPolarHBondContact O-CB 3.28Å; N64-N83 PolarHBondContact O-N 3.39Å; N64-N83 WeakPolarHBondContact OD1-CB 3.41Å; N64-N83 PolarHBondContact OD1-ND2 3.23Å; N64-N83 VanDerWaalsContact OD1-ND2 3.12Å; N64-N84 WeakPolarHBondContact CB-OD1 3.42Å
65	S	96.6	Very high	97.4	Very high	23 Å²	23	45.5 Å²	45.5	16%	0.161	26%	0.26	C	S	.	.	S	Bend	trans	51.7	62	-175.8	-169.8	0	0	0	0	112.5	H67 T82 N83 H308	S65-H67 PolarHBondContact O-CD2 2.89Å; S65-H67 PolarHBondContact O-N 3.08Å; S65-H67 PolarHBondContact OG-CD2 2.79Å; S65-H67 PolarHBondContact OG-NE2 2.96Å; S65-H67 VanDerWaalsContact OG-NE2 3.11Å; S65-T82 WeakPolarHBondContact O-CB 3.36Å; S65-T82 PolarHBondContact O-OG1 2.96Å; S65-N83 VanDerWaalsContact CB-ND2 3.29Å; S65-N83 WeakPolarHBondContact CB-ND2 3.44Å; S65-H308 PolarHBondContact N-CE1 3.45Å
66	P	97.5	Very high	97.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	128.3	178.6	34.8	-37.4	0	0	0	109.6	F63 V79 A80 L303 K305	F63-P66 HydrophobicContact CB-CB 4.11Å; F63-P66 HydrophobicContact CB-CG 3.77Å; F63-P66 HydrophobicContact CD2-CG 4.41Å; F63-P66 HydrophobicContact CG-CB 4.33Å; F63-P66 HydrophobicContact CG-CG 4.19Å; P66-V79 HydrophobicContact CB-CG1 3.75Å; P66-A80 VanDerWaalsContact CA-O 3.29Å; P66-A80 WeakPolarHBondContact CA-O 3.35Å; P66-L303 HydrophobicContact CB-CD1 3.99Å; P66-L303 HydrophobicContact CB-CD2 3.73Å; P66-L303 HydrophobicContact CB-CG 4.26Å; P66-L303 HydrophobicContact CG-CD1 3.67Å; P66-L303 HydrophobicContact CG-CD2 4.11Å; P66-L303 HydrophobicContact CG-CG 4.1Å; P66-K305 WeakPolarHBondContact O-CB 3.25Å; P66-K305 VanDerWaalsContact O-CG 3.29Å; P66-K305 WeakPolarHBondContact O-CG 3.09Å
67	H	96.3	Very high	97.4	Very high	37 Å²	37	39.3 Å²	39.3	17%	0.171	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-16.2	-169.9	-88.1	-144.1	0	0	0	115	S65 A80 T82 R114 C290 K305	S65-H67 PolarHBondContact O-CD2 2.89Å; S65-H67 PolarHBondContact O-N 3.08Å; S65-H67 PolarHBondContact OG-CD2 2.79Å; S65-H67 PolarHBondContact OG-NE2 2.96Å; S65-H67 VanDerWaalsContact OG-NE2 3.11Å; H67-A80 PolarHBondContact N-O 3.47Å; H67-T82 VanDerWaalsContact CB-OG1 3.31Å; H67-T82 WeakPolarHBondContact CB-OG1 3.23Å; H67-T82 PolarHBondContact CD2-OG1 2.55Å; H67-T82 PolarHBondContact N-OG1 3.15Å; H67-R114 CarbonylContact C-O 3.17Å; H67-R114 HydrophobicContact CB-CB 4.41Å; H67-R114 HydrophobicContact CB-CG 4.5Å; H67-C290 VanDerWaalsContact C-SG 3.59Å; H67-C290 WeakPolarHBondContact O-CB 3.39Å; H67-C290 PolarHBondContact O-SG 3.14Å; H67-K305 VanDerWaalsContact CD2-CE 3.48Å; H67-K305 WeakPolarHBondContact CD2-CE 3.04Å; H67-K305 PolarHBondContact CD2-NZ 3.05Å; H67-K305 PolarHBondContact CE1-NZ 3.48Å; H67-K305 WeakPolarHBondContact NE2-CE 3.29Å; H67-K305 PolarHBondContact NE2-NZ 2.82Å
68	G	96.5	Very high	97.5	Very high	2 Å²	2	38.6 Å²	38.6	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	150.7	-176.1	0	0	0	0	0	110.6	A80 R114	G68-A80 WeakPolarHBondContact O-CB 3.45Å; G68-A80 PolarHBondContact O-N 3.34Å; G68-R114 WeakPolarHBondContact CA-O 3.41Å; G68-R114 PolarHBondContact N-O 3.41Å
69	F	98.5	Very high	97.5	Very high	14 Å²	14	33.9 Å²	33.9	6%	0.061	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	163.2	171.7	81.4	-79.1	0	0	0	109.5	I77 I78 V79 C290 K293 V301 L303	F69-I77 HydrophobicContact CD2-CG2 4.24Å; F69-I78 CarbonylContact C-O 3.57Å; F69-I78 WeakPolarHBondContact CA-O 3.47Å; F69-I78 VanDerWaalsContact CB-O 3.24Å; F69-I78 WeakPolarHBondContact CB-O 3.47Å; F69-V79 HydrophobicContact CB-CG2 4.16Å; F69-C290 VanDerWaalsContact CD1-O 3.32Å; F69-C290 WeakPolarHBondContact CD1-O 3.47Å; F69-C290 WeakPolarHBondContact CE1-O 3.35Å; F69-K293 HydrophobicContact CE2-CB 3.94Å; F69-K293 HydrophobicContact CE2-CG 3.88Å; F69-K293 HydrophobicContact CZ-CB 4.22Å; F69-K293 HydrophobicContact CZ-CG 4.09Å; F69-V301 HydrophobicContact CD2-CG1 4.31Å; F69-V301 HydrophobicContact CE2-CB 3.99Å; F69-V301 HydrophobicContact CE2-CG1 3.66Å; F69-V301 HydrophobicContact CZ-CB 4.36Å; F69-V301 HydrophobicContact CZ-CG1 4.19Å; F69-V301 VanDerWaalsContact CZ-O 3.29Å; F69-V301 WeakPolarHBondContact CZ-O 3.36Å; F69-L303 HydrophobicContact CB-CD2 4.28Å; F69-L303 HydrophobicContact CD1-CB 3.51Å; F69-L303 HydrophobicContact CD1-CD2 4.33Å; F69-L303 HydrophobicContact CE1-CB 4.01Å; F69-L303 HydrophobicContact CG-CB 4.25Å
70	C	98.5	Very high	97.5	Very high	12 Å²	12	31.4 Å²	31.4	8%	0.081	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	173.9	166.7	61.1	0	0	0	0	110	I78 V116 A117	C70-I78 PolarHBondContact N-O 2.83Å; C70-I78 PolarHBondContact O-N 3.25Å; C70-V116 WeakPolarHBondContact CB-O 3.41Å; C70-V116 PolarHBondContact SG-O 3.29Å; C70-A117 VanDerWaalsContact SG-CA 3.54Å
71	L	98	Very high	97.5	Very high	22 Å²	22	23.6 Å²	23.6	12%	0.115	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	143	167.9	-62.8	-178.4	0	0	0	110.6	E76 I77 K293 T295 V301	L71-E76 CarbonylContact C-O 3.57Å; L71-E76 VanDerWaalsContact CA-O 3.25Å; L71-E76 WeakPolarHBondContact CA-O 3.35Å; L71-I77 HydrophobicContact CD2-CG1 3.9Å; L71-K293 HydrophobicContact CD1-CB 3.73Å; L71-K293 HydrophobicContact CG-CB 3.72Å; L71-K293 HydrophobicContact CG-CG 4.29Å; L71-T295 HydrophobicContact CD1-CG2 4.06Å; L71-V301 HydrophobicContact CD2-CG2 4.31Å
72	G	97.3	Very high	97.6	Very high	6 Å²	6	22.9 Å²	22.9	6%	0.062	12%	0.124	C	C	.	.			trans	-80.4	-176.8	172.8	0	0	0	0	0	112.7	D74 E75 E76	G72-D74 VanDerWaalsContact C-N 3.32Å; G72-E75 PolarHBondContact O-N 2.77Å; G72-E76 PolarHBondContact N-O 2.89Å
73	V	93.8	Very high	97.5	Very high	72 Å²	72	23.3 Å²	23.3	44%	0.436	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-38.5	177.6	-177.8	0	0	0	0	111	E75 V118	V73-E75 VanDerWaalsContact C-N 3.28Å; V73-V118 HydrophobicContact CG2-CG1 4.05Å
74	D	94.8	Very high	97.5	Very high	123 Å²	123	24.8 Å²	24.8	66%	0.658	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.2	25.8	177.2	-58.1	-40.4	0	0	0	111.3	G72 E76	G72-D74 VanDerWaalsContact C-N 3.32Å; D74-E76 PolarHBondContact N-OE2 2.86Å; D74-E76 PolarHBondContact O-N 2.96Å
75	E	96.1	Very high	97.5	Very high	30 Å²	30	23.5 Å²	23.5	14%	0.14	13%	0.128	C	C	.	.			trans	58.6	28	-177.7	-52.7	-179.3	161.4	0	0	114.1	G72 V73 S296	G72-E75 PolarHBondContact O-N 2.77Å; V73-E75 VanDerWaalsContact C-N 3.28Å; E75-S296 WeakPolarHBondContact OE1-CA 3.46Å; E75-S296 WeakPolarHBondContact OE1-CB 3.43Å; E75-S296 PolarHBondContact OE1-N 3.36Å; E75-S296 PolarHBondContact OE1-OG 3.09Å
76	E	98.3	Very high	97.6	Very high	31 Å²	31	23.3 Å²	23.3	15%	0.145	12%	0.124	C	C	.	.			trans	-60.1	146.7	166.1	-61.5	122.7	132.3	0	0	109.8	L71 G72 D74 I78 V89 F90 K97	L71-E76 CarbonylContact C-O 3.57Å; L71-E76 VanDerWaalsContact CA-O 3.25Å; L71-E76 WeakPolarHBondContact CA-O 3.35Å; G72-E76 PolarHBondContact N-O 2.89Å; D74-E76 PolarHBondContact N-OE2 2.86Å; D74-E76 PolarHBondContact O-N 2.96Å; E76-I78 HydrophobicContact CB-CD1 4.13Å; E76-I78 VanDerWaalsContact O-CD1 3.29Å; E76-I78 WeakPolarHBondContact O-CD1 3.33Å; E76-V89 HydrophobicContact CB-CG1 4.05Å; E76-V89 HydrophobicContact CG-CG1 4.47Å; E76-F90 CarbonylContact C-O 3.32Å; E76-F90 WeakPolarHBondContact CA-O 3.09Å; E76-F90 VanDerWaalsContact CB-O 3.22Å; E76-F90 WeakPolarHBondContact CB-O 3.33Å; E76-K97 HydrophobicContact CG-CD 4.01Å; E76-K97 IonicContact OE1-NZ 2.7Å; E76-K97 PolarHBondContact OE1-NZ 3.23Å
77	I	98.6	Very high	97.7	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.01	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	113.7	176.3	-58.2	168.9	0	0	0	107.2	F53 F69 L71 V79 F90 V301 V310 V312	F53-I77 HydrophobicContact CE1-CD1 3.89Å; F53-I77 HydrophobicContact CZ-CB 4.34Å; F53-I77 HydrophobicContact CZ-CD1 3.78Å; F53-I77 HydrophobicContact CZ-CG2 4.26Å; F69-I77 HydrophobicContact CD2-CG2 4.24Å; L71-I77 HydrophobicContact CD2-CG1 3.9Å; I77-V79 HydrophobicContact CG2-CG2 4.09Å; I77-F90 HydrophobicContact CB-CB 4.38Å; I77-F90 PolarHBondContact N-O 2.85Å; I77-F90 WeakPolarHBondContact O-CD2 3.47Å; I77-F90 PolarHBondContact O-N 3.18Å; I77-V301 HydrophobicContact CD1-CG1 3.99Å; I77-V301 HydrophobicContact CG1-CG1 4.33Å; I77-V301 HydrophobicContact CG2-CG1 4.42Å; I77-V310 HydrophobicContact CD1-CG1 4.25Å; I77-V310 HydrophobicContact CG2-CG1 4.24Å; I77-V310 HydrophobicContact CG2-CG2 4.39Å; I77-V312 HydrophobicContact CD1-CG2 3.81Å
78	I	98.8	Very high	97.8	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	118.5	-177.3	-58.2	98.4	0	0	0	109	F69 C70 E76 I87 E88 V89 V116 V118 F125	F69-I78 CarbonylContact C-O 3.57Å; F69-I78 WeakPolarHBondContact CA-O 3.47Å; F69-I78 VanDerWaalsContact CB-O 3.24Å; F69-I78 WeakPolarHBondContact CB-O 3.47Å; C70-I78 PolarHBondContact N-O 2.83Å; C70-I78 PolarHBondContact O-N 3.25Å; E76-I78 HydrophobicContact CB-CD1 4.13Å; E76-I78 VanDerWaalsContact O-CD1 3.29Å; E76-I78 WeakPolarHBondContact O-CD1 3.33Å; I78-I87 HydrophobicContact CG2-CG2 3.35Å; I78-E88 CarbonylContact C-O 3.58Å; I78-E88 WeakPolarHBondContact CA-O 3.44Å; I78-V89 HydrophobicContact CG1-CG1 4.16Å; I78-V89 HydrophobicContact CG1-CG2 4.05Å; I78-V89 HydrophobicContact CG2-CG2 4.22Å; I78-V116 HydrophobicContact CG2-CB 4.46Å; I78-V116 HydrophobicContact CG2-CG1 3.97Å; I78-V116 HydrophobicContact CG2-CG2 3.69Å; I78-V116 WeakPolarHBondContact O-CG1 3.49Å; I78-V118 HydrophobicContact CD1-CG2 3.78Å; I78-V118 HydrophobicContact CG1-CG2 4.43Å; I78-F125 HydrophobicContact CD1-CE1 4.43Å; I78-F125 HydrophobicContact CG1-CE1 3.9Å; I78-F125 HydrophobicContact CG2-CD1 4.26Å; I78-F125 HydrophobicContact CG2-CE1 4.31Å
79	V	98.8	Very high	97.9	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.1	-172.9	179.8	0	0	0	0	110.4	F63 P66 F69 I77 D81 I87 E88 F90 L303 V310	F63-V79 HydrophobicContact CD1-CG1 4.16Å; F63-V79 HydrophobicContact CE1-CB 4.13Å; F63-V79 HydrophobicContact CE1-CG1 3.9Å; F63-V79 HydrophobicContact CE1-CG2 4.41Å; F63-V79 HydrophobicContact CZ-CB 4.41Å; F63-V79 HydrophobicContact CZ-CG1 4.27Å; F63-V79 HydrophobicContact CZ-CG2 4.19Å; P66-V79 HydrophobicContact CB-CG1 3.75Å; F69-V79 HydrophobicContact CB-CG2 4.16Å; I77-V79 HydrophobicContact CG2-CG2 4.09Å; V79-D81 PolarHBondContact O-N 2.96Å; V79-I87 WeakPolarHBondContact O-CA 3.38Å; V79-E88 PolarHBondContact N-O 2.89Å; V79-E88 PolarHBondContact O-N 3.42Å; V79-F90 HydrophobicContact CG2-CD2 4.37Å; V79-F90 HydrophobicContact CG2-CE2 4.23Å; V79-L303 HydrophobicContact CG1-CD1 4.38Å; V79-L303 HydrophobicContact CG1-CD2 4.12Å; V79-V310 HydrophobicContact CG2-CG2 3.99Å
80	A	98.6	Very high	98	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	102.2	167	0	0	0	0	0	110	P66 H67 G68 T82 I87 P113 V116	P66-A80 VanDerWaalsContact CA-O 3.29Å; P66-A80 WeakPolarHBondContact CA-O 3.35Å; H67-A80 PolarHBondContact N-O 3.47Å; G68-A80 WeakPolarHBondContact O-CB 3.45Å; G68-A80 PolarHBondContact O-N 3.34Å; A80-T82 PolarHBondContact O-N 2.95Å; A80-I87 HydrophobicContact CB-CD1 3.89Å; A80-P113 HydrophobicContact CB-CB 4.28Å; A80-V116 HydrophobicContact CB-CG1 4.23Å
81	D	98.6	Very high	97.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	80.1	-178	-173.2	11.7	0	0	0	110.5	F63 N64 V79 N83 N84 H85 R86	F63-D81 WeakPolarHBondContact CA-OD1 3.26Å; F63-D81 HydrophobicContact CD1-CB 4.38Å; N64-D81 PolarHBondContact N-OD1 2.87Å; V79-D81 PolarHBondContact O-N 2.96Å; D81-N83 PolarHBondContact O-N 3.2Å; D81-N84 HydrophobicContact CB-CB 4.47Å; D81-N84 CarbonylContact O-C 3.55Å; D81-N84 PolarHBondContact O-N 3.18Å; D81-N84 VanDerWaalsContact O-N 3.14Å; D81-N84 PolarHBondContact OD1-ND2 3.49Å; D81-N84 VanDerWaalsContact OD2-CB 3.24Å; D81-N84 WeakPolarHBondContact OD2-CB 3.42Å; D81-N84 PolarHBondContact OD2-ND2 2.87Å; D81-H85 PolarHBondContact O-N 2.87Å; D81-H85 VanDerWaalsContact O-N 3.09Å; D81-R86 HydrophobicContact CB-CG 3.89Å; D81-R86 PolarHBondContact N-O 2.86Å; D81-R86 PolarHBondContact O-N 2.8Å; D81-R86 IonicContact OD2-CZ 3.93Å; D81-R86 IonicContact OD2-NE 2.68Å; D81-R86 PolarHBondContact OD2-NE 3.02Å; D81-R86 VanDerWaalsContact OD2-NE 3.1Å; D81-R86 IonicContact OD2-NH2 2.78Å; D81-R86 PolarHBondContact OD2-NH2 3.35Å
82	T	98.1	Very high	97.7	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.018	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-51.6	-56	-161.3	-40.3	0	0	0	0	114	S65 H67 A80 N84 H85 Y112 P113 R114	S65-T82 WeakPolarHBondContact O-CB 3.36Å; S65-T82 PolarHBondContact O-OG1 2.96Å; H67-T82 VanDerWaalsContact CB-OG1 3.31Å; H67-T82 WeakPolarHBondContact CB-OG1 3.23Å; H67-T82 PolarHBondContact CD2-OG1 2.55Å; H67-T82 PolarHBondContact N-OG1 3.15Å; A80-T82 PolarHBondContact O-N 2.95Å; T82-N84 VanDerWaalsContact C-N 3.28Å; T82-N84 PolarHBondContact O-N 2.88Å; T82-H85 PolarHBondContact O-N 2.83Å; T82-Y112 HydrophobicContact CG2-CD1 4.17Å; T82-Y112 HydrophobicContact CG2-CG 4.48Å; T82-Y112 WeakPolarHBondContact O-CA 3.31Å; T82-P113 WeakPolarHBondContact CA-O 3.15Å; T82-P113 WeakPolarHBondContact CB-O 3.22Å; T82-P113 WeakPolarHBondContact CG2-O 3.37Å; T82-P113 PolarHBondContact OG1-O 3.38Å; T82-R114 HydrophobicContact CG2-CG 4.38Å
83	N	98	Very high	97.4	Very high	64 Å²	64	32.8 Å²	32.8	34%	0.342	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-81.2	-11.1	-173.7	-68.8	-16.4	0	0	0	112.9	N64 S65 D81 H85	N64-N83 HydrophobicContact CB-CB 3.89Å; N64-N83 VanDerWaalsContact O-CB 3.29Å; N64-N83 WeakPolarHBondContact O-CB 3.28Å; N64-N83 PolarHBondContact O-N 3.39Å; N64-N83 WeakPolarHBondContact OD1-CB 3.41Å; N64-N83 PolarHBondContact OD1-ND2 3.23Å; N64-N83 VanDerWaalsContact OD1-ND2 3.12Å; S65-N83 VanDerWaalsContact CB-ND2 3.29Å; S65-N83 WeakPolarHBondContact CB-ND2 3.44Å; D81-N83 PolarHBondContact O-N 3.2Å; N83-H85 VanDerWaalsContact C-N 3.35Å; N83-H85 PolarHBondContact O-CD2 3.33Å; N83-H85 VanDerWaalsContact O-CD2 3.23Å
84	N	98.6	Very high	97.5	Very high	31 Å²	31	30 Å²	30	17%	0.166	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-93.4	1	170.1	-68	-23	0	0	0	112.1	G57 N64 D81 T82 R86	G57-N84 PolarHBondContact O-ND2 3.11Å; N64-N84 WeakPolarHBondContact CB-OD1 3.42Å; D81-N84 HydrophobicContact CB-CB 4.47Å; D81-N84 CarbonylContact O-C 3.55Å; D81-N84 PolarHBondContact O-N 3.18Å; D81-N84 VanDerWaalsContact O-N 3.14Å; D81-N84 PolarHBondContact OD1-ND2 3.49Å; D81-N84 VanDerWaalsContact OD2-CB 3.24Å; D81-N84 WeakPolarHBondContact OD2-CB 3.42Å; D81-N84 PolarHBondContact OD2-ND2 2.87Å; T82-N84 VanDerWaalsContact C-N 3.28Å; T82-N84 PolarHBondContact O-N 2.88Å; N84-R86 VanDerWaalsContact C-N 3.26Å; N84-R86 HydrophobicContact CB-CG 4.04Å; N84-R86 PolarHBondContact O-N 3.33Å
85	H	98.4	Very high	97.6	Very high	20 Å²	20	26.7 Å²	26.7	9%	0.093	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	38.1	174.3	-56	-96.3	0	0	0	113.7	D81 T82 N83 A103 L110 W111 Y112	D81-H85 PolarHBondContact O-N 2.87Å; D81-H85 VanDerWaalsContact O-N 3.09Å; T82-H85 PolarHBondContact O-N 2.83Å; N83-H85 VanDerWaalsContact C-N 3.35Å; N83-H85 PolarHBondContact O-CD2 3.33Å; N83-H85 VanDerWaalsContact O-CD2 3.23Å; H85-A103 HydrophobicContact CB-CB 3.69Å; H85-L110 PolarHBondContact ND1-O 3.28Å; H85-L110 WeakPolarHBondContact O-CB 3.34Å; H85-W111 AromaticContact CE1-CD2 3.85Å; H85-W111 AromaticContact CE1-CE3 3.39Å; H85-W111 AromaticContact CE1-CH2 3.99Å; H85-W111 AromaticContact CE1-CZ3 3.46Å; H85-W111 VanDerWaalsContact CE1-CZ3 3.46Å; H85-W111 WeakPolarHBondContact CE1-CZ3 3.42Å; H85-W111 AromaticContact ND1-CE3 3.46Å; H85-W111 AromaticContact ND1-CZ3 3.89Å; H85-Y112 AromaticContact CE1-CD1 3.78Å; H85-Y112 AromaticContact CE1-CD2 3.9Å; H85-Y112 AromaticContact CE1-CE1 3.65Å; H85-Y112 AromaticContact CE1-CE2 3.78Å; H85-Y112 AromaticContact CE1-CG 3.91Å; H85-Y112 AromaticContact CE1-CZ 3.65Å; H85-Y112 PolarHBondContact ND1-N 2.7Å; H85-Y112 AromaticContact NE2-CE1 3.75Å; H85-Y112 AromaticContact NE2-CZ 3.93Å
86	R	98.7	Very high	97.7	Very high	20 Å²	20	28 Å²	28	8%	0.075	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	165.4	-176	69.2	-177.7	-178.3	-161.3	4.6	112.3	T58 A59 Q62 D81 N84 E88 F100	T58-R86 PolarHBondContact O-NH1 2.9Å; T58-R86 PolarHBondContact O-NH2 2.89Å; A59-R86 PolarHBondContact O-NH2 2.86Å; Q62-R86 PolarHBondContact O-NH2 2.91Å; D81-R86 HydrophobicContact CB-CG 3.89Å; D81-R86 PolarHBondContact N-O 2.86Å; D81-R86 PolarHBondContact O-N 2.8Å; D81-R86 IonicContact OD2-CZ 3.93Å; D81-R86 IonicContact OD2-NE 2.68Å; D81-R86 PolarHBondContact OD2-NE 3.02Å; D81-R86 VanDerWaalsContact OD2-NE 3.1Å; D81-R86 IonicContact OD2-NH2 2.78Å; D81-R86 PolarHBondContact OD2-NH2 3.35Å; N84-R86 VanDerWaalsContact C-N 3.26Å; N84-R86 HydrophobicContact CB-CG 4.04Å; N84-R86 PolarHBondContact O-N 3.33Å; R86-E88 HydrophobicContact CG-CG 4.39Å; R86-E88 IonicContact CZ-OE1 3.63Å; R86-E88 IonicContact NE-OE1 3.1Å; R86-E88 PolarHBondContact NE-OE1 2.86Å; R86-E88 IonicContact NH2-OE1 3.42Å; R86-E88 PolarHBondContact NH2-OE1 2.91Å; R86-F100 WeakPolarHBondContact CA-O 3.45Å; R86-F100 WeakPolarHBondContact CB-O 3.38Å
87	I	98.9	Very high	97.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	134.6	165.2	-55.3	-55.5	0	0	0	108	I78 V79 A80 Q99 F100 L110 P113 V116 V127	I78-I87 HydrophobicContact CG2-CG2 3.35Å; V79-I87 WeakPolarHBondContact O-CA 3.38Å; A80-I87 HydrophobicContact CB-CD1 3.89Å; I87-Q99 CarbonylContact O-C 3.52Å; I87-Q99 WeakPolarHBondContact O-CA 3.25Å; I87-Q99 WeakPolarHBondContact O-CB 3.1Å; I87-F100 HydrophobicContact CB-CD1 4.1Å; I87-F100 HydrophobicContact CB-CD2 4.43Å; I87-F100 HydrophobicContact CB-CE1 3.63Å; I87-F100 HydrophobicContact CB-CE2 3.98Å; I87-F100 HydrophobicContact CB-CG 4.49Å; I87-F100 HydrophobicContact CB-CZ 3.56Å; I87-F100 HydrophobicContact CG1-CE1 4.3Å; I87-F100 HydrophobicContact CG1-CE2 3.82Å; I87-F100 HydrophobicContact CG1-CZ 3.7Å; I87-F100 HydrophobicContact CG2-CD1 4.41Å; I87-F100 HydrophobicContact CG2-CE1 3.61Å; I87-F100 HydrophobicContact CG2-CZ 3.73Å; I87-F100 PolarHBondContact N-O 3.38Å; I87-F100 PolarHBondContact O-N 2.97Å; I87-L110 HydrophobicContact CD1-CD1 4.37Å; I87-L110 HydrophobicContact CG1-CD1 3.87Å; I87-P113 HydrophobicContact CD1-CB 3.99Å; I87-P113 HydrophobicContact CD1-CG 4.32Å; I87-V116 HydrophobicContact CD1-CB 4.43Å; I87-V127 HydrophobicContact CD1-CG1 3.91Å; I87-V127 HydrophobicContact CD1-CG2 4.14Å; I87-V127 HydrophobicContact CG1-CG1 4.33Å; I87-V127 HydrophobicContact CG1-CG2 3.93Å
88	E	98.8	Very high	97.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	137.7	172.2	-68	-164.3	-129.7	0	0	110.6	G61 F63 I78 V79 R86 F90 L96 Q99	G61-E88 VanDerWaalsContact CA-OE2 3.31Å; G61-E88 WeakPolarHBondContact CA-OE2 3.31Å; G61-E88 PolarHBondContact N-OE2 2.82Å; F63-E88 HydrophobicContact CE1-CB 4.38Å; I78-E88 CarbonylContact C-O 3.58Å; I78-E88 WeakPolarHBondContact CA-O 3.44Å; V79-E88 PolarHBondContact N-O 2.89Å; V79-E88 PolarHBondContact O-N 3.42Å; R86-E88 HydrophobicContact CG-CG 4.39Å; R86-E88 IonicContact CZ-OE1 3.63Å; R86-E88 IonicContact NE-OE1 3.1Å; R86-E88 PolarHBondContact NE-OE1 2.86Å; R86-E88 IonicContact NH2-OE1 3.42Å; R86-E88 PolarHBondContact NH2-OE1 2.91Å; E88-F90 HydrophobicContact CB-CD2 4.36Å; E88-F90 HydrophobicContact CB-CE2 3.44Å; E88-F90 VanDerWaalsContact CB-CE2 3.44Å; E88-F90 HydrophobicContact CB-CZ 3.84Å; E88-F90 WeakPolarHBondContact OE2-CZ 3.29Å; E88-L96 HydrophobicContact CB-CD1 4.08Å; E88-L96 HydrophobicContact CG-CD1 4.43Å; E88-L96 WeakPolarHBondContact OE2-CD1 3.5Å; E88-Q99 HydrophobicContact CG-CB 3.92Å
89	V	98.8	Very high	97.7	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	120	-177.8	-178.6	0	0	0	0	108.8	E76 I78 K97 F98 F100 F125	E76-V89 HydrophobicContact CB-CG1 4.05Å; E76-V89 HydrophobicContact CG-CG1 4.47Å; I78-V89 HydrophobicContact CG1-CG1 4.16Å; I78-V89 HydrophobicContact CG1-CG2 4.05Å; I78-V89 HydrophobicContact CG2-CG2 4.22Å; V89-K97 HydrophobicContact CG1-CD 4.43Å; V89-K97 WeakPolarHBondContact O-CB 3.18Å; V89-K97 PolarHBondContact O-N 2.89Å; V89-F98 HydrophobicContact CB-CD1 4.02Å; V89-F98 HydrophobicContact CB-CE1 3.74Å; V89-F98 HydrophobicContact CB-CE2 4.41Å; V89-F98 HydrophobicContact CB-CG 4.45Å; V89-F98 HydrophobicContact CB-CZ 3.96Å; V89-F98 HydrophobicContact CG1-CD1 4.27Å; V89-F98 HydrophobicContact CG1-CE1 3.7Å; V89-F98 HydrophobicContact CG1-CZ 4.15Å; V89-F98 HydrophobicContact CG2-CD2 4.43Å; V89-F98 HydrophobicContact CG2-CE1 3.96Å; V89-F98 HydrophobicContact CG2-CE2 3.88Å; V89-F98 HydrophobicContact CG2-CZ 3.62Å; V89-F98 PolarHBondContact N-O 2.95Å; V89-F98 PolarHBondContact O-N 2.93Å; V89-F100 HydrophobicContact CG2-CE1 4.39Å; V89-F125 HydrophobicContact CG2-CZ 4.24Å
90	F	98.8	Very high	97.7	Very high	3 Å²	3	38.7 Å²	38.7	1%	0.013	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	153.4	178.9	-56.6	-97.3	0	0	0	110	F53 F63 E76 I77 V79 E88 G94 A95 L96	F53-F90 AromaticContact CD2-CD1 3.85Å; F53-F90 HydrophobicContact CD2-CD1 3.85Å; F53-F90 AromaticContact CD2-CE1 3.96Å; F53-F90 HydrophobicContact CD2-CE1 3.96Å; F53-F90 HydrophobicContact CD2-CG 4.25Å; F53-F90 HydrophobicContact CD2-CZ 4.44Å; F53-F90 HydrophobicContact CE2-CB 4.02Å; F53-F90 AromaticContact CE2-CD1 3.58Å; F53-F90 HydrophobicContact CE2-CD1 3.58Å; F53-F90 AromaticContact CE2-CD2 3.76Å; F53-F90 HydrophobicContact CE2-CD2 3.76Å; F53-F90 AromaticContact CE2-CE1 3.94Å; F53-F90 HydrophobicContact CE2-CE1 3.94Å; F53-F90 HydrophobicContact CE2-CE2 4.11Å; F53-F90 AromaticContact CE2-CG 3.5Å; F53-F90 HydrophobicContact CE2-CG 3.5Å; F53-F90 HydrophobicContact CE2-CZ 4.21Å; F53-F90 HydrophobicContact CZ-CB 4.15Å; F53-F90 HydrophobicContact CZ-CD1 4.48Å; F53-F90 HydrophobicContact CZ-CD2 4.45Å; F53-F90 HydrophobicContact CZ-CG 4.12Å; F63-F90 AromaticContact CE1-CE2 3.63Å; F63-F90 HydrophobicContact CE1-CE2 3.63Å; F63-F90 AromaticContact CE1-CZ 3.57Å; F63-F90 HydrophobicContact CE1-CZ 3.57Å; F63-F90 HydrophobicContact CZ-CE1 4.42Å; F63-F90 AromaticContact CZ-CE2 3.5Å; F63-F90 HydrophobicContact CZ-CE2 3.5Å; F63-F90 AromaticContact CZ-CZ 3.43Å; F63-F90 HydrophobicContact CZ-CZ 3.43Å; F63-F90 VanDerWaalsContact CZ-CZ 3.43Å; E76-F90 CarbonylContact C-O 3.32Å; E76-F90 WeakPolarHBondContact CA-O 3.09Å; E76-F90 VanDerWaalsContact CB-O 3.22Å; E76-F90 WeakPolarHBondContact CB-O 3.33Å; I77-F90 HydrophobicContact CB-CB 4.38Å; I77-F90 PolarHBondContact N-O 2.85Å; I77-F90 WeakPolarHBondContact O-CD2 3.47Å; I77-F90 PolarHBondContact O-N 3.18Å; V79-F90 HydrophobicContact CG2-CD2 4.37Å; V79-F90 HydrophobicContact CG2-CE2 4.23Å; E88-F90 HydrophobicContact CB-CD2 4.36Å; E88-F90 HydrophobicContact CB-CE2 3.44Å; E88-F90 VanDerWaalsContact CB-CE2 3.44Å; E88-F90 HydrophobicContact CB-CZ 3.84Å; E88-F90 WeakPolarHBondContact OE2-CZ 3.29Å; F90-G94 WeakPolarHBondContact CD1-O 3.44Å; F90-A95 CarbonylContact C-O 3.5Å; F90-A95 VanDerWaalsContact CA-O 3.23Å; F90-A95 WeakPolarHBondContact CA-O 3.28Å; F90-L96 HydrophobicContact CD1-CB 3.98Å; F90-L96 HydrophobicContact CD1-CD1 4.06Å; F90-L96 HydrophobicContact CE1-CB 3.86Å; F90-L96 HydrophobicContact CE1-CD1 3.67Å; F90-L96 HydrophobicContact CE1-CG 4.36Å; F90-L96 HydrophobicContact CE2-CD1 4.24Å; F90-L96 HydrophobicContact CG-CD1 4.49Å; F90-L96 HydrophobicContact CZ-CD1 3.75Å
91	D	97.1	Very high	97.7	Very high	52 Å²	52	40.1 Å²	40.1	28%	0.278	21%	0.212	S	C	.	.			trans	-71	173.8	164.2	71	18.1	0	0	0	111.4	M93 G94 A95 K97	D91-M93 PolarHBondContact O-N 3.47Å; D91-M93 VanDerWaalsContact O-N 3.09Å; D91-M93 WeakPolarHBondContact OD1-CA 3.48Å; D91-M93 WeakPolarHBondContact OD1-CB 3.34Å; D91-M93 PolarHBondContact OD1-N 3.03Å; D91-G94 PolarHBondContact O-N 3.26Å; D91-G94 PolarHBondContact OD1-N 2.89Å; D91-A95 PolarHBondContact N-O 2.83Å; D91-A95 PolarHBondContact OD1-N 2.88Å; D91-A95 WeakPolarHBondContact OD2-CB 3.43Å; D91-K97 HydrophobicContact CB-CD 4.17Å; D91-K97 HydrophobicContact CB-CG 4.31Å
92	K	93.7	Very high	97.6	Very high	89 Å²	89	44.9 Å²	44.9	39%	0.387	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.9	179.3	70.7	175.5	-171.6	165.1	0	114.6	E297	K92-E297 VanDerWaalsContact NZ-CD 3.33Å; K92-E297 IonicContact NZ-OE1 3.3Å; K92-E297 PolarHBondContact NZ-OE1 3.47Å; K92-E297 IonicContact NZ-OE2 2.74Å; K92-E297 PolarHBondContact NZ-OE2 2.72Å
93	M	90.6	Very high	97.5	Very high	147 Å²	147	47.3 Å²	47.3	72%	0.724	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-7.1	177.4	-63.8	-175.6	64.7	0	0	112.7	D91	D91-M93 PolarHBondContact O-N 3.47Å; D91-M93 VanDerWaalsContact O-N 3.09Å; D91-M93 WeakPolarHBondContact OD1-CA 3.48Å; D91-M93 WeakPolarHBondContact OD1-CB 3.34Å; D91-M93 PolarHBondContact OD1-N 3.03Å
94	G	95.9	Very high	97.5	Very high	14 Å²	14	44.9 Å²	44.9	14%	0.144	25%	0.251	C	S	.	.	S	Bend	trans	92.3	12	179.6	0	0	0	0	0	114.6	F53 F90 D91	F53-G94 VanDerWaalsContact CD1-CA 3.42Å; F53-G94 VanDerWaalsContact CE1-CA 3.43Å; F90-G94 WeakPolarHBondContact CD1-O 3.44Å; D91-G94 PolarHBondContact O-N 3.26Å; D91-G94 PolarHBondContact OD1-N 2.89Å
95	A	97.4	Very high	97.2	Very high	53 Å²	53	47.2 Å²	47.2	44%	0.438	26%	0.26	S	S	.	.			trans	-79.6	130	171.7	0	0	0	0	0	110	F90 D91 K97	F90-A95 CarbonylContact C-O 3.5Å; F90-A95 VanDerWaalsContact CA-O 3.23Å; F90-A95 WeakPolarHBondContact CA-O 3.28Å; D91-A95 PolarHBondContact N-O 2.83Å; D91-A95 PolarHBondContact OD1-N 2.88Å; D91-A95 WeakPolarHBondContact OD2-CB 3.43Å; A95-K97 PolarHBondContact O-N 3.24Å
96	L	98.4	Very high	97	Very high	57 Å²	57	52.7 Å²	52.7	30%	0.298	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	122.3	178.6	-178.8	71.2	0	0	0	110.1	K60 E88 F90	K60-L96 HydrophobicContact CB-CD2 3.59Å; K60-L96 HydrophobicContact CD-CD2 4.29Å; K60-L96 HydrophobicContact CG-CD2 4.09Å; E88-L96 HydrophobicContact CB-CD1 4.08Å; E88-L96 HydrophobicContact CG-CD1 4.43Å; E88-L96 WeakPolarHBondContact OE2-CD1 3.5Å; F90-L96 HydrophobicContact CD1-CB 3.98Å; F90-L96 HydrophobicContact CD1-CD1 4.06Å; F90-L96 HydrophobicContact CE1-CB 3.86Å; F90-L96 HydrophobicContact CE1-CD1 3.67Å; F90-L96 HydrophobicContact CE1-CG 4.36Å; F90-L96 HydrophobicContact CE2-CD1 4.24Å; F90-L96 HydrophobicContact CG-CD1 4.49Å; F90-L96 HydrophobicContact CZ-CD1 3.75Å
97	K	98.4	Very high	96.8	Very high	107 Å²	107	58 Å²	58	47%	0.465	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-57.5	173.4	-62.6	177.6	68.7	173	0	110.2	E76 V89 D91 A95	E76-K97 HydrophobicContact CG-CD 4.01Å; E76-K97 IonicContact OE1-NZ 2.7Å; E76-K97 PolarHBondContact OE1-NZ 3.23Å; V89-K97 HydrophobicContact CG1-CD 4.43Å; V89-K97 WeakPolarHBondContact O-CB 3.18Å; V89-K97 PolarHBondContact O-N 2.89Å; D91-K97 HydrophobicContact CB-CD 4.17Å; D91-K97 HydrophobicContact CB-CG 4.31Å; A95-K97 PolarHBondContact O-N 3.24Å
98	F	98.6	Very high	96.7	Very high	61 Å²	61	58.9 Å²	58.9	27%	0.268	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	173.5	179.5	66.8	-81	0	0	0	111.3	V89 F100 F125 K142	V89-F98 HydrophobicContact CB-CD1 4.02Å; V89-F98 HydrophobicContact CB-CE1 3.74Å; V89-F98 HydrophobicContact CB-CE2 4.41Å; V89-F98 HydrophobicContact CB-CG 4.45Å; V89-F98 HydrophobicContact CB-CZ 3.96Å; V89-F98 HydrophobicContact CG1-CD1 4.27Å; V89-F98 HydrophobicContact CG1-CE1 3.7Å; V89-F98 HydrophobicContact CG1-CZ 4.15Å; V89-F98 HydrophobicContact CG2-CD2 4.43Å; V89-F98 HydrophobicContact CG2-CE1 3.96Å; V89-F98 HydrophobicContact CG2-CE2 3.88Å; V89-F98 HydrophobicContact CG2-CZ 3.62Å; V89-F98 PolarHBondContact N-O 2.95Å; V89-F98 PolarHBondContact O-N 2.93Å; F98-F100 HydrophobicContact CD2-CD1 4.25Å; F98-F100 AromaticContact CE2-CD1 3.78Å; F98-F100 HydrophobicContact CE2-CD1 3.78Å; F98-F100 HydrophobicContact CE2-CE1 4.22Å; F98-F125 HydrophobicContact CE2-CE2 4.48Å; F98-F125 HydrophobicContact CZ-CE2 4.18Å; F98-F125 HydrophobicContact CZ-CZ 4.06Å; F98-K142 WeakPolarHBondContact CZ-O 3.29Å
99	Q	98.6	Very high	96.6	Very high	72 Å²	72	61.8 Å²	61.8	34%	0.336	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	154.8	173.2	69.4	-178.1	39.5	0	0	109.6	I87 E88	I87-Q99 CarbonylContact O-C 3.52Å; I87-Q99 WeakPolarHBondContact O-CA 3.25Å; I87-Q99 WeakPolarHBondContact O-CB 3.1Å; E88-Q99 HydrophobicContact CG-CB 3.92Å
100	F	98.8	Very high	96.6	Very high	18 Å²	18	61.8 Å²	61.8	8%	0.079	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	164.3	174.3	66.7	-87.1	0	0	0	111.5	R86 I87 V89 F98 F125 V127 F140 G144	R86-F100 WeakPolarHBondContact CA-O 3.45Å; R86-F100 WeakPolarHBondContact CB-O 3.38Å; I87-F100 HydrophobicContact CB-CD1 4.1Å; I87-F100 HydrophobicContact CB-CD2 4.43Å; I87-F100 HydrophobicContact CB-CE1 3.63Å; I87-F100 HydrophobicContact CB-CE2 3.98Å; I87-F100 HydrophobicContact CB-CG 4.49Å; I87-F100 HydrophobicContact CB-CZ 3.56Å; I87-F100 HydrophobicContact CG1-CE1 4.3Å; I87-F100 HydrophobicContact CG1-CE2 3.82Å; I87-F100 HydrophobicContact CG1-CZ 3.7Å; I87-F100 HydrophobicContact CG2-CD1 4.41Å; I87-F100 HydrophobicContact CG2-CE1 3.61Å; I87-F100 HydrophobicContact CG2-CZ 3.73Å; I87-F100 PolarHBondContact N-O 3.38Å; I87-F100 PolarHBondContact O-N 2.97Å; V89-F100 HydrophobicContact CG2-CE1 4.39Å; F98-F100 HydrophobicContact CD2-CD1 4.25Å; F98-F100 AromaticContact CE2-CD1 3.78Å; F98-F100 HydrophobicContact CE2-CD1 3.78Å; F98-F100 HydrophobicContact CE2-CE1 4.22Å; F100-F125 AromaticContact CE1-CD2 3.75Å; F100-F125 HydrophobicContact CE1-CD2 3.75Å; F100-F125 AromaticContact CE1-CE2 3.84Å; F100-F125 HydrophobicContact CE1-CE2 3.84Å; F100-F125 HydrophobicContact CE1-CG 4.29Å; F100-F125 HydrophobicContact CE1-CZ 4.48Å; F100-F125 HydrophobicContact CZ-CB 4.18Å; F100-F125 AromaticContact CZ-CD2 3.61Å; F100-F125 HydrophobicContact CZ-CD2 3.61Å; F100-F125 HydrophobicContact CZ-CE2 4.19Å; F100-F125 AromaticContact CZ-CG 3.92Å; F100-F125 HydrophobicContact CZ-CG 3.92Å; F100-V127 HydrophobicContact CE2-CG2 4.48Å; F100-F140 AromaticContact CD2-CD1 3.92Å; F100-F140 HydrophobicContact CD2-CD1 3.92Å; F100-F140 HydrophobicContact CD2-CE1 4.29Å; F100-F140 HydrophobicContact CD2-CG 4.24Å; F100-F140 HydrophobicContact CE2-CB 3.93Å; F100-F140 AromaticContact CE2-CD1 3.78Å; F100-F140 HydrophobicContact CE2-CD1 3.78Å; F100-F140 AromaticContact CE2-CD2 3.97Å; F100-F140 HydrophobicContact CE2-CD2 3.97Å; F100-F140 HydrophobicContact CE2-CE1 4.28Å; F100-F140 HydrophobicContact CE2-CE2 4.43Å; F100-F140 AromaticContact CE2-CG 3.63Å; F100-F140 HydrophobicContact CE2-CG 3.63Å; F100-F140 HydrophobicContact CZ-CB 4.32Å; F100-F140 HydrophobicContact CZ-CG 4.43Å; F100-G144 VanDerWaalsContact CG-CA 3.49Å
101	G	97.8	Very high	96.5	Very high	31 Å²	31	64.8 Å²	64.8	32%	0.32	35%	0.345	S	S	.	.			trans	108.2	143.8	-175.6	0	0	0	0	0	112.6
102	V	96.5	Very high	96.5	Very high	99 Å²	99	65.9 Å²	65.9	60%	0.6	35%	0.346	S	S	*	.			trans	-132.2	139.5	175.3	178.9	0	0	0	0	107.1	G104 Q109 L110	V102-G104 PolarHBondContact O-N 3.21Å; V102-Q109 CarbonylContact O-C 3.56Å; V102-Q109 WeakPolarHBondContact O-CA 3.32Å; V102-Q109 WeakPolarHBondContact O-CB 3.31Å; V102-L110 PolarHBondContact O-N 2.86Å
103	A	97.8	Very high	96.7	Very high	55 Å²	55	61.6 Å²	61.6	46%	0.455	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-59	125.2	179.7	0	0	0	0	0	111.5	H85 L110 W111	H85-A103 HydrophobicContact CB-CB 3.69Å; A103-L110 WeakPolarHBondContact CA-O 3.33Å; A103-W111 HydrophobicContact CB-CZ3 4.48Å
104	G	96.2	Very high	97	Very high	12 Å²	12	59.2 Å²	59.2	12%	0.124	31%	0.31	C	S	.	.	S	Bend	trans	154.4	178.9	172.6	0	0	0	0	0	113	V102 Q109 L110 W111 R136	V102-G104 PolarHBondContact O-N 3.21Å; G104-Q109 VanDerWaalsContact C-CB 3.46Å; G104-Q109 VanDerWaalsContact C-OE1 3.24Å; G104-Q109 WeakPolarHBondContact O-CB 3.29Å; G104-L110 PolarHBondContact N-O 3.27Å; G104-L110 CarbonylContact O-C 3.21Å; G104-L110 PolarHBondContact O-N 3.23Å; G104-W111 WeakPolarHBondContact O-CB 3.22Å; G104-R136 PolarHBondContact O-NH2 2.91Å
105	K	93.7	Very high	97.1	Very high	81 Å²	81	59.7 Å²	59.7	35%	0.352	31%	0.308	S	S	.	.	S	Bend	trans	-115.8	-0.7	-169.2	-57.6	-169.5	-177.4	173.3	0	113.9	Q109 W111 G131 N132 R136	K105-Q109 VanDerWaalsContact N-OE1 3.1Å; K105-W111 HydrophobicContact CD-CG 4.47Å; K105-W111 HydrophobicContact CG-CB 4.02Å; K105-W111 HydrophobicContact CG-CD2 4.2Å; K105-W111 HydrophobicContact CG-CG 3.89Å; K105-G131 WeakPolarHBondContact CD-O 3.29Å; K105-G131 WeakPolarHBondContact CE-O 3.26Å; K105-N132 WeakPolarHBondContact CD-OD1 3.36Å; K105-N132 PolarHBondContact NZ-OD1 3.43Å; K105-R136 VanDerWaalsContact C-NH1 3.35Å; K105-R136 PolarHBondContact O-NH1 2.8Å
106	E	94.8	Very high	97.1	Very high	135 Å²	135	57.4 Å²	57.4	63%	0.631	29%	0.289	S	S	*	.	S	Bend	trans	-73.2	167.8	171.5	-57.7	-53.6	140.9	0	0	110.8	G108 Q109 R136	E106-G108 PolarHBondContact O-N 2.76Å; E106-Q109 HydrophobicContact CB-CG 4.31Å; E106-Q109 WeakPolarHBondContact O-CB 3.31Å; E106-Q109 PolarHBondContact O-N 3.12Å; E106-Q109 VanDerWaalsContact O-N 3.14Å; E106-R136 PolarHBondContact O-NH1 2.83Å
107	E	94	Very high	97.1	Very high	130 Å²	130	54.9 Å²	54.9	61%	0.607	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	132.1	176.1	-66.5	-164.7	158	0	0	111.5	Q109 F146	E107-Q109 PolarHBondContact O-N 2.72Å; E107-F146 HydrophobicContact CB-CE1 3.74Å; E107-F146 HydrophobicContact CB-CE2 4.39Å; E107-F146 HydrophobicContact CB-CZ 3.62Å; E107-F146 HydrophobicContact CG-CZ 4.21Å
108	G	95.8	Very high	97.1	Very high	19 Å²	19	50.2 Å²	50.2	20%	0.196	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	-13	-176.8	0	0	0	0	0	115.6	E106	E106-G108 PolarHBondContact O-N 2.76Å
109	Q	97.6	Very high	97	Very high	62 Å²	62	47.3 Å²	47.3	29%	0.29	24%	0.244	S	C	.	.			trans	-82.5	159.8	167.3	-62.3	178	-21.3	0	0	110.6	V102 G104 K105 E106 E107 R136 Q138	V102-Q109 CarbonylContact O-C 3.56Å; V102-Q109 WeakPolarHBondContact O-CA 3.32Å; V102-Q109 WeakPolarHBondContact O-CB 3.31Å; G104-Q109 VanDerWaalsContact C-CB 3.46Å; G104-Q109 VanDerWaalsContact C-OE1 3.24Å; G104-Q109 WeakPolarHBondContact O-CB 3.29Å; K105-Q109 VanDerWaalsContact N-OE1 3.1Å; E106-Q109 HydrophobicContact CB-CG 4.31Å; E106-Q109 WeakPolarHBondContact O-CB 3.31Å; E106-Q109 PolarHBondContact O-N 3.12Å; E106-Q109 VanDerWaalsContact O-N 3.14Å; E107-Q109 PolarHBondContact O-N 2.72Å; Q109-R136 PolarHBondContact O-NH2 3.17Å; Q109-Q138 PolarHBondContact O-NE2 3.49Å
110	L	98.1	Very high	96.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-119.4	137.2	178.5	-64.5	-180	0	0	0	111.3	H85 I87 V102 A103 G104 P113 V127 D129 F140	H85-L110 PolarHBondContact ND1-O 3.28Å; H85-L110 WeakPolarHBondContact O-CB 3.34Å; I87-L110 HydrophobicContact CD1-CD1 4.37Å; I87-L110 HydrophobicContact CG1-CD1 3.87Å; V102-L110 PolarHBondContact O-N 2.86Å; A103-L110 WeakPolarHBondContact CA-O 3.33Å; G104-L110 PolarHBondContact N-O 3.27Å; G104-L110 CarbonylContact O-C 3.21Å; G104-L110 PolarHBondContact O-N 3.23Å; L110-P113 HydrophobicContact CB-CG 4.48Å; L110-P113 HydrophobicContact CD1-CG 4.38Å; L110-V127 HydrophobicContact CD2-CB 4.45Å; L110-V127 HydrophobicContact CD2-CG1 3.77Å; L110-D129 WeakPolarHBondContact CA-OD2 3.31Å; L110-F140 HydrophobicContact CD2-CE2 3.93Å; L110-F140 HydrophobicContact CD2-CZ 3.76Å; L110-F140 HydrophobicContact CG-CZ 4.35Å
111	W	97.3	Very high	96.5	Very high	67 Å²	67	53.5 Å²	53.5	25%	0.254	28%	0.276	S	S	.	.	S	Bend	trans	-128.6	97.2	177.5	-166.1	-112.7	0	0	0	111.4	H85 A103 G104 K105 D129 R130 G131	H85-W111 AromaticContact CE1-CD2 3.85Å; H85-W111 AromaticContact CE1-CE3 3.39Å; H85-W111 AromaticContact CE1-CH2 3.99Å; H85-W111 AromaticContact CE1-CZ3 3.46Å; H85-W111 VanDerWaalsContact CE1-CZ3 3.46Å; H85-W111 WeakPolarHBondContact CE1-CZ3 3.42Å; H85-W111 AromaticContact ND1-CE3 3.46Å; H85-W111 AromaticContact ND1-CZ3 3.89Å; A103-W111 HydrophobicContact CB-CZ3 4.48Å; G104-W111 WeakPolarHBondContact O-CB 3.22Å; K105-W111 HydrophobicContact CD-CG 4.47Å; K105-W111 HydrophobicContact CG-CB 4.02Å; K105-W111 HydrophobicContact CG-CD2 4.2Å; K105-W111 HydrophobicContact CG-CG 3.89Å; W111-D129 PolarHBondContact N-OD2 2.81Å; W111-D129 WeakPolarHBondContact O-CB 3.37Å; W111-R130 WeakPolarHBondContact O-CB 3.48Å; W111-R130 PolarHBondContact O-N 2.82Å; W111-G131 VanDerWaalsContact CD1-O 3.27Å
112	Y	97.3	Very high	96.3	Very high	74 Å²	74	54.5 Å²	54.5	29%	0.29	27%	0.274	S	S	.	.	S	Bend	trans	53.2	63.8	-173.5	-57.6	-73.1	0	0	0	112.6	T82 H85 R114	T82-Y112 HydrophobicContact CG2-CD1 4.17Å; T82-Y112 HydrophobicContact CG2-CG 4.48Å; T82-Y112 WeakPolarHBondContact O-CA 3.31Å; H85-Y112 AromaticContact CE1-CD1 3.78Å; H85-Y112 AromaticContact CE1-CD2 3.9Å; H85-Y112 AromaticContact CE1-CE1 3.65Å; H85-Y112 AromaticContact CE1-CE2 3.78Å; H85-Y112 AromaticContact CE1-CG 3.91Å; H85-Y112 AromaticContact CE1-CZ 3.65Å; H85-Y112 PolarHBondContact ND1-N 2.7Å; H85-Y112 AromaticContact NE2-CE1 3.75Å; H85-Y112 AromaticContact NE2-CZ 3.93Å; Y112-R114 PolarHBondContact O-N 2.88Å
113	P	97.9	Very high	96.4	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.252	C	S	.	.			trans	-60.1	128.8	176.3	28.1	-34.9	0	0	0	110.2	A80 T82 I87 L110 V127 D129	A80-P113 HydrophobicContact CB-CB 4.28Å; T82-P113 WeakPolarHBondContact CA-O 3.15Å; T82-P113 WeakPolarHBondContact CB-O 3.22Å; T82-P113 WeakPolarHBondContact CG2-O 3.37Å; T82-P113 PolarHBondContact OG1-O 3.38Å; I87-P113 HydrophobicContact CD1-CB 3.99Å; I87-P113 HydrophobicContact CD1-CG 4.32Å; L110-P113 HydrophobicContact CB-CG 4.48Å; L110-P113 HydrophobicContact CD1-CG 4.38Å; P113-V127 HydrophobicContact CB-CG1 3.91Å; P113-D129 HydrophobicContact CB-CB 4.2Å
114	R	96.1	Very high	96.4	Very high	97 Å²	97	49.6 Å²	49.6	37%	0.366	24%	0.238	S	C	.	.			trans	-111.6	-35.8	-174.8	-72.8	-174.5	172.3	-141.6	0	113.7	H67 G68 T82 Y112 C128	H67-R114 CarbonylContact C-O 3.17Å; H67-R114 HydrophobicContact CB-CB 4.41Å; H67-R114 HydrophobicContact CB-CG 4.5Å; G68-R114 WeakPolarHBondContact CA-O 3.41Å; G68-R114 PolarHBondContact N-O 3.41Å; T82-R114 HydrophobicContact CG2-CG 4.38Å; Y112-R114 PolarHBondContact O-N 2.88Å; R114-C128 PolarHBondContact N-O 3.19Å
115	K	97.5	Very high	96.5	Very high	24 Å²	24	49.6 Å²	49.6	10%	0.104	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	145.9	-179.2	-68.2	-72.9	-178.1	156.4	0	109.7	C128 V158 A159 L161 S202 D203	K115-C128 HydrophobicContact CB-CB 4.23Å; K115-C128 PolarHBondContact N-O 2.83Å; K115-C128 PolarHBondContact O-N 2.77Å; K115-V158 HydrophobicContact CB-CG1 4.4Å; K115-V158 HydrophobicContact CG-CG1 4.22Å; K115-A159 WeakPolarHBondContact CE-O 3.29Å; K115-A159 PolarHBondContact NZ-O 3.01Å; K115-L161 HydrophobicContact CB-CB 3.86Å; K115-L161 HydrophobicContact CB-CD2 3.93Å; K115-L161 HydrophobicContact CG-CB 4.35Å; K115-S202 PolarHBondContact NZ-O 3.42Å; K115-D203 IonicContact NZ-OD1 3.1Å; K115-D203 PolarHBondContact NZ-OD1 2.95Å; K115-D203 VanDerWaalsContact NZ-OD1 3.13Å
116	V	98.6	Very high	96.7	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.024	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	136.8	176.4	60.7	0	0	0	0	108.3	C70 I78 A80 I87 V126 V127	C70-V116 WeakPolarHBondContact CB-O 3.41Å; C70-V116 PolarHBondContact SG-O 3.29Å; I78-V116 HydrophobicContact CG2-CB 4.46Å; I78-V116 HydrophobicContact CG2-CG1 3.97Å; I78-V116 HydrophobicContact CG2-CG2 3.69Å; I78-V116 WeakPolarHBondContact O-CG1 3.49Å; A80-V116 HydrophobicContact CB-CG1 4.23Å; I87-V116 HydrophobicContact CD1-CB 4.43Å; V116-V126 CarbonylContact C-O 3.57Å; V116-V126 VanDerWaalsContact CA-O 3.28Å; V116-V126 WeakPolarHBondContact CA-O 3.47Å; V116-V127 HydrophobicContact CG2-CG2 4.06Å
117	A	98.3	Very high	96.9	Very high	5 Å²	5	39.3 Å²	39.3	4%	0.041	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	156.6	172.9	0	0	0	0	0	109.6	C70 F125 V126 L161 V163	C70-A117 VanDerWaalsContact SG-CA 3.54Å; A117-F125 WeakPolarHBondContact O-CA 3.26Å; A117-V126 PolarHBondContact N-O 2.97Å; A117-V126 PolarHBondContact O-N 2.84Å; A117-L161 HydrophobicContact CB-CD2 3.78Å; A117-L161 HydrophobicContact CB-CG 3.87Å; A117-V163 HydrophobicContact CB-CG2 3.94Å
118	V	98.3	Very high	97.1	Very high	8 Å²	8	33.2 Å²	33.2	5%	0.048	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	133.7	176.1	175	0	0	0	0	109.7	V73 I78 H120 K124 F125	V73-V118 HydrophobicContact CG2-CG1 4.05Å; I78-V118 HydrophobicContact CD1-CG2 3.78Å; I78-V118 HydrophobicContact CG1-CG2 4.43Å; V118-H120 PolarHBondContact O-N 3.37Å; V118-K124 WeakPolarHBondContact CA-O 3.36Å; V118-F125 HydrophobicContact CG2-CD1 3.65Å; V118-F125 HydrophobicContact CG2-CE1 3.79Å
119	M	96.9	Very high	97.1	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	15%	0.151	C	C	.	.			trans	-80.9	110.9	171.4	-62.8	-174.5	78.9	0	0	110.1	N121 N122 G123 K124 V126 V163 G167 E184	M119-N121 VanDerWaalsContact C-N 3.25Å; M119-N121 PolarHBondContact O-N 2.77Å; M119-N122 WeakPolarHBondContact CB-OD1 3.37Å; M119-N122 PolarHBondContact O-N 3.42Å; M119-G123 WeakPolarHBondContact O-CA 3.2Å; M119-G123 PolarHBondContact O-N 2.8Å; M119-K124 HydrophobicContact CB-CB 4.46Å; M119-K124 HydrophobicContact CG-CB 4.48Å; M119-K124 PolarHBondContact N-O 3.39Å; M119-K124 HydrophobicContact SD-CB 4.14Å; M119-K124 HydrophobicContact SD-CD 4.4Å; M119-V126 HydrophobicContact CG-CG2 3.95Å; M119-V126 HydrophobicContact SD-CG2 4.31Å; M119-V163 HydrophobicContact CG-CG1 4.42Å; M119-V163 HydrophobicContact CG-CG2 4.37Å; M119-G167 WeakPolarHBondContact CE-O 3.49Å; M119-E184 HydrophobicContact CE-CB 3.79Å; M119-E184 HydrophobicContact CE-CG 3.47Å; M119-E184 VanDerWaalsContact CE-CG 3.47Å; M119-E184 WeakPolarHBondContact CE-OE2 3.18Å; M119-E184 HydrophobicContact SD-CG 3.66Å
120	H	93	Very high	96.7	Very high	117 Å²	117	36 Å²	36	54%	0.542	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-29.5	-173.6	-71.8	-78.8	0	0	0	114.5	V118 N122	V118-H120 PolarHBondContact O-N 3.37Å; H120-N122 VanDerWaalsContact C-N 3.33Å; H120-N122 PolarHBondContact O-N 3.28Å
121	N	93.3	Very high	96.1	Very high	102 Å²	102	36.2 Å²	36.2	55%	0.545	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-22.7	-177.8	63	-13.3	0	0	0	114.1	M119	M119-N121 VanDerWaalsContact C-N 3.25Å; M119-N121 PolarHBondContact O-N 2.77Å
122	N	94.6	Very high	95.2	Very high	52 Å²	52	38.2 Å²	38.2	28%	0.278	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-144.6	-3.5	-173.5	62.2	33.4	0	0	0	114.9	M119 H120 K124 E184	M119-N122 WeakPolarHBondContact CB-OD1 3.37Å; M119-N122 PolarHBondContact O-N 3.42Å; H120-N122 VanDerWaalsContact C-N 3.33Å; H120-N122 PolarHBondContact O-N 3.28Å; N122-K124 VanDerWaalsContact C-N 3.26Å; N122-K124 WeakPolarHBondContact ND2-CD 3.45Å; N122-K124 WeakPolarHBondContact ND2-CE 3.34Å; N122-K124 PolarHBondContact ND2-NZ 3.37Å; N122-K124 VanDerWaalsContact ND2-NZ 3.19Å; N122-K124 PolarHBondContact O-N 2.92Å; N122-K124 VanDerWaalsContact OD1-CB 3.22Å; N122-K124 WeakPolarHBondContact OD1-CB 3.37Å; N122-K124 WeakPolarHBondContact OD1-CD 3.31Å; N122-K124 WeakPolarHBondContact OD1-CG 3.48Å; N122-K124 PolarHBondContact OD1-N 2.77Å; N122-E184 PolarHBondContact ND2-OE2 3.36Å
123	G	96.9	Very high	94.1	Very high	13 Å²	13	43.5 Å²	43.5	13%	0.134	21%	0.207	C	C	.	.			trans	71.2	13.1	178.9	0	0	0	0	0	114.8	M119 K142	M119-G123 WeakPolarHBondContact O-CA 3.2Å; M119-G123 PolarHBondContact O-N 2.8Å; G123-K142 WeakPolarHBondContact O-CA 3.33Å; G123-K142 VanDerWaalsContact O-CB 3.31Å; G123-K142 WeakPolarHBondContact O-CB 3.36Å
124	K	98.1	Very high	93.4	Very high	39 Å²	39	49.9 Å²	49.9	17%	0.17	23%	0.231	C	C	.	.			trans	-69.3	145.5	176.1	-68	169.9	-166.1	160	0	110.6	V118 M119 N122 I139 F140 M147 E184	V118-K124 WeakPolarHBondContact CA-O 3.36Å; M119-K124 HydrophobicContact CB-CB 4.46Å; M119-K124 HydrophobicContact CG-CB 4.48Å; M119-K124 PolarHBondContact N-O 3.39Å; M119-K124 HydrophobicContact SD-CB 4.14Å; M119-K124 HydrophobicContact SD-CD 4.4Å; N122-K124 VanDerWaalsContact C-N 3.26Å; N122-K124 WeakPolarHBondContact ND2-CD 3.45Å; N122-K124 WeakPolarHBondContact ND2-CE 3.34Å; N122-K124 PolarHBondContact ND2-NZ 3.37Å; N122-K124 VanDerWaalsContact ND2-NZ 3.19Å; N122-K124 PolarHBondContact O-N 2.92Å; N122-K124 VanDerWaalsContact OD1-CB 3.22Å; N122-K124 WeakPolarHBondContact OD1-CB 3.37Å; N122-K124 WeakPolarHBondContact OD1-CD 3.31Å; N122-K124 WeakPolarHBondContact OD1-CG 3.48Å; N122-K124 PolarHBondContact OD1-N 2.77Å; K124-I139 HydrophobicContact CB-CG2 4.06Å; K124-I139 HydrophobicContact CD-CG2 3.91Å; K124-I139 HydrophobicContact CG-CG2 4.31Å; K124-F140 CarbonylContact C-O 3.6Å; K124-F140 VanDerWaalsContact CA-O 3.3Å; K124-F140 WeakPolarHBondContact CA-O 3.42Å; K124-F140 WeakPolarHBondContact CB-O 3.36Å; K124-M147 HydrophobicContact CD-CE 4.42Å; K124-M147 HydrophobicContact CD-SD 3.86Å; K124-M147 HydrophobicContact CG-SD 3.98Å; K124-E184 IonicContact NZ-OE1 3.04Å; K124-E184 PolarHBondContact NZ-OE1 3.1Å; K124-E184 IonicContact NZ-OE2 3.72Å; K124-E184 PolarHBondContact NZ-OE2 2.78Å
125	F	98.6	Very high	93.2	Very high	11 Å²	11	46.1 Å²	46.1	5%	0.048	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	133.1	172.1	-52.5	-70.6	0	0	0	110	I78 V89 F98 F100 A117 V118 V127 I139 F140 S141 K142	I78-F125 HydrophobicContact CD1-CE1 4.43Å; I78-F125 HydrophobicContact CG1-CE1 3.9Å; I78-F125 HydrophobicContact CG2-CD1 4.26Å; I78-F125 HydrophobicContact CG2-CE1 4.31Å; V89-F125 HydrophobicContact CG2-CZ 4.24Å; F98-F125 HydrophobicContact CE2-CE2 4.48Å; F98-F125 HydrophobicContact CZ-CE2 4.18Å; F98-F125 HydrophobicContact CZ-CZ 4.06Å; F100-F125 AromaticContact CE1-CD2 3.75Å; F100-F125 HydrophobicContact CE1-CD2 3.75Å; F100-F125 AromaticContact CE1-CE2 3.84Å; F100-F125 HydrophobicContact CE1-CE2 3.84Å; F100-F125 HydrophobicContact CE1-CG 4.29Å; F100-F125 HydrophobicContact CE1-CZ 4.48Å; F100-F125 HydrophobicContact CZ-CB 4.18Å; F100-F125 AromaticContact CZ-CD2 3.61Å; F100-F125 HydrophobicContact CZ-CD2 3.61Å; F100-F125 HydrophobicContact CZ-CE2 4.19Å; F100-F125 AromaticContact CZ-CG 3.92Å; F100-F125 HydrophobicContact CZ-CG 3.92Å; A117-F125 WeakPolarHBondContact O-CA 3.26Å; V118-F125 HydrophobicContact CG2-CD1 3.65Å; V118-F125 HydrophobicContact CG2-CE1 3.79Å; F125-V127 HydrophobicContact CB-CG2 4.27Å; F125-I139 CarbonylContact O-C 3.56Å; F125-I139 VanDerWaalsContact O-CA 3.3Å; F125-I139 WeakPolarHBondContact O-CA 3.2Å; F125-F140 HydrophobicContact CB-CB 4.27Å; F125-F140 HydrophobicContact CD2-CB 4.26Å; F125-F140 PolarHBondContact N-O 2.97Å; F125-F140 PolarHBondContact O-N 3.01Å; F125-S141 WeakPolarHBondContact CD2-O 3.3Å; F125-S141 VanDerWaalsContact CE2-O 3.23Å; F125-S141 WeakPolarHBondContact CE2-O 3.39Å; F125-K142 WeakPolarHBondContact CE2-O 3.25Å
126	V	98.4	Very high	93	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	113.7	166.3	-177.4	0	0	0	0	107	V116 A117 M119 M137 I139 L161 I169	V116-V126 CarbonylContact C-O 3.57Å; V116-V126 VanDerWaalsContact CA-O 3.28Å; V116-V126 WeakPolarHBondContact CA-O 3.47Å; A117-V126 PolarHBondContact N-O 2.97Å; A117-V126 PolarHBondContact O-N 2.84Å; M119-V126 HydrophobicContact CG-CG2 3.95Å; M119-V126 HydrophobicContact SD-CG2 4.31Å; V126-M137 HydrophobicContact CG1-CE 4.41Å; V126-M137 HydrophobicContact CG1-CG 3.67Å; V126-M137 HydrophobicContact CG1-SD 3.81Å; V126-I139 HydrophobicContact CG2-CG1 4.46Å; V126-L161 HydrophobicContact CG1-CD2 4.31Å; V126-I169 HydrophobicContact CG1-CD1 3.99Å; V126-I169 HydrophobicContact CG1-CG1 4.47Å; V126-I169 HydrophobicContact CG1-CG2 4.07Å; V126-I169 HydrophobicContact CG2-CD1 3.75Å; V126-I169 HydrophobicContact CG2-CG1 4Å
127	V	98.4	Very high	92.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	125.7	-177.6	-178.2	0	0	0	0	109.5	I87 F100 L110 P113 V116 F125 M137 Q138 F140	I87-V127 HydrophobicContact CD1-CG1 3.91Å; I87-V127 HydrophobicContact CD1-CG2 4.14Å; I87-V127 HydrophobicContact CG1-CG1 4.33Å; I87-V127 HydrophobicContact CG1-CG2 3.93Å; F100-V127 HydrophobicContact CE2-CG2 4.48Å; L110-V127 HydrophobicContact CD2-CB 4.45Å; L110-V127 HydrophobicContact CD2-CG1 3.77Å; P113-V127 HydrophobicContact CB-CG1 3.91Å; V116-V127 HydrophobicContact CG2-CG2 4.06Å; F125-V127 HydrophobicContact CB-CG2 4.27Å; V127-M137 CarbonylContact O-C 3.55Å; V127-M137 WeakPolarHBondContact O-CA 3.35Å; V127-Q138 PolarHBondContact N-O 3.07Å; V127-Q138 PolarHBondContact O-N 2.61Å; V127-F140 HydrophobicContact CB-CD2 4.26Å; V127-F140 HydrophobicContact CB-CE2 4.04Å; V127-F140 HydrophobicContact CG2-CD2 3.83Å; V127-F140 HydrophobicContact CG2-CE2 4.02Å
128	C	97.3	Very high	92.8	Very high	2 Å²	2	45 Å²	45	1%	0.014	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	121.2	172.1	-64.6	0	0	0	0	109.9	R114 K115 R136 M137 V158	R114-C128 PolarHBondContact N-O 3.19Å; K115-C128 HydrophobicContact CB-CB 4.23Å; K115-C128 PolarHBondContact N-O 2.83Å; K115-C128 PolarHBondContact O-N 2.77Å; C128-R136 CarbonylContact C-O 3.46Å; C128-R136 VanDerWaalsContact CA-O 3.29Å; C128-R136 WeakPolarHBondContact CA-O 3.17Å; C128-M137 VanDerWaalsContact SG-CE 3.53Å; C128-V158 HydrophobicContact CB-CB 4.18Å; C128-V158 HydrophobicContact CB-CG1 4.35Å; C128-V158 HydrophobicContact CB-CG2 4.05Å
129	D	95.9	Very high	92.8	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.011	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	176.2	177.5	78.3	17.3	0	0	0	112	L110 W111 P113 G131 S135 R136	L110-D129 WeakPolarHBondContact CA-OD2 3.31Å; W111-D129 PolarHBondContact N-OD2 2.81Å; W111-D129 WeakPolarHBondContact O-CB 3.37Å; P113-D129 HydrophobicContact CB-CB 4.2Å; D129-G131 VanDerWaalsContact C-N 3.27Å; D129-G131 PolarHBondContact O-N 3.44Å; D129-G131 PolarHBondContact OD1-N 2.84Å; D129-S135 CarbonylContact O-C 3.58Å; D129-S135 VanDerWaalsContact O-CA 3.27Å; D129-S135 WeakPolarHBondContact O-CA 3.42Å; D129-R136 PolarHBondContact N-O 3.14Å; D129-R136 PolarHBondContact O-N 2.89Å; D129-R136 WeakPolarHBondContact OD1-CB 3.23Å; D129-R136 IonicContact OD1-CZ 3.88Å; D129-R136 IonicContact OD1-NE 3.84Å; D129-R136 PolarHBondContact OD1-NE 3.24Å; D129-R136 IonicContact OD1-NH2 2.84Å; D129-R136 PolarHBondContact OD1-NH2 2.85Å; D129-R136 IonicContact OD2-CZ 2.61Å; D129-R136 IonicContact OD2-NE 3.5Å; D129-R136 PolarHBondContact OD2-NE 2.64Å; D129-R136 IonicContact OD2-NH2 2.77Å; D129-R136 PolarHBondContact OD2-NH2 2.96Å
130	R	90.9	Very high	92.9	Very high	138 Å²	138	44.7 Å²	44.7	52%	0.521	21%	0.211	S	C	.	.			trans	-76.5	-10.7	-173.2	-155.2	-150.7	177.1	-169.8	-2.8	113.7	W111 N132 R134	W111-R130 WeakPolarHBondContact O-CB 3.48Å; W111-R130 PolarHBondContact O-N 2.82Å; R130-N132 PolarHBondContact O-N 2.85Å; R130-R134 CarbonylContact C-O 3.56Å
131	G	83.9	Confident	93.1	Very high	4 Å²	4	40.1 Å²	40.1	4%	0.041	19%	0.193	C	C	.	.			trans	46.7	-131.4	-177.2	0	0	0	0	0	114	K105 W111 D129	K105-G131 WeakPolarHBondContact CD-O 3.29Å; K105-G131 WeakPolarHBondContact CE-O 3.26Å; W111-G131 VanDerWaalsContact CD1-O 3.27Å; D129-G131 VanDerWaalsContact C-N 3.27Å; D129-G131 PolarHBondContact O-N 3.44Å; D129-G131 PolarHBondContact OD1-N 2.84Å
132	N	79	Confident	93.3	Very high	110 Å²	110	42.6 Å²	42.6	59%	0.588	20%	0.198	S	C	*	.	S	Bend	trans	-93	-70.5	175.7	-84.3	-40.6	0	0	0	111.8	K105 R130	K105-N132 WeakPolarHBondContact CD-OD1 3.36Å; K105-N132 PolarHBondContact NZ-OD1 3.43Å; R130-N132 PolarHBondContact O-N 2.85Å
133	E	75.1	Confident	93.4	Very high	185 Å²	185	43.4 Å²	43.4	86%	0.864	21%	0.207	S	C	*	.	S	Bend	trans	-114.4	-37.2	-172.6	-66.4	174.3	-178.7	0	0	111.9
134	R	83.6	Confident	93.4	Very high	133 Å²	133	43.3 Å²	43.3	50%	0.502	21%	0.206	S	C	.	.	S	Bend	trans	-120.3	164.5	177.3	-66.6	-176.2	169.1	165.3	5	110.8	R130 R136 R153 D156	R130-R134 CarbonylContact C-O 3.56Å; R134-R136 PolarHBondContact O-N 3.29Å; R134-R153 PolarHBondContact NH1-O 2.93Å; R134-D156 VanDerWaalsContact CD-OD1 3.22Å; R134-D156 WeakPolarHBondContact CD-OD1 3.2Å; R134-D156 WeakPolarHBondContact CG-OD1 3.27Å; R134-D156 IonicContact CZ-OD1 2.67Å; R134-D156 IonicContact NE-OD1 3.01Å; R134-D156 PolarHBondContact NE-OD1 3.11Å; R134-D156 IonicContact NH2-OD1 2.95Å
135	S	89.9	Confident	93.4	Very high	18 Å²	18	47.5 Å²	47.5	13%	0.126	23%	0.226	C	C	.	.			trans	-49.3	141.4	170.1	-65.2	0	0	0	0	110.9	D129 I152 D156 I157 V158	D129-S135 CarbonylContact O-C 3.58Å; D129-S135 VanDerWaalsContact O-CA 3.27Å; D129-S135 WeakPolarHBondContact O-CA 3.42Å; S135-I152 VanDerWaalsContact C-CD1 3.48Å; S135-I152 WeakPolarHBondContact O-CD1 3.3Å; S135-I152 WeakPolarHBondContact O-CG1 3.4Å; S135-D156 WeakPolarHBondContact CB-O 3.17Å; S135-D156 PolarHBondContact N-O 3.24Å; S135-D156 PolarHBondContact OG-O 2.95Å; S135-I157 WeakPolarHBondContact OG-CA 3.22Å; S135-V158 PolarHBondContact OG-N 2.84Å
136	R	93.5	Very high	93.4	Very high	9 Å²	9	50.1 Å²	50.1	3%	0.034	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	136.7	172.1	160.6	-179.6	70.5	160	5.5	108.2	G104 K105 E106 Q109 C128 D129 R134 Q138 K149	G104-R136 PolarHBondContact O-NH2 2.91Å; K105-R136 VanDerWaalsContact C-NH1 3.35Å; K105-R136 PolarHBondContact O-NH1 2.8Å; E106-R136 PolarHBondContact O-NH1 2.83Å; Q109-R136 PolarHBondContact O-NH2 3.17Å; C128-R136 CarbonylContact C-O 3.46Å; C128-R136 VanDerWaalsContact CA-O 3.29Å; C128-R136 WeakPolarHBondContact CA-O 3.17Å; D129-R136 PolarHBondContact N-O 3.14Å; D129-R136 PolarHBondContact O-N 2.89Å; D129-R136 WeakPolarHBondContact OD1-CB 3.23Å; D129-R136 IonicContact OD1-CZ 3.88Å; D129-R136 IonicContact OD1-NE 3.84Å; D129-R136 PolarHBondContact OD1-NE 3.24Å; D129-R136 IonicContact OD1-NH2 2.84Å; D129-R136 PolarHBondContact OD1-NH2 2.85Å; D129-R136 IonicContact OD2-CZ 2.61Å; D129-R136 IonicContact OD2-NE 3.5Å; D129-R136 PolarHBondContact OD2-NE 2.64Å; D129-R136 IonicContact OD2-NH2 2.77Å; D129-R136 PolarHBondContact OD2-NH2 2.96Å; R134-R136 PolarHBondContact O-N 3.29Å; R136-Q138 HydrophobicContact CG-CG 3.9Å; R136-K149 HydrophobicContact CG-CD 4.29Å; R136-K149 HydrophobicContact CG-CG 4.26Å
137	M	96.2	Very high	93.4	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.1	175.5	-172.2	179.5	-74.9	0	0	109.8	V126 V127 C128 I150 I152 L161 I169 A171 I182	V126-M137 HydrophobicContact CG1-CE 4.41Å; V126-M137 HydrophobicContact CG1-CG 3.67Å; V126-M137 HydrophobicContact CG1-SD 3.81Å; V127-M137 CarbonylContact O-C 3.55Å; V127-M137 WeakPolarHBondContact O-CA 3.35Å; C128-M137 VanDerWaalsContact SG-CE 3.53Å; M137-I150 HydrophobicContact CB-CB 4.22Å; M137-I150 HydrophobicContact CG-CB 4.25Å; M137-I150 HydrophobicContact CG-CD1 4.5Å; M137-I150 PolarHBondContact O-N 3.19Å; M137-I150 HydrophobicContact SD-CB 4.23Å; M137-I150 HydrophobicContact SD-CD1 4.09Å; M137-I150 HydrophobicContact SD-CG2 4.17Å; M137-I152 HydrophobicContact CB-CD1 3.96Å; M137-I152 HydrophobicContact CB-CG1 4.16Å; M137-I152 HydrophobicContact CB-CG2 3.86Å; M137-I152 HydrophobicContact CE-CG2 3.94Å; M137-I152 HydrophobicContact SD-CG2 4.02Å; M137-L161 HydrophobicContact CE-CD1 3.95Å; M137-I169 HydrophobicContact CE-CG2 3.84Å; M137-I169 HydrophobicContact SD-CD1 4.15Å; M137-I169 HydrophobicContact SD-CG2 3.91Å; M137-A171 HydrophobicContact CE-CB 4.22Å; M137-I182 HydrophobicContact CE-CD1 4.39Å
138	Q	97.4	Very high	93.3	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	141.7	-179.8	-64.8	-174.9	100.1	0	0	110.4	Q109 V127 R136 F140 F146 R148 K149	Q109-Q138 PolarHBondContact O-NE2 3.49Å; V127-Q138 PolarHBondContact N-O 3.07Å; V127-Q138 PolarHBondContact O-N 2.61Å; R136-Q138 HydrophobicContact CG-CG 3.9Å; Q138-F140 HydrophobicContact CB-CD2 4.32Å; Q138-F140 HydrophobicContact CB-CE2 3.57Å; Q138-F140 HydrophobicContact CB-CZ 4.18Å; Q138-F146 HydrophobicContact CB-CE2 4.35Å; Q138-F146 HydrophobicContact CG-CE2 4.32Å; Q138-R148 WeakPolarHBondContact CA-O 3.35Å; Q138-K149 HydrophobicContact CG-CB 4.44Å; Q138-K149 HydrophobicContact CG-CG 4.44Å
139	I	98.2	Very high	93.1	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	130.9	173.3	-66.5	-175.1	0	0	0	109.4	K124 F125 V126 M147 R148 I150 E184	K124-I139 HydrophobicContact CB-CG2 4.06Å; K124-I139 HydrophobicContact CD-CG2 3.91Å; K124-I139 HydrophobicContact CG-CG2 4.31Å; F125-I139 CarbonylContact O-C 3.56Å; F125-I139 VanDerWaalsContact O-CA 3.3Å; F125-I139 WeakPolarHBondContact O-CA 3.2Å; V126-I139 HydrophobicContact CG2-CG1 4.46Å; I139-M147 HydrophobicContact CG2-CB 4.15Å; I139-M147 HydrophobicContact CG2-CG 4.45Å; I139-M147 HydrophobicContact CG2-SD 4.06Å; I139-M147 WeakPolarHBondContact O-CB 3.27Å; I139-M147 PolarHBondContact O-N 2.86Å; I139-R148 HydrophobicContact CB-CG 4.32Å; I139-R148 PolarHBondContact N-O 2.91Å; I139-R148 PolarHBondContact O-N 2.94Å; I139-I150 HydrophobicContact CD1-CD1 3.54Å; I139-I150 HydrophobicContact CD1-CG1 4.29Å; I139-I150 HydrophobicContact CG1-CD1 3.81Å; I139-I150 HydrophobicContact CG1-CG1 4.4Å; I139-E184 HydrophobicContact CD1-CG 3.68Å
140	F	98.6	Very high	92.9	Very high	3 Å²	3	62.7 Å²	62.7	1%	0.013	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	147.3	170.9	-60.6	-101.5	0	0	0	109.7	F100 L110 K124 F125 V127 Q138 G144 H145 F146	F100-F140 AromaticContact CD2-CD1 3.92Å; F100-F140 HydrophobicContact CD2-CD1 3.92Å; F100-F140 HydrophobicContact CD2-CE1 4.29Å; F100-F140 HydrophobicContact CD2-CG 4.24Å; F100-F140 HydrophobicContact CE2-CB 3.93Å; F100-F140 AromaticContact CE2-CD1 3.78Å; F100-F140 HydrophobicContact CE2-CD1 3.78Å; F100-F140 AromaticContact CE2-CD2 3.97Å; F100-F140 HydrophobicContact CE2-CD2 3.97Å; F100-F140 HydrophobicContact CE2-CE1 4.28Å; F100-F140 HydrophobicContact CE2-CE2 4.43Å; F100-F140 AromaticContact CE2-CG 3.63Å; F100-F140 HydrophobicContact CE2-CG 3.63Å; F100-F140 HydrophobicContact CZ-CB 4.32Å; F100-F140 HydrophobicContact CZ-CG 4.43Å; L110-F140 HydrophobicContact CD2-CE2 3.93Å; L110-F140 HydrophobicContact CD2-CZ 3.76Å; L110-F140 HydrophobicContact CG-CZ 4.35Å; K124-F140 CarbonylContact C-O 3.6Å; K124-F140 VanDerWaalsContact CA-O 3.3Å; K124-F140 WeakPolarHBondContact CA-O 3.42Å; K124-F140 WeakPolarHBondContact CB-O 3.36Å; F125-F140 HydrophobicContact CB-CB 4.27Å; F125-F140 HydrophobicContact CD2-CB 4.26Å; F125-F140 PolarHBondContact N-O 2.97Å; F125-F140 PolarHBondContact O-N 3.01Å; V127-F140 HydrophobicContact CB-CD2 4.26Å; V127-F140 HydrophobicContact CB-CE2 4.04Å; V127-F140 HydrophobicContact CG2-CD2 3.83Å; V127-F140 HydrophobicContact CG2-CE2 4.02Å; Q138-F140 HydrophobicContact CB-CD2 4.32Å; Q138-F140 HydrophobicContact CB-CE2 3.57Å; Q138-F140 HydrophobicContact CB-CZ 4.18Å; F140-G144 WeakPolarHBondContact CD1-O 3.33Å; F140-H145 CarbonylContact C-O 3.58Å; F140-H145 VanDerWaalsContact CA-O 3.28Å; F140-H145 WeakPolarHBondContact CA-O 3.47Å; F140-F146 HydrophobicContact CD1-CB 4.09Å; F140-F146 HydrophobicContact CE1-CB 3.91Å; F140-F146 HydrophobicContact CE1-CD2 4.14Å; F140-F146 HydrophobicContact CZ-CD2 4.24Å
141	S	98.3	Very high	92.6	Very high	22 Å²	22	59 Å²	59	15%	0.154	29%	0.291	C	S	.	.			trans	-63.8	165.3	171.4	63.5	0	0	0	0	111.5	F125 C143 G144 H145	F125-S141 WeakPolarHBondContact CD2-O 3.3Å; F125-S141 VanDerWaalsContact CE2-O 3.23Å; F125-S141 WeakPolarHBondContact CE2-O 3.39Å; S141-C143 PolarHBondContact O-N 3.5Å; S141-C143 PolarHBondContact OG-SG 3.08Å; S141-G144 PolarHBondContact O-N 3.31Å; S141-H145 PolarHBondContact N-O 3.14Å; S141-H145 WeakPolarHBondContact OG-CB 3.31Å; S141-H145 PolarHBondContact OG-N 2.83Å; S141-H145 VanDerWaalsContact OG-N 3.08Å; S141-H145 PolarHBondContact OG-O 2.91Å
142	K	96.9	Very high	92.5	Very high	154 Å²	154	59.6 Å²	59.6	67%	0.67	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-16.7	176.6	69.6	178.6	-177.2	177.2	0	115.3	F98 G123 F125	F98-K142 WeakPolarHBondContact CZ-O 3.29Å; G123-K142 WeakPolarHBondContact O-CA 3.33Å; G123-K142 VanDerWaalsContact O-CB 3.31Å; G123-K142 WeakPolarHBondContact O-CB 3.36Å; F125-K142 WeakPolarHBondContact CE2-O 3.25Å
143	C	96.6	Very high	92.5	Very high	69 Å²	69	62.9 Å²	62.9	47%	0.466	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	8.6	174.8	48.5	0	0	0	0	113.6	S141 H145	S141-C143 PolarHBondContact O-N 3.5Å; S141-C143 PolarHBondContact OG-SG 3.08Å; C143-H145 PolarHBondContact SG-ND1 2.78Å
144	G	97.7	Very high	92.8	Very high	10 Å²	10	59.5 Å²	59.5	10%	0.103	28%	0.278	C	S	.	.	S	Bend	trans	85.1	6.8	174.8	0	0	0	0	0	115.3	F100 F140 S141	F100-G144 VanDerWaalsContact CG-CA 3.49Å; F140-G144 WeakPolarHBondContact CD1-O 3.33Å; S141-G144 PolarHBondContact O-N 3.31Å
145	H	98.1	Very high	93.1	Very high	127 Å²	127	53.3 Å²	53.3	59%	0.588	25%	0.254	S	S	*	.			trans	-76	133.4	172.4	-57.5	120.4	0	0	0	111	F140 S141 C143 M147	F140-H145 CarbonylContact C-O 3.58Å; F140-H145 VanDerWaalsContact CA-O 3.28Å; F140-H145 WeakPolarHBondContact CA-O 3.47Å; S141-H145 PolarHBondContact N-O 3.14Å; S141-H145 WeakPolarHBondContact OG-CB 3.31Å; S141-H145 PolarHBondContact OG-N 2.83Å; S141-H145 VanDerWaalsContact OG-N 3.08Å; S141-H145 PolarHBondContact OG-O 2.91Å; C143-H145 PolarHBondContact SG-ND1 2.78Å; H145-M147 PolarHBondContact O-N 2.78Å
146	F	98.3	Very high	93.1	Very high	67 Å²	67	54.5 Å²	54.5	29%	0.294	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	135.4	174.1	174.9	-109.3	0	0	0	111	E107 Q138 F140 R148	E107-F146 HydrophobicContact CB-CE1 3.74Å; E107-F146 HydrophobicContact CB-CE2 4.39Å; E107-F146 HydrophobicContact CB-CZ 3.62Å; E107-F146 HydrophobicContact CG-CZ 4.21Å; Q138-F146 HydrophobicContact CB-CE2 4.35Å; Q138-F146 HydrophobicContact CG-CE2 4.32Å; F140-F146 HydrophobicContact CD1-CB 4.09Å; F140-F146 HydrophobicContact CE1-CB 3.91Å; F140-F146 HydrophobicContact CE1-CD2 4.14Å; F140-F146 HydrophobicContact CZ-CD2 4.24Å; F146-R148 WeakPolarHBondContact CE2-O 3.46Å; F146-R148 VanDerWaalsContact CZ-C 3.43Å
147	M	97.8	Very high	93.1	Very high	87 Å²	87	57.2 Å²	57.2	43%	0.429	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-53.3	175	-61.1	-171.7	68.7	0	0	111.2	K124 I139 H145	K124-M147 HydrophobicContact CD-CE 4.42Å; K124-M147 HydrophobicContact CD-SD 3.86Å; K124-M147 HydrophobicContact CG-SD 3.98Å; I139-M147 HydrophobicContact CG2-CB 4.15Å; I139-M147 HydrophobicContact CG2-CG 4.45Å; I139-M147 HydrophobicContact CG2-SD 4.06Å; I139-M147 WeakPolarHBondContact O-CB 3.27Å; I139-M147 PolarHBondContact O-N 2.86Å; H145-M147 PolarHBondContact O-N 2.78Å
148	R	95.8	Very high	93	Very high	69 Å²	69	57.6 Å²	57.6	26%	0.26	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.3	162.4	-178.5	55	-163.4	167.3	94.4	-2.9	112.8	Q138 I139 F146 E184 E185	Q138-R148 WeakPolarHBondContact CA-O 3.35Å; I139-R148 HydrophobicContact CB-CG 4.32Å; I139-R148 PolarHBondContact N-O 2.91Å; I139-R148 PolarHBondContact O-N 2.94Å; F146-R148 WeakPolarHBondContact CE2-O 3.46Å; F146-R148 VanDerWaalsContact CZ-C 3.43Å; R148-E184 IonicContact CZ-OE1 3.79Å; R148-E184 PolarHBondContact NH1-O 3.23Å; R148-E184 VanDerWaalsContact NH2-CG 3.28Å; R148-E184 PolarHBondContact NH2-O 2.74Å; R148-E184 IonicContact NH2-OE1 3.63Å; R148-E184 PolarHBondContact NH2-OE1 3.42Å; R148-E185 VanDerWaalsContact NH1-CA 3.32Å
149	K	94.1	Very high	92.9	Very high	109 Å²	109	58.1 Å²	58.1	47%	0.474	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	142.1	168.3	-178.1	179.5	173.7	-176.4	0	110.3	R136 Q138	R136-K149 HydrophobicContact CG-CD 4.29Å; R136-K149 HydrophobicContact CG-CG 4.26Å; Q138-K149 HydrophobicContact CG-CB 4.44Å; Q138-K149 HydrophobicContact CG-CG 4.44Å
150	I	91.3	Very high	92.9	Very high	2 Å²	2	58.1 Å²	58.1	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	133.9	170.1	-69.2	173.1	0	0	0	109.2	M137 I139 I152 I169 I182 E184	M137-I150 HydrophobicContact CB-CB 4.22Å; M137-I150 HydrophobicContact CG-CB 4.25Å; M137-I150 HydrophobicContact CG-CD1 4.5Å; M137-I150 PolarHBondContact O-N 3.19Å; M137-I150 HydrophobicContact SD-CB 4.23Å; M137-I150 HydrophobicContact SD-CD1 4.09Å; M137-I150 HydrophobicContact SD-CG2 4.17Å; I139-I150 HydrophobicContact CD1-CD1 3.54Å; I139-I150 HydrophobicContact CD1-CG1 4.29Å; I139-I150 HydrophobicContact CG1-CD1 3.81Å; I139-I150 HydrophobicContact CG1-CG1 4.4Å; I150-I152 HydrophobicContact CG2-CG2 4.14Å; I150-I152 PolarHBondContact O-N 2.94Å; I150-I152 VanDerWaalsContact O-N 3.16Å; I150-I169 HydrophobicContact CD1-CD1 3.57Å; I150-I182 HydrophobicContact CG2-CG2 4.17Å; I150-E184 WeakPolarHBondContact CD1-O 3.49Å
151	A	83.6	Confident	92.8	Very high	61 Å²	61	58.7 Å²	58.7	50%	0.504	28%	0.284	S	S	.	.			trans	-78.6	96	178.6	0	0	0	0	0	111.2	R153	A151-R153 HydrophobicContact CB-CG 4.46Å; A151-R153 PolarHBondContact O-N 3.08Å
152	I	82.4	Confident	92.8	Very high	16 Å²	16	58.4 Å²	58.4	8%	0.082	28%	0.283	C	S	.	.			trans	-94.5	64.5	174.5	53	163.9	0	0	0	112.1	S135 M137 I150 Y154 I155 V158 I182	S135-I152 VanDerWaalsContact C-CD1 3.48Å; S135-I152 WeakPolarHBondContact O-CD1 3.3Å; S135-I152 WeakPolarHBondContact O-CG1 3.4Å; M137-I152 HydrophobicContact CB-CD1 3.96Å; M137-I152 HydrophobicContact CB-CG1 4.16Å; M137-I152 HydrophobicContact CB-CG2 3.86Å; M137-I152 HydrophobicContact CE-CG2 3.94Å; M137-I152 HydrophobicContact SD-CG2 4.02Å; I150-I152 HydrophobicContact CG2-CG2 4.14Å; I150-I152 PolarHBondContact O-N 2.94Å; I150-I152 VanDerWaalsContact O-N 3.16Å; I152-Y154 PolarHBondContact O-N 3.37Å; I152-Y154 VanDerWaalsContact O-N 3.14Å; I152-I155 HydrophobicContact CB-CB 4.25Å; I152-I155 HydrophobicContact CB-CD1 4.11Å; I152-I155 HydrophobicContact CB-CG1 4.32Å; I152-I155 HydrophobicContact CD1-CB 4.31Å; I152-I155 HydrophobicContact CG2-CD1 4.09Å; I152-I155 PolarHBondContact O-N 3.1Å; I152-V158 HydrophobicContact CD1-CG2 4.47Å; I152-I182 HydrophobicContact CG2-CD1 3.97Å
153	R	79.4	Confident	92.8	Very high	180 Å²	180	52.1 Å²	52.1	68%	0.679	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-25.1	-171.1	-62.9	-176.8	-176.6	-86.9	0.2	114.5	R134 A151	R134-R153 PolarHBondContact NH1-O 2.93Å; A151-R153 HydrophobicContact CB-CG 4.46Å; A151-R153 PolarHBondContact O-N 3.08Å
154	Y	82.1	Confident	92.8	Very high	114 Å²	114	49.9 Å²	49.9	45%	0.447	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	1.8	-171.8	-46.7	-78	0	0	0	113.5	L8 I152 F180 L188	L8-Y154 HydrophobicContact CD1-CD1 4.05Å; L8-Y154 HydrophobicContact CD1-CE1 3.8Å; L8-Y154 HydrophobicContact CD2-CD1 4.07Å; L8-Y154 HydrophobicContact CD2-CE1 3.9Å; L8-Y154 HydrophobicContact CG-CE1 4.11Å; I152-Y154 PolarHBondContact O-N 3.37Å; I152-Y154 VanDerWaalsContact O-N 3.14Å; Y154-F180 HydrophobicContact CG-CE1 4.49Å; Y154-L188 HydrophobicContact CD2-CD2 4.45Å; Y154-L188 HydrophobicContact CE2-CD2 4.37Å
155	I	89.4	Confident	92.4	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.01	28%	0.281	C	S	.	.			trans	-113.5	118.4	-175.7	-54.1	178.8	0	0	0	109	I152 V158 A171 D173 F180 I182	I152-I155 HydrophobicContact CB-CB 4.25Å; I152-I155 HydrophobicContact CB-CD1 4.11Å; I152-I155 HydrophobicContact CB-CG1 4.32Å; I152-I155 HydrophobicContact CD1-CB 4.31Å; I152-I155 HydrophobicContact CG2-CD1 4.09Å; I152-I155 PolarHBondContact O-N 3.1Å; I155-V158 HydrophobicContact CG2-CG2 3.66Å; I155-A171 HydrophobicContact CD1-CB 3.74Å; I155-D173 HydrophobicContact CG2-CB 4.13Å; I155-F180 HydrophobicContact CD1-CB 4.08Å; I155-F180 HydrophobicContact CD1-CD2 3.77Å; I155-F180 HydrophobicContact CD1-CE2 4.42Å; I155-F180 HydrophobicContact CD1-CG 3.99Å; I155-F180 HydrophobicContact CG1-CD2 3.57Å; I155-F180 HydrophobicContact CG1-CE2 3.72Å; I155-F180 HydrophobicContact CG1-CG 4.04Å; I155-F180 HydrophobicContact CG1-CZ 4.31Å; I155-I182 HydrophobicContact CD1-CD1 4.06Å
156	D	90.4	Very high	92.1	Very high	44 Å²	44	56.7 Å²	56.7	24%	0.235	29%	0.288	C	S	.	.	S	Bend	trans	-84.7	-55.2	177.5	-74.7	-43.3	0	0	0	110.4	R134 S135 D173 V175	R134-D156 VanDerWaalsContact CD-OD1 3.22Å; R134-D156 WeakPolarHBondContact CD-OD1 3.2Å; R134-D156 WeakPolarHBondContact CG-OD1 3.27Å; R134-D156 IonicContact CZ-OD1 2.67Å; R134-D156 IonicContact NE-OD1 3.01Å; R134-D156 PolarHBondContact NE-OD1 3.11Å; R134-D156 IonicContact NH2-OD1 2.95Å; S135-D156 WeakPolarHBondContact CB-O 3.17Å; S135-D156 PolarHBondContact N-O 3.24Å; S135-D156 PolarHBondContact OG-O 2.95Å; D156-D173 PolarHBondContact N-OD1 3.18Å; D156-D173 VanDerWaalsContact N-OD1 3.14Å; D156-V175 HydrophobicContact CB-CB 3.94Å; D156-V175 HydrophobicContact CB-CG2 3.6Å
157	I	92.1	Very high	91.9	Very high	66 Å²	66	53.8 Å²	53.8	34%	0.338	28%	0.277	S	S	.	.			trans	-134.6	112.2	-177	-58.7	178.6	0	0	0	109.9	S135 A159 D173 S174 V175	S135-I157 WeakPolarHBondContact OG-CA 3.22Å; I157-A159 PolarHBondContact O-N 2.93Å; I157-A159 VanDerWaalsContact O-N 3.08Å; I157-D173 PolarHBondContact N-OD1 2.86Å; I157-D173 CarbonylContact O-C 3.53Å; I157-D173 WeakPolarHBondContact O-CA 3.37Å; I157-D173 VanDerWaalsContact O-OD1 3.12Å; I157-S174 WeakPolarHBondContact CB-OG 3.47Å; I157-S174 WeakPolarHBondContact CG2-OG 3.45Å; I157-S174 PolarHBondContact O-N 3.41Å; I157-V175 HydrophobicContact CB-CG2 4.19Å; I157-V175 HydrophobicContact CD1-CG2 3.82Å; I157-V175 HydrophobicContact CG1-CG2 3.87Å
158	V	95.3	Very high	91.9	Very high	7 Å²	7	52.4 Å²	52.4	4%	0.042	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	105	174.3	-177.7	0	0	0	0	110	K115 C128 S135 I152 I155 G160 L161 A171 V172	K115-V158 HydrophobicContact CB-CG1 4.4Å; K115-V158 HydrophobicContact CG-CG1 4.22Å; C128-V158 HydrophobicContact CB-CB 4.18Å; C128-V158 HydrophobicContact CB-CG1 4.35Å; C128-V158 HydrophobicContact CB-CG2 4.05Å; S135-V158 PolarHBondContact OG-N 2.84Å; I152-V158 HydrophobicContact CD1-CG2 4.47Å; I155-V158 HydrophobicContact CG2-CG2 3.66Å; V158-G160 VanDerWaalsContact CG1-O 3.27Å; V158-G160 WeakPolarHBondContact CG1-O 3.3Å; V158-L161 HydrophobicContact CG1-CB 4.12Å; V158-L161 HydrophobicContact CG1-CD1 4.36Å; V158-A171 HydrophobicContact CG1-CB 4.29Å; V158-V172 WeakPolarHBondContact CA-O 3.5Å
159	A	95.5	Very high	91.9	Very high	11 Å²	11	49.1 Å²	49.1	9%	0.091	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-39.2	174.1	0	0	0	0	0	112.7	K115 I157 V172 P201 S202	K115-A159 WeakPolarHBondContact CE-O 3.29Å; K115-A159 PolarHBondContact NZ-O 3.01Å; I157-A159 PolarHBondContact O-N 2.93Å; I157-A159 VanDerWaalsContact O-N 3.08Å; A159-V172 PolarHBondContact N-O 2.79Å; A159-P201 HydrophobicContact CB-CB 4.18Å; A159-P201 HydrophobicContact CB-CG 4.12Å; A159-P201 WeakPolarHBondContact CB-O 3.35Å; A159-S202 CarbonylContact O-C 3.59Å
160	G	96.8	Very high	92.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	143.2	177.6	0	0	0	0	0	110.2	V158 A171 V172	V158-G160 VanDerWaalsContact CG1-O 3.27Å; V158-G160 WeakPolarHBondContact CG1-O 3.3Å; G160-A171 WeakPolarHBondContact O-CA 3.28Å; G160-V172 PolarHBondContact O-N 2.83Å
161	L	97.9	Very high	92.4	Very high	15 Å²	15	43.8 Å²	43.8	8%	0.079	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	124.9	176.4	-171.8	71.3	0	0	0	109.4	K115 A117 V126 M137 V158 I169 V170 A171	K115-L161 HydrophobicContact CB-CB 3.86Å; K115-L161 HydrophobicContact CB-CD2 3.93Å; K115-L161 HydrophobicContact CG-CB 4.35Å; A117-L161 HydrophobicContact CB-CD2 3.78Å; A117-L161 HydrophobicContact CB-CG 3.87Å; V126-L161 HydrophobicContact CG1-CD2 4.31Å; M137-L161 HydrophobicContact CE-CD1 3.95Å; V158-L161 HydrophobicContact CG1-CB 4.12Å; V158-L161 HydrophobicContact CG1-CD1 4.36Å; L161-I169 HydrophobicContact CD1-CG2 3.86Å; L161-V170 WeakPolarHBondContact CA-O 3.12Å; L161-A171 HydrophobicContact CD1-CB 4.16Å
162	A	97.7	Very high	93.1	Very high	16 Å²	16	40.9 Å²	40.9	13%	0.132	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	170.3	176.3	0	0	0	0	0	110.5	V170 I204 I206	A162-V170 PolarHBondContact N-O 3.42Å; A162-V170 PolarHBondContact O-N 3.23Å; A162-I204 HydrophobicContact CB-CG2 3.93Å; A162-I206 HydrophobicContact CB-CD1 3.85Å; A162-I206 HydrophobicContact CB-CG1 4.33Å
163	V	97	Very high	93.7	Very high	23 Å²	23	40.3 Å²	40.3	14%	0.139	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.2	172.6	179.8	0	0	0	0	108.1	A117 M119 H168	A117-V163 HydrophobicContact CB-CG2 3.94Å; M119-V163 HydrophobicContact CG-CG1 4.42Å; M119-V163 HydrophobicContact CG-CG2 4.37Å; V163-H168 CarbonylContact C-O 3.55Å; V163-H168 WeakPolarHBondContact CA-O 3.5Å
164	T	95.4	Very high	94.3	Very high	21 Å²	21	33.6 Å²	33.6	13%	0.129	19%	0.187	C	C	.	.			trans	-71	163	176.4	65.3	0	0	0	0	111.3	K166 G167 H168 V170 I206	T164-K166 PolarHBondContact O-N 3.44Å; T164-K166 VanDerWaalsContact O-N 3.11Å; T164-K166 PolarHBondContact OG1-N 3.25Å; T164-G167 PolarHBondContact O-N 2.98Å; T164-H168 HydrophobicContact CG2-CB 4.27Å; T164-H168 PolarHBondContact N-O 2.99Å; T164-H168 WeakPolarHBondContact OG1-CB 3.44Å; T164-H168 PolarHBondContact OG1-N 3.31Å; T164-H168 PolarHBondContact OG1-O 3.22Å; T164-V170 HydrophobicContact CG2-CG2 3.69Å; T164-I206 HydrophobicContact CG2-CD1 3.99Å; T164-I206 HydrophobicContact CG2-CG2 4.38Å
165	A	91.1	Very high	94.8	Very high	114 Å²	114	31.9 Å²	31.9	94%	0.942	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-25.3	172.6	0	0	0	0	0	113.6	G167	A165-G167 VanDerWaalsContact C-N 3.26Å; A165-G167 PolarHBondContact O-N 3.47Å
166	K	91.8	Very high	94.9	Very high	166 Å²	166	35 Å²	35	72%	0.722	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-3.9	175.6	-64.4	178.4	-177.9	170.7	0	113.4	T164	T164-K166 PolarHBondContact O-N 3.44Å; T164-K166 VanDerWaalsContact O-N 3.11Å; T164-K166 PolarHBondContact OG1-N 3.25Å
167	G	93.9	Very high	95.1	Very high	6 Å²	6	33.7 Å²	33.7	6%	0.062	20%	0.204	C	C	.	.	S	Bend	trans	84.1	7.8	-177.8	0	0	0	0	0	114.6	M119 T164 A165	M119-G167 WeakPolarHBondContact CE-O 3.49Å; T164-G167 PolarHBondContact O-N 2.98Å; A165-G167 VanDerWaalsContact C-N 3.26Å; A165-G167 PolarHBondContact O-N 3.47Å
168	H	95.9	Very high	95.4	Very high	58 Å²	58	31.1 Å²	31.1	27%	0.269	19%	0.191	S	C	.	.			trans	-73.4	137.7	170.5	-59.4	152.5	0	0	0	111.1	V163 T164 V181 I182	V163-H168 CarbonylContact C-O 3.55Å; V163-H168 WeakPolarHBondContact CA-O 3.5Å; T164-H168 HydrophobicContact CG2-CB 4.27Å; T164-H168 PolarHBondContact N-O 2.99Å; T164-H168 WeakPolarHBondContact OG1-CB 3.44Å; T164-H168 PolarHBondContact OG1-N 3.31Å; T164-H168 PolarHBondContact OG1-O 3.22Å; H168-V181 HydrophobicContact CB-CG1 3.63Å; H168-I182 CarbonylContact C-O 3.6Å; H168-I182 WeakPolarHBondContact CA-O 3.44Å
169	I	97.3	Very high	95.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	131.6	175.3	-57.4	168	0	0	0	107.9	V126 M137 I150 L161 V181 I182	V126-I169 HydrophobicContact CG1-CD1 3.99Å; V126-I169 HydrophobicContact CG1-CG1 4.47Å; V126-I169 HydrophobicContact CG1-CG2 4.07Å; V126-I169 HydrophobicContact CG2-CD1 3.75Å; V126-I169 HydrophobicContact CG2-CG1 4Å; M137-I169 HydrophobicContact CE-CG2 3.84Å; M137-I169 HydrophobicContact SD-CD1 4.15Å; M137-I169 HydrophobicContact SD-CG2 3.91Å; I150-I169 HydrophobicContact CD1-CD1 3.57Å; L161-I169 HydrophobicContact CD1-CG2 3.86Å; I169-V181 CarbonylContact O-C 3.6Å; I169-V181 WeakPolarHBondContact O-CA 3.36Å; I169-I182 HydrophobicContact CB-CB 4.42Å; I169-I182 PolarHBondContact N-O 3.46Å; I169-I182 PolarHBondContact O-N 2.88Å
170	V	97.9	Very high	95.6	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	125	176	-176.4	0	0	0	0	109.5	L161 A162 T164 V179 F180 V181 I204 I206 F211	L161-V170 WeakPolarHBondContact CA-O 3.12Å; A162-V170 PolarHBondContact N-O 3.42Å; A162-V170 PolarHBondContact O-N 3.23Å; T164-V170 HydrophobicContact CG2-CG2 3.69Å; V170-V179 HydrophobicContact CG1-CG1 3.61Å; V170-F180 CarbonylContact C-O 3.24Å; V170-F180 VanDerWaalsContact CA-O 3.26Å; V170-F180 WeakPolarHBondContact CA-O 3.37Å; V170-V181 HydrophobicContact CG2-CB 4.49Å; V170-V181 HydrophobicContact CG2-CG1 4.25Å; V170-V181 HydrophobicContact CG2-CG2 4.06Å; V170-I204 HydrophobicContact CG1-CD1 3.76Å; V170-I206 HydrophobicContact CB-CD1 3.53Å; V170-I206 HydrophobicContact CG1-CD1 3.87Å; V170-I206 HydrophobicContact CG2-CD1 3.37Å; V170-F211 HydrophobicContact CG1-CD1 4.08Å; V170-F211 HydrophobicContact CG1-CE1 3.75Å; V170-F211 HydrophobicContact CG2-CE1 4Å
171	A	97.5	Very high	95.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	137.2	179.7	0	0	0	0	0	110	M137 I155 V158 G160 L161 F180	M137-A171 HydrophobicContact CE-CB 4.22Å; I155-A171 HydrophobicContact CD1-CB 3.74Å; V158-A171 HydrophobicContact CG1-CB 4.29Å; G160-A171 WeakPolarHBondContact O-CA 3.28Å; L161-A171 HydrophobicContact CD1-CB 4.16Å; A171-F180 PolarHBondContact N-O 2.77Å; A171-F180 PolarHBondContact O-N 2.75Å
172	V	97.4	Very high	95.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	121.5	173.1	-171.1	0	0	0	0	108.3	V158 A159 G160 T178 V179 P201 I204 V213	V158-V172 WeakPolarHBondContact CA-O 3.5Å; A159-V172 PolarHBondContact N-O 2.79Å; G160-V172 PolarHBondContact O-N 2.83Å; V172-T178 WeakPolarHBondContact CA-O 2.88Å; V172-V179 HydrophobicContact CG2-CG2 4.2Å; V172-P201 HydrophobicContact CG1-CB 3.62Å; V172-P201 HydrophobicContact CG1-CG 3.97Å; V172-I204 HydrophobicContact CG2-CB 3.84Å; V172-I204 HydrophobicContact CG2-CD1 3.57Å; V172-I204 HydrophobicContact CG2-CG1 4.23Å; V172-I204 HydrophobicContact CG2-CG2 4.03Å; V172-V213 HydrophobicContact CG1-CG1 4.12Å; V172-V213 HydrophobicContact CG2-CG1 4.37Å
173	D	95.6	Very high	95.4	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.016	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	141	170.7	-176.4	45.2	0	0	0	110.6	I155 D156 I157 V175 S176 P177 T178 F180 P201	I155-D173 HydrophobicContact CG2-CB 4.13Å; D156-D173 PolarHBondContact N-OD1 3.18Å; D156-D173 VanDerWaalsContact N-OD1 3.14Å; I157-D173 PolarHBondContact N-OD1 2.86Å; I157-D173 CarbonylContact O-C 3.53Å; I157-D173 WeakPolarHBondContact O-CA 3.37Å; I157-D173 VanDerWaalsContact O-OD1 3.12Å; D173-V175 PolarHBondContact OD2-N 3.23Å; D173-S176 PolarHBondContact OD2-N 3.31Å; D173-P177 WeakPolarHBondContact O-CA 3.41Å; D173-T178 PolarHBondContact N-O 3.46Å; D173-F180 HydrophobicContact CB-CE2 3.95Å; D173-P201 WeakPolarHBondContact O-CG 3.23Å
174	S	92.4	Very high	95.1	Very high	39 Å²	39	30.7 Å²	30.7	27%	0.273	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-14.3	179.8	85.9	0	0	0	0	114.3	I157	I157-S174 WeakPolarHBondContact CB-OG 3.47Å; I157-S174 WeakPolarHBondContact CG2-OG 3.45Å; I157-S174 PolarHBondContact O-N 3.41Å
175	V	91.7	Very high	94.9	Very high	79 Å²	79	35.7 Å²	35.7	48%	0.479	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-45.9	-177.7	178.8	0	0	0	0	110	D156 I157 D173	D156-V175 HydrophobicContact CB-CB 3.94Å; D156-V175 HydrophobicContact CB-CG2 3.6Å; I157-V175 HydrophobicContact CB-CG2 4.19Å; I157-V175 HydrophobicContact CD1-CG2 3.82Å; I157-V175 HydrophobicContact CG1-CG2 3.87Å; D173-V175 PolarHBondContact OD2-N 3.23Å
176	S	92.1	Very high	94.8	Very high	68 Å²	68	31.1 Å²	31.1	48%	0.476	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.8	93.7	168.4	-63.7	0	0	0	0	107.2	D173 T178	D173-S176 PolarHBondContact OD2-N 3.31Å; S176-T178 VanDerWaalsContact O-CB 3.29Å; S176-T178 WeakPolarHBondContact O-CB 3.27Å; S176-T178 PolarHBondContact O-N 2.86Å; S176-T178 PolarHBondContact O-OG1 2.62Å
177	P	95.6	Very high	94.9	Very high	15 Å²	15	29.6 Å²	29.6	10%	0.097	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	102.2	-171.1	-27	33.2	0	0	0	112.5	D173 C194 S195 M198 P201	D173-P177 WeakPolarHBondContact O-CA 3.41Å; P177-C194 CarbonylContact O-C 3.56Å; P177-C194 PolarHBondContact O-N 3.19Å; P177-C194 PolarHBondContact O-SG 2.92Å; P177-S195 PolarHBondContact O-N 2.88Å; P177-M198 HydrophobicContact CB-CG 3.54Å; P177-M198 HydrophobicContact CB-SD 3.76Å; P177-M198 HydrophobicContact CG-CG 4.15Å; P177-P201 HydrophobicContact CB-CG 4.35Å
178	T	97.2	Very high	94.9	Very high	12 Å²	12	32.6 Å²	32.6	7%	0.074	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	135.5	-171.6	-56.1	0	0	0	0	107.7	V172 D173 S176 F180 W191 F192	V172-T178 WeakPolarHBondContact CA-O 2.88Å; D173-T178 PolarHBondContact N-O 3.46Å; S176-T178 VanDerWaalsContact O-CB 3.29Å; S176-T178 WeakPolarHBondContact O-CB 3.27Å; S176-T178 PolarHBondContact O-N 2.86Å; S176-T178 PolarHBondContact O-OG1 2.62Å; T178-F180 HydrophobicContact CG2-CD1 4.49Å; T178-F180 HydrophobicContact CG2-CD2 4.11Å; T178-F180 HydrophobicContact CG2-CE1 3.96Å; T178-F180 HydrophobicContact CG2-CE2 3.54Å; T178-F180 HydrophobicContact CG2-CZ 3.45Å; T178-F180 VanDerWaalsContact CG2-CZ 3.45Å; T178-W191 HydrophobicContact CG2-CB 4.44Å; T178-W191 HydrophobicContact CG2-CE3 3.75Å; T178-W191 HydrophobicContact CG2-CZ3 4.48Å; T178-F192 WeakPolarHBondContact CA-O 3.34Å; T178-F192 WeakPolarHBondContact CG2-O 3.41Å
179	V	98.1	Very high	94.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	127.4	173.1	-178.5	0	0	0	0	108.7	V170 V172 W191 F192 I204 F211 V213	V170-V179 HydrophobicContact CG1-CG1 3.61Å; V172-V179 HydrophobicContact CG2-CG2 4.2Å; V179-W191 CarbonylContact O-C 3.55Å; V179-W191 WeakPolarHBondContact O-CA 3.26Å; V179-W191 WeakPolarHBondContact O-CB 3.5Å; V179-F192 HydrophobicContact CB-CD1 4.16Å; V179-F192 HydrophobicContact CB-CD2 4.12Å; V179-F192 HydrophobicContact CB-CE1 3.7Å; V179-F192 HydrophobicContact CB-CE2 3.66Å; V179-F192 HydrophobicContact CB-CG 4.36Å; V179-F192 HydrophobicContact CB-CZ 3.43Å; V179-F192 VanDerWaalsContact CB-CZ 3.43Å; V179-F192 HydrophobicContact CG1-CE1 3.78Å; V179-F192 HydrophobicContact CG1-CE2 4.44Å; V179-F192 HydrophobicContact CG1-CZ 3.73Å; V179-F192 HydrophobicContact CG2-CD2 4.22Å; V179-F192 HydrophobicContact CG2-CE1 4.29Å; V179-F192 HydrophobicContact CG2-CE2 3.45Å; V179-F192 VanDerWaalsContact CG2-CE2 3.45Å; V179-F192 HydrophobicContact CG2-CZ 3.5Å; V179-F192 PolarHBondContact N-O 3.01Å; V179-F192 PolarHBondContact O-N 3.38Å; V179-I204 HydrophobicContact CG1-CD1 4.31Å; V179-F211 HydrophobicContact CG1-CD1 3.86Å; V179-F211 HydrophobicContact CG1-CE1 4.11Å; V179-V213 HydrophobicContact CG2-CG2 4.04Å
180	F	97.3	Very high	94.7	Very high	15 Å²	15	37.6 Å²	37.6	7%	0.066	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.6	175.5	-62	-88.9	0	0	0	109.9	Y154 I155 V170 A171 D173 T178 I182 L188 W191	Y154-F180 HydrophobicContact CG-CE1 4.49Å; I155-F180 HydrophobicContact CD1-CB 4.08Å; I155-F180 HydrophobicContact CD1-CD2 3.77Å; I155-F180 HydrophobicContact CD1-CE2 4.42Å; I155-F180 HydrophobicContact CD1-CG 3.99Å; I155-F180 HydrophobicContact CG1-CD2 3.57Å; I155-F180 HydrophobicContact CG1-CE2 3.72Å; I155-F180 HydrophobicContact CG1-CG 4.04Å; I155-F180 HydrophobicContact CG1-CZ 4.31Å; V170-F180 CarbonylContact C-O 3.24Å; V170-F180 VanDerWaalsContact CA-O 3.26Å; V170-F180 WeakPolarHBondContact CA-O 3.37Å; A171-F180 PolarHBondContact N-O 2.77Å; A171-F180 PolarHBondContact O-N 2.75Å; D173-F180 HydrophobicContact CB-CE2 3.95Å; T178-F180 HydrophobicContact CG2-CD1 4.49Å; T178-F180 HydrophobicContact CG2-CD2 4.11Å; T178-F180 HydrophobicContact CG2-CE1 3.96Å; T178-F180 HydrophobicContact CG2-CE2 3.54Å; T178-F180 HydrophobicContact CG2-CZ 3.45Å; T178-F180 VanDerWaalsContact CG2-CZ 3.45Å; F180-I182 HydrophobicContact CB-CD1 4.28Å; F180-I182 HydrophobicContact CB-CG1 4.3Å; F180-L188 HydrophobicContact CB-CD1 4.32Å; F180-L188 HydrophobicContact CD1-CD1 3.88Å; F180-W191 HydrophobicContact CD1-CB 3.72Å; F180-W191 HydrophobicContact CD1-CG 4.49Å; F180-W191 HydrophobicContact CE1-CB 4.07Å; F180-W191 HydrophobicContact CE1-CG 4.47Å; F180-W191 HydrophobicContact CG-CB 4.42Å
181	V	96.9	Very high	94.6	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.024	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	121	171.1	-174.9	0	0	0	0	108	H168 I169 V170 V189 R190 F211	H168-V181 HydrophobicContact CB-CG1 3.63Å; I169-V181 CarbonylContact O-C 3.6Å; I169-V181 WeakPolarHBondContact O-CA 3.36Å; V170-V181 HydrophobicContact CG2-CB 4.49Å; V170-V181 HydrophobicContact CG2-CG1 4.25Å; V170-V181 HydrophobicContact CG2-CG2 4.06Å; V181-V189 HydrophobicContact CB-CB 4.5Å; V181-V189 HydrophobicContact CG1-CB 4.24Å; V181-V189 WeakPolarHBondContact O-CB 3.33Å; V181-V189 PolarHBondContact O-N 2.88Å; V181-R190 HydrophobicContact CB-CG 3.49Å; V181-R190 VanDerWaalsContact CB-CG 3.49Å; V181-R190 HydrophobicContact CG1-CG 4.22Å; V181-R190 HydrophobicContact CG2-CG 3.55Å; V181-R190 PolarHBondContact N-O 3.26Å; V181-R190 PolarHBondContact O-N 2.82Å; V181-F211 HydrophobicContact CG2-CE1 3.91Å; V181-F211 HydrophobicContact CG2-CZ 4.02Å
182	I	95.9	Very high	94.6	Very high	8 Å²	8	45.3 Å²	45.3	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	136.2	-168.8	-54.1	162.1	0	0	0	107.9	M137 I150 I152 I155 H168 I169 F180 E187 L188	M137-I182 HydrophobicContact CE-CD1 4.39Å; I150-I182 HydrophobicContact CG2-CG2 4.17Å; I152-I182 HydrophobicContact CG2-CD1 3.97Å; I155-I182 HydrophobicContact CD1-CD1 4.06Å; H168-I182 CarbonylContact C-O 3.6Å; H168-I182 WeakPolarHBondContact CA-O 3.44Å; I169-I182 HydrophobicContact CB-CB 4.42Å; I169-I182 PolarHBondContact N-O 3.46Å; I169-I182 PolarHBondContact O-N 2.88Å; F180-I182 HydrophobicContact CB-CD1 4.28Å; F180-I182 HydrophobicContact CB-CG1 4.3Å; I182-E187 CarbonylContact C-O 3.47Å; I182-E187 WeakPolarHBondContact CA-O 3.44Å; I182-L188 HydrophobicContact CG1-CD1 4.38Å
183	S	94.3	Very high	94.6	Very high	11 Å²	11	49.1 Å²	49.1	8%	0.077	25%	0.254	C	S	.	.			trans	-68.8	168.4	174.6	87.7	0	0	0	0	110.7	E185 G186 E187	S183-E185 WeakPolarHBondContact CB-OE2 3.43Å; S183-E185 PolarHBondContact O-N 2.96Å; S183-E185 WeakPolarHBondContact OG-CB 3.39Å; S183-E185 PolarHBondContact OG-N 2.78Å; S183-E185 VanDerWaalsContact OG-N 3.14Å; S183-E185 PolarHBondContact OG-OE2 2.78Å; S183-G186 PolarHBondContact O-N 2.78Å; S183-G186 VanDerWaalsContact O-N 3.14Å; S183-G186 PolarHBondContact OG-N 2.68Å; S183-E187 PolarHBondContact N-O 2.83Å; S183-E187 PolarHBondContact OG-N 3.21Å
184	E	92.1	Very high	94.6	Very high	26 Å²	26	49 Å²	49	12%	0.121	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-36.9	173.6	-162.1	-163.1	125.3	0	0	110.4	M119 N122 K124 I139 R148 I150 G186	M119-E184 HydrophobicContact CE-CB 3.79Å; M119-E184 HydrophobicContact CE-CG 3.47Å; M119-E184 VanDerWaalsContact CE-CG 3.47Å; M119-E184 WeakPolarHBondContact CE-OE2 3.18Å; M119-E184 HydrophobicContact SD-CG 3.66Å; N122-E184 PolarHBondContact ND2-OE2 3.36Å; K124-E184 IonicContact NZ-OE1 3.04Å; K124-E184 PolarHBondContact NZ-OE1 3.1Å; K124-E184 IonicContact NZ-OE2 3.72Å; K124-E184 PolarHBondContact NZ-OE2 2.78Å; I139-E184 HydrophobicContact CD1-CG 3.68Å; R148-E184 IonicContact CZ-OE1 3.79Å; R148-E184 PolarHBondContact NH1-O 3.23Å; R148-E184 VanDerWaalsContact NH2-CG 3.28Å; R148-E184 PolarHBondContact NH2-O 2.74Å; R148-E184 IonicContact NH2-OE1 3.63Å; R148-E184 PolarHBondContact NH2-OE1 3.42Å; I150-E184 WeakPolarHBondContact CD1-O 3.49Å; E184-G186 PolarHBondContact O-N 2.9Å
185	E	91	Very high	94.8	Very high	125 Å²	125	49.4 Å²	49.4	58%	0.584	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-18.3	-179.5	-61.2	65.6	-138.5	0	0	112.7	R148 S183	R148-E185 VanDerWaalsContact NH1-CA 3.32Å; S183-E185 WeakPolarHBondContact CB-OE2 3.43Å; S183-E185 PolarHBondContact O-N 2.96Å; S183-E185 WeakPolarHBondContact OG-CB 3.39Å; S183-E185 PolarHBondContact OG-N 2.78Å; S183-E185 VanDerWaalsContact OG-N 3.14Å; S183-E185 PolarHBondContact OG-OE2 2.78Å
186	G	89.8	Confident	95	Very high	18 Å²	18	52.6 Å²	52.6	19%	0.186	27%	0.271	C	S	.	.	S	Bend	trans	98.1	8.9	-178.8	0	0	0	0	0	114.2	S183 E184	S183-G186 PolarHBondContact O-N 2.78Å; S183-G186 VanDerWaalsContact O-N 3.14Å; S183-G186 PolarHBondContact OG-N 2.68Å; E184-G186 PolarHBondContact O-N 2.9Å
187	E	92.1	Very high	95.2	Very high	135 Å²	135	53.6 Å²	53.6	63%	0.631	27%	0.265	S	S	*	.			trans	-76	135.9	175	-62	-55.7	141.2	0	0	110.3	I182 S183 V189	I182-E187 CarbonylContact C-O 3.47Å; I182-E187 WeakPolarHBondContact CA-O 3.44Å; S183-E187 PolarHBondContact N-O 2.83Å; S183-E187 PolarHBondContact OG-N 3.21Å; E187-V189 PolarHBondContact O-N 2.82Å
188	L	94.5	Very high	95.1	Very high	69 Å²	69	53.4 Å²	53.4	36%	0.361	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	108.6	174.2	-178.1	62.7	0	0	0	108.8	Y154 F180 I182 R190 W191	Y154-L188 HydrophobicContact CD2-CD2 4.45Å; Y154-L188 HydrophobicContact CE2-CD2 4.37Å; F180-L188 HydrophobicContact CB-CD1 4.32Å; F180-L188 HydrophobicContact CD1-CD1 3.88Å; I182-L188 HydrophobicContact CG1-CD1 4.38Å; L188-R190 WeakPolarHBondContact CD1-O 3.3Å; L188-W191 HydrophobicContact CD1-CB 4.41Å; L188-W191 HydrophobicContact CD2-CG 4.48Å
189	V	94.7	Very high	95	Very high	73 Å²	73	60.9 Å²	60.9	44%	0.442	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-45.5	179.8	179.1	0	0	0	0	109.9	V181 E187	V181-V189 HydrophobicContact CB-CB 4.5Å; V181-V189 HydrophobicContact CG1-CB 4.24Å; V181-V189 WeakPolarHBondContact O-CB 3.33Å; V181-V189 PolarHBondContact O-N 2.88Å; E187-V189 PolarHBondContact O-N 2.82Å
190	R	94.7	Very high	94.9	Very high	89 Å²	89	64.8 Å²	64.8	34%	0.336	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	165.4	177.3	55.3	171.4	21.4	150.6	-18.8	110.7	V181 L188 D226	V181-R190 HydrophobicContact CB-CG 3.49Å; V181-R190 VanDerWaalsContact CB-CG 3.49Å; V181-R190 HydrophobicContact CG1-CG 4.22Å; V181-R190 HydrophobicContact CG2-CG 3.55Å; V181-R190 PolarHBondContact N-O 3.26Å; V181-R190 PolarHBondContact O-N 2.82Å; L188-R190 WeakPolarHBondContact CD1-O 3.3Å; R190-D226 WeakPolarHBondContact CD-O 3.46Å; R190-D226 IonicContact CZ-OD2 3.01Å; R190-D226 PolarHBondContact NE-O 2.79Å; R190-D226 VanDerWaalsContact NH1-CG 3.25Å; R190-D226 PolarHBondContact NH1-O 2.83Å; R190-D226 IonicContact NH1-OD2 2.94Å; R190-D226 PolarHBondContact NH1-OD2 3.14Å; R190-D226 PolarHBondContact NH2-O 3.27Å; R190-D226 IonicContact NH2-OD2 3.98Å
191	W	96.7	Very high	94.9	Very high	149 Å²	149	64.4 Å²	64.4	56%	0.564	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.9	158.7	170	64.5	-80.5	0	0	0	109.7	T178 V179 F180 L188 D193	T178-W191 HydrophobicContact CG2-CB 4.44Å; T178-W191 HydrophobicContact CG2-CE3 3.75Å; T178-W191 HydrophobicContact CG2-CZ3 4.48Å; V179-W191 CarbonylContact O-C 3.55Å; V179-W191 WeakPolarHBondContact O-CA 3.26Å; V179-W191 WeakPolarHBondContact O-CB 3.5Å; F180-W191 HydrophobicContact CD1-CB 3.72Å; F180-W191 HydrophobicContact CD1-CG 4.49Å; F180-W191 HydrophobicContact CE1-CB 4.07Å; F180-W191 HydrophobicContact CE1-CG 4.47Å; F180-W191 HydrophobicContact CG-CB 4.42Å; L188-W191 HydrophobicContact CD1-CB 4.41Å; L188-W191 HydrophobicContact CD2-CG 4.48Å; W191-D193 HydrophobicContact CZ3-CB 4.3Å
192	F	97.6	Very high	94.9	Very high	14 Å²	14	65.3 Å²	65.3	6%	0.061	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	138.5	169.1	57.7	-95.5	0	0	0	110.3	T178 V179 C194 F211 F224	T178-F192 WeakPolarHBondContact CA-O 3.34Å; T178-F192 WeakPolarHBondContact CG2-O 3.41Å; V179-F192 HydrophobicContact CB-CD1 4.16Å; V179-F192 HydrophobicContact CB-CD2 4.12Å; V179-F192 HydrophobicContact CB-CE1 3.7Å; V179-F192 HydrophobicContact CB-CE2 3.66Å; V179-F192 HydrophobicContact CB-CG 4.36Å; V179-F192 HydrophobicContact CB-CZ 3.43Å; V179-F192 VanDerWaalsContact CB-CZ 3.43Å; V179-F192 HydrophobicContact CG1-CE1 3.78Å; V179-F192 HydrophobicContact CG1-CE2 4.44Å; V179-F192 HydrophobicContact CG1-CZ 3.73Å; V179-F192 HydrophobicContact CG2-CD2 4.22Å; V179-F192 HydrophobicContact CG2-CE1 4.29Å; V179-F192 HydrophobicContact CG2-CE2 3.45Å; V179-F192 VanDerWaalsContact CG2-CE2 3.45Å; V179-F192 HydrophobicContact CG2-CZ 3.5Å; V179-F192 PolarHBondContact N-O 3.01Å; V179-F192 PolarHBondContact O-N 3.38Å; F192-C194 HydrophobicContact CD2-CB 4.35Å; F192-C194 HydrophobicContact CE2-CB 4.4Å; F192-F211 HydrophobicContact CE1-CD1 4.31Å; F192-F211 HydrophobicContact CE1-CG 4.35Å; F192-F211 HydrophobicContact CZ-CB 4.13Å; F192-F211 HydrophobicContact CZ-CD1 4.26Å; F192-F211 HydrophobicContact CZ-CG 4.15Å; F192-F224 HydrophobicContact CE2-CB 3.82Å; F192-F224 HydrophobicContact CE2-CD1 4.08Å; F192-F224 HydrophobicContact CE2-CD2 4.08Å; F192-F224 AromaticContact CE2-CG 3.73Å; F192-F224 HydrophobicContact CE2-CG 3.73Å; F192-F224 HydrophobicContact CZ-CB 3.89Å; F192-F224 HydrophobicContact CZ-CG 4.26Å
193	D	96.4	Very high	95	Very high	79 Å²	79	65.4 Å²	65.4	42%	0.422	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	137.2	172	-177.1	10.8	0	0	0	109.2	W191 S195	W191-D193 HydrophobicContact CZ3-CB 4.3Å; D193-S195 VanDerWaalsContact CG-OG 3.3Å; D193-S195 WeakPolarHBondContact OD1-CB 3.42Å; D193-S195 PolarHBondContact OD1-N 3Å; D193-S195 PolarHBondContact OD1-OG 3.33Å; D193-S195 PolarHBondContact OD2-OG 2.92Å; D193-S195 VanDerWaalsContact OD2-OG 3.12Å
194	C	95.8	Very high	95.2	Very high	1 Å²	1	64.9 Å²	64.9	1%	0.007	31%	0.31	C	S	.	.			trans	-132.2	13.6	178.3	57.7	0	0	0	0	112.4	P177 F192 D196 Y197 M198 F224	P177-C194 CarbonylContact O-C 3.56Å; P177-C194 PolarHBondContact O-N 3.19Å; P177-C194 PolarHBondContact O-SG 2.92Å; F192-C194 HydrophobicContact CD2-CB 4.35Å; F192-C194 HydrophobicContact CE2-CB 4.4Å; C194-D196 VanDerWaalsContact C-N 3.35Å; C194-D196 PolarHBondContact O-N 2.94Å; C194-Y197 WeakPolarHBondContact O-CA 3.05Å; C194-Y197 PolarHBondContact O-N 2.74Å; C194-M198 HydrophobicContact CB-CE 3.46Å; C194-M198 VanDerWaalsContact CB-CE 3.46Å; C194-M198 HydrophobicContact CB-SD 4.33Å; C194-M198 WeakPolarHBondContact O-CG 3.35Å; C194-M198 PolarHBondContact O-N 3.04Å; C194-M198 WeakPolarHBondContact SG-CE 3.44Å; C194-M198 PolarHBondContact SG-SD 2.81Å; C194-F224 HydrophobicContact CB-CE1 3.92Å; C194-F224 HydrophobicContact CB-CE2 4.15Å; C194-F224 HydrophobicContact CB-CZ 3.61Å
195	S	95.4	Very high	95.5	Very high	47 Å²	47	63.9 Å²	63.9	33%	0.329	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-60.3	-35.7	-178.5	62	0	0	0	0	114.2	P177 D193 Y197 M198	P177-S195 PolarHBondContact O-N 2.88Å; D193-S195 VanDerWaalsContact CG-OG 3.3Å; D193-S195 WeakPolarHBondContact OD1-CB 3.42Å; D193-S195 PolarHBondContact OD1-N 3Å; D193-S195 PolarHBondContact OD1-OG 3.33Å; D193-S195 PolarHBondContact OD2-OG 2.92Å; D193-S195 VanDerWaalsContact OD2-OG 3.12Å; S195-Y197 PolarHBondContact O-N 3.29Å; S195-Y197 VanDerWaalsContact O-N 3.17Å; S195-M198 PolarHBondContact O-N 2.92Å
196	D	96.3	Very high	95.8	Very high	147 Å²	147	59.7 Å²	59.7	79%	0.786	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-64.6	-18.9	173.9	-73.3	-28.2	0	0	0	113.2	C194	C194-D196 VanDerWaalsContact C-N 3.35Å; C194-D196 PolarHBondContact O-N 2.94Å
197	Y	96.4	Very high	96	Very high	89 Å²	89	60.8 Å²	60.8	35%	0.349	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-109.9	-6.6	-174.9	-58.4	-80.5	0	0	0	113.7	C194 S195 F224 F230 R233	C194-Y197 WeakPolarHBondContact O-CA 3.05Å; C194-Y197 PolarHBondContact O-N 2.74Å; S195-Y197 PolarHBondContact O-N 3.29Å; S195-Y197 VanDerWaalsContact O-N 3.17Å; Y197-F224 AromaticContact CD2-CE1 3.72Å; Y197-F224 HydrophobicContact CD2-CE1 3.72Å; Y197-F224 HydrophobicContact CD2-CZ 4.22Å; Y197-F224 HydrophobicContact CE2-CE1 4.34Å; Y197-F224 AromaticContact CG-CE1 3.99Å; Y197-F224 HydrophobicContact CG-CE1 3.99Å; Y197-F224 HydrophobicContact CG-CZ 4.16Å; Y197-F230 HydrophobicContact CD1-CB 4.02Å; Y197-F230 HydrophobicContact CD1-CD1 4Å; Y197-F230 AromaticContact CD1-CD2 3.49Å; Y197-F230 HydrophobicContact CD1-CD2 3.49Å; Y197-F230 VanDerWaalsContact CD1-CD2 3.49Å; Y197-F230 HydrophobicContact CD1-CE1 4.37Å; Y197-F230 AromaticContact CD1-CE2 3.91Å; Y197-F230 HydrophobicContact CD1-CE2 3.91Å; Y197-F230 AromaticContact CD1-CG 3.54Å; Y197-F230 HydrophobicContact CD1-CG 3.54Å; Y197-F230 HydrophobicContact CD1-CZ 4.32Å; Y197-F230 HydrophobicContact CD2-CB 4.38Å; Y197-F230 HydrophobicContact CE1-CB 3.56Å; Y197-F230 AromaticContact CE1-CD1 3.6Å; Y197-F230 HydrophobicContact CE1-CD1 3.6Å; Y197-F230 AromaticContact CE1-CD2 3.86Å; Y197-F230 HydrophobicContact CE1-CD2 3.86Å; Y197-F230 HydrophobicContact CE1-CE1 4.26Å; Y197-F230 HydrophobicContact CE1-CE2 4.48Å; Y197-F230 AromaticContact CE1-CG 3.36Å; Y197-F230 HydrophobicContact CE1-CG 3.36Å; Y197-F230 HydrophobicContact CE2-CB 3.95Å; Y197-F230 HydrophobicContact CG-CB 4.4Å; Y197-F230 AromaticContact CG-CD2 3.92Å; Y197-F230 HydrophobicContact CG-CD2 3.92Å; Y197-F230 HydrophobicContact CG-CG 4.21Å; Y197-F230 AromaticContact CZ-CG 3.91Å; Y197-R233 PolarHBondContact O-NH1 3.49Å; Y197-R233 PolarHBondContact O-NH2 2.91Å
198	M	93.8	Very high	95.9	Very high	11 Å²	11	60 Å²	60	5%	0.054	29%	0.286	C	S	.	.			trans	-146.7	147.5	-179.6	67.3	-168.1	62.6	0	0	114.3	P177 C194 S195 P201 V213 D215 A222 F224	P177-M198 HydrophobicContact CB-CG 3.54Å; P177-M198 HydrophobicContact CB-SD 3.76Å; P177-M198 HydrophobicContact CG-CG 4.15Å; C194-M198 HydrophobicContact CB-CE 3.46Å; C194-M198 VanDerWaalsContact CB-CE 3.46Å; C194-M198 HydrophobicContact CB-SD 4.33Å; C194-M198 WeakPolarHBondContact O-CG 3.35Å; C194-M198 PolarHBondContact O-N 3.04Å; C194-M198 WeakPolarHBondContact SG-CE 3.44Å; C194-M198 PolarHBondContact SG-SD 2.81Å; S195-M198 PolarHBondContact O-N 2.92Å; M198-P201 HydrophobicContact SD-CB 3.87Å; M198-P201 HydrophobicContact SD-CG 4.26Å; M198-V213 HydrophobicContact CE-CB 3.95Å; M198-V213 HydrophobicContact CE-CG1 3.76Å; M198-V213 HydrophobicContact CE-CG2 4.47Å; M198-V213 HydrophobicContact SD-CG1 3.8Å; M198-D215 VanDerWaalsContact CA-OD2 3.27Å; M198-D215 WeakPolarHBondContact CA-OD2 3.49Å; M198-D215 HydrophobicContact CB-CB 3.95Å; M198-A222 HydrophobicContact CE-CB 4.41Å; M198-F224 HydrophobicContact CE-CE2 3.69Å; M198-F224 HydrophobicContact CE-CZ 3.8Å
199	R	95.5	Very high	95.8	Very high	168 Å²	168	60.8 Å²	60.8	63%	0.634	29%	0.291	S	S	*	.	S	Bend	trans	-92.2	-43.2	-179.6	-66.8	-168.6	-73	-168.9	-8.2	113	D215 K217	R199-D215 VanDerWaalsContact N-CG 3.28Å; R199-D215 PolarHBondContact N-OD1 2.96Å; R199-D215 PolarHBondContact N-OD2 3.32Å; R199-K217 HydrophobicContact CB-CB 3.6Å; R199-K217 PolarHBondContact NE-O 2.95Å; R199-K217 PolarHBondContact NH2-O 2.9Å
200	E	96.5	Very high	95.9	Very high	83 Å²	83	57.9 Å²	57.9	39%	0.388	27%	0.273	S	S	.	.			trans	-153.2	100	-179.2	-172	177.9	154.3	0	0	110.1	D215 F216 K217	E200-D215 PolarHBondContact N-OD1 2.85Å; E200-D215 CarbonylContact O-C 3.56Å; E200-F216 HydrophobicContact CB-CB 4.34Å; E200-F216 HydrophobicContact CG-CB 4.4Å; E200-F216 WeakPolarHBondContact O-CB 3.28Å; E200-F216 PolarHBondContact O-N 3.37Å; E200-K217 HydrophobicContact CB-CB 3.94Å; E200-K217 HydrophobicContact CB-CG 3.57Å; E200-K217 HydrophobicContact CG-CG 4.37Å; E200-K217 WeakPolarHBondContact OE2-CE 3.32Å; E200-K217 WeakPolarHBondContact OE2-CG 3.03Å
201	P	97.3	Very high	96.1	Very high	6 Å²	6	54 Å²	54	4%	0.039	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	141.9	178.8	26.8	-33	0	0	0	111.5	A159 V172 D173 P177 M198 V213 C214	A159-P201 HydrophobicContact CB-CB 4.18Å; A159-P201 HydrophobicContact CB-CG 4.12Å; A159-P201 WeakPolarHBondContact CB-O 3.35Å; V172-P201 HydrophobicContact CG1-CB 3.62Å; V172-P201 HydrophobicContact CG1-CG 3.97Å; D173-P201 WeakPolarHBondContact O-CG 3.23Å; P177-P201 HydrophobicContact CB-CG 4.35Å; M198-P201 HydrophobicContact SD-CB 3.87Å; M198-P201 HydrophobicContact SD-CG 4.26Å; P201-V213 HydrophobicContact CB-CG1 4.14Å; P201-C214 CarbonylContact C-O 3.55Å; P201-C214 VanDerWaalsContact CA-O 3.23Å; P201-C214 WeakPolarHBondContact CA-O 3.43Å
202	S	97.1	Very high	96.2	Very high	23 Å²	23	47 Å²	47	16%	0.161	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	-27.5	-178.4	51.7	0	0	0	0	115.6	K115 A159 C214 P243	K115-S202 PolarHBondContact NZ-O 3.42Å; A159-S202 CarbonylContact O-C 3.59Å; S202-C214 PolarHBondContact N-O 3.24Å; S202-C214 WeakPolarHBondContact OG-CB 3.12Å; S202-P243 PolarHBondContact OG-O 3.48Å
203	D	97.9	Very high	96.2	Very high	10 Å²	10	46.3 Å²	46.3	5%	0.053	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	169.5	178	-145.9	20.6	0	0	0	111.3	K115 C214 G245 I246	K115-D203 IonicContact NZ-OD1 3.1Å; K115-D203 PolarHBondContact NZ-OD1 2.95Å; K115-D203 VanDerWaalsContact NZ-OD1 3.13Å; D203-C214 HydrophobicContact CB-CB 4.39Å; D203-C214 PolarHBondContact O-N 3.08Å; D203-G245 WeakPolarHBondContact OD2-CA 3.33Å; D203-I246 HydrophobicContact CB-CG2 4.18Å; D203-I246 PolarHBondContact OD2-N 3.21Å
204	I	98.4	Very high	96.3	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	142.2	-179.9	-171.3	170.9	0	0	0	111.6	A162 V170 V172 V179 I206 F211 Y212 V213	A162-I204 HydrophobicContact CB-CG2 3.93Å; V170-I204 HydrophobicContact CG1-CD1 3.76Å; V172-I204 HydrophobicContact CG2-CB 3.84Å; V172-I204 HydrophobicContact CG2-CD1 3.57Å; V172-I204 HydrophobicContact CG2-CG1 4.23Å; V172-I204 HydrophobicContact CG2-CG2 4.03Å; V179-I204 HydrophobicContact CG1-CD1 4.31Å; I204-I206 HydrophobicContact CD1-CG1 4.41Å; I204-I206 HydrophobicContact CG1-CG1 4.36Å; I204-F211 HydrophobicContact CD1-CD1 4.1Å; I204-Y212 WeakPolarHBondContact CA-O 3.23Å; I204-V213 HydrophobicContact CD1-CG2 4.02Å; I204-V213 HydrophobicContact CG1-CG2 4.2Å
205	A	98.1	Very high	96.4	Very high	5 Å²	5	42.6 Å²	42.6	4%	0.041	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	155.2	163.7	0	0	0	0	0	110.2	Y212 I246 I248	A205-Y212 PolarHBondContact N-O 2.82Å; A205-Y212 PolarHBondContact O-N 3.33Å; A205-I246 HydrophobicContact CB-CB 4.43Å; A205-I246 HydrophobicContact CB-CD1 4.32Å; A205-I246 HydrophobicContact CB-CG1 4Å; A205-I246 HydrophobicContact CB-CG2 3.85Å; A205-I248 HydrophobicContact CB-CD1 3.77Å; A205-I248 HydrophobicContact CB-CG1 3.79Å
206	I	97	Very high	96.5	Very high	36 Å²	36	43.1 Å²	43.1	19%	0.185	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	133	-175.9	-54.1	166.6	0	0	0	107.8	A162 T164 V170 I204 D210 F211	A162-I206 HydrophobicContact CB-CD1 3.85Å; A162-I206 HydrophobicContact CB-CG1 4.33Å; T164-I206 HydrophobicContact CG2-CD1 3.99Å; T164-I206 HydrophobicContact CG2-CG2 4.38Å; V170-I206 HydrophobicContact CB-CD1 3.53Å; V170-I206 HydrophobicContact CG1-CD1 3.87Å; V170-I206 HydrophobicContact CG2-CD1 3.37Å; I204-I206 HydrophobicContact CD1-CG1 4.41Å; I204-I206 HydrophobicContact CG1-CG1 4.36Å; I206-D210 WeakPolarHBondContact CA-O 3.45Å; I206-F211 HydrophobicContact CD1-CD1 4.29Å; I206-F211 HydrophobicContact CD1-CE1 4.07Å; I206-F211 HydrophobicContact CG1-CD1 4.14Å; I206-F211 HydrophobicContact CG1-CE1 4.35Å; I206-F211 HydrophobicContact CG2-CE2 4.49Å; I206-F211 HydrophobicContact CG2-CZ 4.49Å
207	R	93.9	Very high	96.5	Very high	42 Å²	42	40.4 Å²	40.4	16%	0.158	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	128.5	169.7	178.2	165	57.7	96	-8.5	109.1	N209 D210 Y212 I248 G252	R207-N209 PolarHBondContact O-N 3.41Å; R207-N209 VanDerWaalsContact O-N 3.1Å; R207-D210 PolarHBondContact N-O 3.13Å; R207-D210 VanDerWaalsContact N-O 3.08Å; R207-D210 PolarHBondContact O-N 3.32Å; R207-Y212 HydrophobicContact CB-CE2 4.46Å; R207-I248 HydrophobicContact CB-CD1 3.66Å; R207-I248 HydrophobicContact CB-CG2 4.31Å; R207-G252 VanDerWaalsContact NH2-CA 3.35Å; R207-G252 PolarHBondContact NH2-O 3.36Å
208	D	90.4	Very high	96.6	Very high	118 Å²	118	36.9 Å²	36.9	63%	0.631	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	-113.1	-174.7	-51.2	-43.7	0	0	0	111.1
209	N	92.4	Very high	96.8	Very high	85 Å²	85	37.8 Å²	37.8	46%	0.455	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	3.2	176.6	-67.5	-12.2	0	0	0	113	R207 F211 Q225 D226	R207-N209 PolarHBondContact O-N 3.41Å; R207-N209 VanDerWaalsContact O-N 3.1Å; N209-F211 WeakPolarHBondContact O-CD2 3.35Å; N209-Q225 CarbonylContact O-C 3.58Å; N209-D226 HydrophobicContact CB-CB 4.23Å; N209-D226 PolarHBondContact O-N 2.69Å
210	D	96.6	Very high	96.9	Very high	13 Å²	13	30.2 Å²	30.2	7%	0.07	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	130	-176.2	-60.9	-20.4	0	0	0	110.4	I206 R207 Y212 V223 F224 R271	I206-D210 WeakPolarHBondContact CA-O 3.45Å; R207-D210 PolarHBondContact N-O 3.13Å; R207-D210 VanDerWaalsContact N-O 3.08Å; R207-D210 PolarHBondContact O-N 3.32Å; D210-Y212 HydrophobicContact CB-CD2 4.26Å; D210-Y212 HydrophobicContact CB-CE2 3.41Å; D210-Y212 VanDerWaalsContact CB-CE2 3.41Å; D210-V223 HydrophobicContact CB-CG1 4.33Å; D210-F224 CarbonylContact C-O 3.51Å; D210-F224 WeakPolarHBondContact CA-O 3.4Å; D210-R271 IonicContact OD2-CZ 3.58Å; D210-R271 IonicContact OD2-NE 3.54Å; D210-R271 IonicContact OD2-NH2 2.77Å; D210-R271 PolarHBondContact OD2-NH2 3.43Å
211	F	98.2	Very high	97	Very high	8 Å²	8	26.2 Å²	26.2	4%	0.035	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	115.9	-179.2	-71	-113.6	0	0	0	108.9	V170 V179 V181 F192 I204 I206 N209 V223 F224 D226	V170-F211 HydrophobicContact CG1-CD1 4.08Å; V170-F211 HydrophobicContact CG1-CE1 3.75Å; V170-F211 HydrophobicContact CG2-CE1 4Å; V179-F211 HydrophobicContact CG1-CD1 3.86Å; V179-F211 HydrophobicContact CG1-CE1 4.11Å; V181-F211 HydrophobicContact CG2-CE1 3.91Å; V181-F211 HydrophobicContact CG2-CZ 4.02Å; F192-F211 HydrophobicContact CE1-CD1 4.31Å; F192-F211 HydrophobicContact CE1-CG 4.35Å; F192-F211 HydrophobicContact CZ-CB 4.13Å; F192-F211 HydrophobicContact CZ-CD1 4.26Å; F192-F211 HydrophobicContact CZ-CG 4.15Å; I204-F211 HydrophobicContact CD1-CD1 4.1Å; I206-F211 HydrophobicContact CD1-CD1 4.29Å; I206-F211 HydrophobicContact CD1-CE1 4.07Å; I206-F211 HydrophobicContact CG1-CD1 4.14Å; I206-F211 HydrophobicContact CG1-CE1 4.35Å; I206-F211 HydrophobicContact CG2-CE2 4.49Å; I206-F211 HydrophobicContact CG2-CZ 4.49Å; N209-F211 WeakPolarHBondContact O-CD2 3.35Å; F211-V223 CarbonylContact O-C 3.46Å; F211-V223 WeakPolarHBondContact O-CA 3.42Å; F211-F224 HydrophobicContact CB-CB 4.4Å; F211-F224 PolarHBondContact N-O 2.9Å; F211-F224 PolarHBondContact O-N 3.03Å; F211-D226 HydrophobicContact CD2-CB 4.37Å; F211-D226 HydrophobicContact CE2-CB 3.62Å; F211-D226 HydrophobicContact CZ-CB 4.44Å
212	Y	98.5	Very high	97	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	102.4	-176.3	-61.2	-106.4	0	0	0	108.6	I204 A205 R207 D210 V221 V223 I234 I246 I248 V254	I204-Y212 WeakPolarHBondContact CA-O 3.23Å; A205-Y212 PolarHBondContact N-O 2.82Å; A205-Y212 PolarHBondContact O-N 3.33Å; R207-Y212 HydrophobicContact CB-CE2 4.46Å; D210-Y212 HydrophobicContact CB-CD2 4.26Å; D210-Y212 HydrophobicContact CB-CE2 3.41Å; D210-Y212 VanDerWaalsContact CB-CE2 3.41Å; Y212-V221 HydrophobicContact CD1-CG1 4.38Å; Y212-V223 HydrophobicContact CD1-CB 4.44Å; Y212-V223 HydrophobicContact CD1-CG1 4.02Å; Y212-V223 HydrophobicContact CD1-CG2 3.63Å; Y212-V223 HydrophobicContact CE1-CG1 3.83Å; Y212-V223 HydrophobicContact CE1-CG2 3.86Å; Y212-V223 HydrophobicContact CE2-CG1 4.41Å; Y212-V223 HydrophobicContact CG-CG1 4.38Å; Y212-V223 HydrophobicContact CG-CG2 4.43Å; Y212-I234 HydrophobicContact CD1-CD1 4.11Å; Y212-I234 HydrophobicContact CE1-CD1 4.01Å; Y212-I246 HydrophobicContact CG-CD1 4.49Å; Y212-I248 HydrophobicContact CD2-CD1 3.29Å; Y212-I248 HydrophobicContact CD2-CG1 4.43Å; Y212-I248 HydrophobicContact CE2-CD1 3.46Å; Y212-I248 VanDerWaalsContact CE2-CD1 3.46Å; Y212-I248 HydrophobicContact CG-CD1 3.9Å; Y212-V254 HydrophobicContact CD1-CG1 4.16Å; Y212-V254 HydrophobicContact CD1-CG2 4.06Å; Y212-V254 HydrophobicContact CE1-CG2 3.64Å
213	V	98.5	Very high	97.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	119.5	-175.5	-171.7	0	0	0	0	109.7	V172 V179 M198 P201 I204 D215 V221 A222 F224	V172-V213 HydrophobicContact CG1-CG1 4.12Å; V172-V213 HydrophobicContact CG2-CG1 4.37Å; V179-V213 HydrophobicContact CG2-CG2 4.04Å; M198-V213 HydrophobicContact CE-CB 3.95Å; M198-V213 HydrophobicContact CE-CG1 3.76Å; M198-V213 HydrophobicContact CE-CG2 4.47Å; M198-V213 HydrophobicContact SD-CG1 3.8Å; P201-V213 HydrophobicContact CB-CG1 4.14Å; I204-V213 HydrophobicContact CD1-CG2 4.02Å; I204-V213 HydrophobicContact CG1-CG2 4.2Å; V213-D215 PolarHBondContact O-N 2.76Å; V213-V221 CarbonylContact O-C 3.34Å; V213-V221 VanDerWaalsContact O-CA 3.31Å; V213-V221 WeakPolarHBondContact O-CA 3.32Å; V213-A222 PolarHBondContact N-O 2.82Å; V213-A222 PolarHBondContact O-N 2.91Å; V213-F224 HydrophobicContact CB-CE2 4.44Å; V213-F224 HydrophobicContact CG2-CD2 4.21Å; V213-F224 HydrophobicContact CG2-CE2 4.24Å
214	C	98.3	Very high	97.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	127.9	173.3	-69.8	0	0	0	0	110.6	P201 S202 D203 P243 I246	P201-C214 CarbonylContact C-O 3.55Å; P201-C214 VanDerWaalsContact CA-O 3.23Å; P201-C214 WeakPolarHBondContact CA-O 3.43Å; S202-C214 PolarHBondContact N-O 3.24Å; S202-C214 WeakPolarHBondContact OG-CB 3.12Å; D203-C214 HydrophobicContact CB-CB 4.39Å; D203-C214 PolarHBondContact O-N 3.08Å; C214-P243 HydrophobicContact CB-CB 4.35Å; C214-P243 HydrophobicContact CB-CG 4.26Å; C214-I246 VanDerWaalsContact SG-CB 3.52Å; C214-I246 VanDerWaalsContact SG-CG2 3.52Å
215	D	97.9	Very high	97	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.016	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	100.3	167.6	-177.3	-0.1	0	0	0	109.5	M198 R199 E200 V213 K217 G218 H219 C220 P243	M198-D215 VanDerWaalsContact CA-OD2 3.27Å; M198-D215 WeakPolarHBondContact CA-OD2 3.49Å; M198-D215 HydrophobicContact CB-CB 3.95Å; R199-D215 VanDerWaalsContact N-CG 3.28Å; R199-D215 PolarHBondContact N-OD1 2.96Å; R199-D215 PolarHBondContact N-OD2 3.32Å; E200-D215 PolarHBondContact N-OD1 2.85Å; E200-D215 CarbonylContact O-C 3.56Å; V213-D215 PolarHBondContact O-N 2.76Å; D215-K217 PolarHBondContact O-N 3.22Å; D215-K217 PolarHBondContact OD1-N 2.85Å; D215-G218 CarbonylContact O-C 3.56Å; D215-G218 PolarHBondContact O-N 3.29Å; D215-G218 PolarHBondContact OD1-N 3.14Å; D215-G218 WeakPolarHBondContact OD2-CA 3.45Å; D215-G218 PolarHBondContact OD2-N 2.87Å; D215-H219 PolarHBondContact O-N 3.34Å; D215-C220 PolarHBondContact N-O 2.87Å; D215-C220 PolarHBondContact O-N 3.14Å; D215-P243 WeakPolarHBondContact O-CD 3.39Å; D215-P243 WeakPolarHBondContact O-CG 3.22Å
216	F	97.5	Very high	96.8	Very high	57 Å²	57	29.5 Å²	29.5	25%	0.25	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-47.9	-179.3	-178.4	-98.5	0	0	0	111.7	E200 F242	E200-F216 HydrophobicContact CB-CB 4.34Å; E200-F216 HydrophobicContact CG-CB 4.4Å; E200-F216 WeakPolarHBondContact O-CB 3.28Å; E200-F216 PolarHBondContact O-N 3.37Å; F216-F242 HydrophobicContact CD1-CD1 4Å; F216-F242 HydrophobicContact CD2-CB 3.87Å; F216-F242 HydrophobicContact CE1-CB 4.35Å; F216-F242 AromaticContact CE1-CD1 3.63Å; F216-F242 HydrophobicContact CE1-CD1 3.63Å; F216-F242 HydrophobicContact CE1-CE1 4.35Å; F216-F242 HydrophobicContact CE1-CG 4.38Å; F216-F242 HydrophobicContact CE2-CB 3.55Å; F216-F242 HydrophobicContact CE2-CD1 4.37Å; F216-F242 HydrophobicContact CE2-CG 4.37Å; F216-F242 HydrophobicContact CG-CB 4.42Å; F216-F242 HydrophobicContact CG-CD1 4.49Å; F216-F242 HydrophobicContact CZ-CB 3.79Å; F216-F242 AromaticContact CZ-CD1 3.83Å; F216-F242 HydrophobicContact CZ-CD1 3.83Å; F216-F242 HydrophobicContact CZ-CG 4.13Å; F216-F242 VanDerWaalsContact O-CA 3.3Å; F216-F242 WeakPolarHBondContact O-CA 3.42Å; F216-F242 WeakPolarHBondContact O-CD1 3.46Å
217	K	97.2	Very high	96.7	Very high	90 Å²	90	32 Å²	32	39%	0.391	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-33.3	178.9	-72.5	-69.5	-179.6	175.7	0	111	R199 E200 D215 H219 F242	R199-K217 HydrophobicContact CB-CB 3.6Å; R199-K217 PolarHBondContact NE-O 2.95Å; R199-K217 PolarHBondContact NH2-O 2.9Å; E200-K217 HydrophobicContact CB-CB 3.94Å; E200-K217 HydrophobicContact CB-CG 3.57Å; E200-K217 HydrophobicContact CG-CG 4.37Å; E200-K217 WeakPolarHBondContact OE2-CE 3.32Å; E200-K217 WeakPolarHBondContact OE2-CG 3.03Å; D215-K217 PolarHBondContact O-N 3.22Å; D215-K217 PolarHBondContact OD1-N 2.85Å; K217-H219 PolarHBondContact O-CD2 3.09Å; K217-H219 VanDerWaalsContact O-CD2 3.29Å; K217-H219 PolarHBondContact O-N 2.88Å; K217-H219 PolarHBondContact O-NE2 2.88Å; K217-F242 HydrophobicContact CD-CE1 4.4Å
218	G	97.4	Very high	96.8	Very high	16 Å²	16	30.8 Å²	30.8	17%	0.165	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-13.8	175.4	0	0	0	0	0	115.7	D215 C220	D215-G218 CarbonylContact O-C 3.56Å; D215-G218 PolarHBondContact O-N 3.29Å; D215-G218 PolarHBondContact OD1-N 3.14Å; D215-G218 WeakPolarHBondContact OD2-CA 3.45Å; D215-G218 PolarHBondContact OD2-N 2.87Å; G218-C220 PolarHBondContact O-N 3.02Å; G218-C220 PolarHBondContact O-SG 2.85Å
219	H	98	Very high	97.2	Very high	29 Å²	29	28.5 Å²	28.5	13%	0.134	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	30.9	-174.7	-46.3	-74.4	0	0	0	113.5	D215 K217 N236 E237 T240 F242	D215-H219 PolarHBondContact O-N 3.34Å; K217-H219 PolarHBondContact O-CD2 3.09Å; K217-H219 VanDerWaalsContact O-CD2 3.29Å; K217-H219 PolarHBondContact O-N 2.88Å; K217-H219 PolarHBondContact O-NE2 2.88Å; H219-N236 CarbonylContact O-C 3.59Å; H219-N236 VanDerWaalsContact O-CA 3.29Å; H219-N236 WeakPolarHBondContact O-CA 3.17Å; H219-N236 PolarHBondContact O-N 2.83Å; H219-E237 HydrophobicContact CB-CB 4.07Å; H219-T240 CarbonylContact C-O 3.55Å; H219-T240 WeakPolarHBondContact CA-O 3.34Å; H219-T240 VanDerWaalsContact O-O 3.12Å; H219-T240 PolarHBondContact O-OG1 3.46Å; H219-F242 AromaticContact CE1-CD1 3.64Å; H219-F242 AromaticContact CE1-CD2 3.77Å; H219-F242 AromaticContact CE1-CE1 3.42Å; H219-F242 VanDerWaalsContact CE1-CE1 3.42Å; H219-F242 WeakPolarHBondContact CE1-CE1 3.24Å; H219-F242 AromaticContact CE1-CE2 3.56Å; H219-F242 AromaticContact CE1-CG 3.83Å; H219-F242 AromaticContact CE1-CZ 3.41Å; H219-F242 VanDerWaalsContact CE1-CZ 3.41Å; H219-F242 WeakPolarHBondContact CE1-CZ 3.15Å; H219-F242 AromaticContact ND1-CD1 3.89Å; H219-F242 AromaticContact ND1-CD2 3.87Å; H219-F242 AromaticContact ND1-CG 3.77Å; H219-F242 PolarHBondContact ND1-N 3.07Å
220	C	98.1	Very high	97.5	Very high	9 Å²	9	27.3 Å²	27.3	6%	0.061	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	178	-175.6	63.3	0	0	0	0	111	D215 G218 I234	D215-C220 PolarHBondContact N-O 2.87Å; D215-C220 PolarHBondContact O-N 3.14Å; G218-C220 PolarHBondContact O-N 3.02Å; G218-C220 PolarHBondContact O-SG 2.85Å; C220-I234 CarbonylContact C-O 3.53Å; C220-I234 WeakPolarHBondContact CA-O 3.28Å; C220-I234 VanDerWaalsContact CB-O 3.31Å; C220-I234 WeakPolarHBondContact CB-O 3.27Å
221	V	98.4	Very high	97.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129.3	169.8	172.7	0	0	0	0	107.7	Y212 V213 V223 R233 I234 I246 I256	Y212-V221 HydrophobicContact CD1-CG1 4.38Å; V213-V221 CarbonylContact O-C 3.34Å; V213-V221 VanDerWaalsContact O-CA 3.31Å; V213-V221 WeakPolarHBondContact O-CA 3.32Å; V221-V223 HydrophobicContact CG1-CG2 4.48Å; V221-R233 CarbonylContact O-C 3.52Å; V221-R233 VanDerWaalsContact O-CA 3.25Å; V221-R233 WeakPolarHBondContact O-CA 3.48Å; V221-I234 HydrophobicContact CB-CB 4.37Å; V221-I234 PolarHBondContact N-O 2.82Å; V221-I234 PolarHBondContact O-N 2.87Å; V221-I246 HydrophobicContact CB-CD1 4.45Å; V221-I246 HydrophobicContact CG1-CD1 3.75Å; V221-I246 HydrophobicContact CG2-CD1 3.85Å; V221-I256 HydrophobicContact CB-CD1 4.13Å; V221-I256 HydrophobicContact CG2-CD1 3.5Å; V221-I256 VanDerWaalsContact CG2-CD1 3.5Å; V221-I256 HydrophobicContact CG2-CG1 3.86Å; V221-I256 HydrophobicContact CG2-CG2 4.16Å
222	A	98.1	Very high	97.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	132.6	170.8	0	0	0	0	0	109.3	M198 V213 F224 F230	M198-A222 HydrophobicContact CE-CB 4.41Å; V213-A222 PolarHBondContact N-O 2.82Å; V213-A222 PolarHBondContact O-N 2.91Å; A222-F224 HydrophobicContact CB-CD2 4.46Å; A222-F224 HydrophobicContact CB-CE2 3.47Å; A222-F224 VanDerWaalsContact CB-CE2 3.47Å; A222-F224 HydrophobicContact CB-CZ 3.74Å; A222-F230 HydrophobicContact CB-CE2 4.33Å
223	V	98.3	Very high	97.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.8	-177.8	-167.9	0	0	0	0	109.4	D210 F211 Y212 V221 L231 Y232 I234	D210-V223 HydrophobicContact CB-CG1 4.33Å; F211-V223 CarbonylContact O-C 3.46Å; F211-V223 WeakPolarHBondContact O-CA 3.42Å; Y212-V223 HydrophobicContact CD1-CB 4.44Å; Y212-V223 HydrophobicContact CD1-CG1 4.02Å; Y212-V223 HydrophobicContact CD1-CG2 3.63Å; Y212-V223 HydrophobicContact CE1-CG1 3.83Å; Y212-V223 HydrophobicContact CE1-CG2 3.86Å; Y212-V223 HydrophobicContact CE2-CG1 4.41Å; Y212-V223 HydrophobicContact CG-CG1 4.38Å; Y212-V223 HydrophobicContact CG-CG2 4.43Å; V221-V223 HydrophobicContact CG1-CG2 4.48Å; V223-L231 HydrophobicContact CB-CB 4.48Å; V223-L231 HydrophobicContact CG1-CD1 4.19Å; V223-L231 PolarHBondContact O-N 2.99Å; V223-Y232 HydrophobicContact CB-CE2 4.38Å; V223-Y232 HydrophobicContact CG2-CD2 4.16Å; V223-Y232 HydrophobicContact CG2-CE2 3.88Å; V223-Y232 PolarHBondContact N-O 3.49Å; V223-I234 HydrophobicContact CG2-CD1 3.89Å; V223-I234 HydrophobicContact CG2-CG1 4.03Å
224	F	98.3	Very high	97.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151.2	-179.5	-55.2	-93.9	0	0	0	110.5	F192 C194 Y197 M198 D210 F211 V213 A222 T229 F230	F192-F224 HydrophobicContact CE2-CB 3.82Å; F192-F224 HydrophobicContact CE2-CD1 4.08Å; F192-F224 HydrophobicContact CE2-CD2 4.08Å; F192-F224 AromaticContact CE2-CG 3.73Å; F192-F224 HydrophobicContact CE2-CG 3.73Å; F192-F224 HydrophobicContact CZ-CB 3.89Å; F192-F224 HydrophobicContact CZ-CG 4.26Å; C194-F224 HydrophobicContact CB-CE1 3.92Å; C194-F224 HydrophobicContact CB-CE2 4.15Å; C194-F224 HydrophobicContact CB-CZ 3.61Å; Y197-F224 AromaticContact CD2-CE1 3.72Å; Y197-F224 HydrophobicContact CD2-CE1 3.72Å; Y197-F224 HydrophobicContact CD2-CZ 4.22Å; Y197-F224 HydrophobicContact CE2-CE1 4.34Å; Y197-F224 AromaticContact CG-CE1 3.99Å; Y197-F224 HydrophobicContact CG-CE1 3.99Å; Y197-F224 HydrophobicContact CG-CZ 4.16Å; M198-F224 HydrophobicContact CE-CE2 3.69Å; M198-F224 HydrophobicContact CE-CZ 3.8Å; D210-F224 CarbonylContact C-O 3.51Å; D210-F224 WeakPolarHBondContact CA-O 3.4Å; F211-F224 HydrophobicContact CB-CB 4.4Å; F211-F224 PolarHBondContact N-O 2.9Å; F211-F224 PolarHBondContact O-N 3.03Å; V213-F224 HydrophobicContact CB-CE2 4.44Å; V213-F224 HydrophobicContact CG2-CD2 4.21Å; V213-F224 HydrophobicContact CG2-CE2 4.24Å; A222-F224 HydrophobicContact CB-CD2 4.46Å; A222-F224 HydrophobicContact CB-CE2 3.47Å; A222-F224 VanDerWaalsContact CB-CE2 3.47Å; A222-F224 HydrophobicContact CB-CZ 3.74Å; F224-T229 CarbonylContact C-O 3.49Å; F224-T229 VanDerWaalsContact CA-O 3.28Å; F224-T229 WeakPolarHBondContact CA-O 3.37Å; F224-F230 HydrophobicContact CD1-CB 4.02Å; F224-F230 HydrophobicContact CD1-CD2 4.34Å; F224-F230 HydrophobicContact CE1-CB 3.96Å; F224-F230 AromaticContact CE1-CD2 3.86Å; F224-F230 HydrophobicContact CE1-CD2 3.86Å; F224-F230 HydrophobicContact CE1-CG 4.41Å; F224-F230 HydrophobicContact CZ-CD2 4.17Å
225	Q	96.9	Very high	97.3	Very high	74 Å²	74	38.2 Å²	38.2	35%	0.346	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	169	162.2	-71.7	-174.9	-28.1	0	0	111	N209 D227 G228 T229 L231	N209-Q225 CarbonylContact O-C 3.58Å; Q225-D227 WeakPolarHBondContact CB-OD1 3.49Å; Q225-D227 PolarHBondContact O-N 2.99Å; Q225-G228 PolarHBondContact O-N 2.83Å; Q225-T229 PolarHBondContact N-O 3.27Å; Q225-L231 HydrophobicContact CG-CD1 3.77Å; Q225-L231 HydrophobicContact CG-CD2 3.79Å; Q225-L231 HydrophobicContact CG-CG 3.92Å
226	D	93.5	Very high	97.2	Very high	40 Å²	40	41.5 Å²	41.5	21%	0.214	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-19.9	-177.6	71.4	-34.7	0	0	0	113.5	R190 N209 F211	R190-D226 WeakPolarHBondContact CD-O 3.46Å; R190-D226 IonicContact CZ-OD2 3.01Å; R190-D226 PolarHBondContact NE-O 2.79Å; R190-D226 VanDerWaalsContact NH1-CG 3.25Å; R190-D226 PolarHBondContact NH1-O 2.83Å; R190-D226 IonicContact NH1-OD2 2.94Å; R190-D226 PolarHBondContact NH1-OD2 3.14Å; R190-D226 PolarHBondContact NH2-O 3.27Å; R190-D226 IonicContact NH2-OD2 3.98Å; N209-D226 HydrophobicContact CB-CB 4.23Å; N209-D226 PolarHBondContact O-N 2.69Å; F211-D226 HydrophobicContact CD2-CB 4.37Å; F211-D226 HydrophobicContact CE2-CB 3.62Å; F211-D226 HydrophobicContact CZ-CB 4.44Å
227	D	94.4	Very high	97.1	Very high	89 Å²	89	45.1 Å²	45.1	48%	0.476	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-3.8	171.3	66.6	-1	0	0	0	114.3	Q225 T229	Q225-D227 WeakPolarHBondContact CB-OD1 3.49Å; Q225-D227 PolarHBondContact O-N 2.99Å; D227-T229 WeakPolarHBondContact OD1-CB 3.41Å; D227-T229 PolarHBondContact OD1-N 3.08Å; D227-T229 PolarHBondContact OD1-OG1 3.21Å
228	G	96.5	Very high	97	Very high	16 Å²	16	48.3 Å²	48.3	17%	0.165	24%	0.243	C	C	.	.			trans	92.1	1.1	-178.5	0	0	0	0	0	114.8	Q225 F230	Q225-G228 PolarHBondContact O-N 2.83Å; G228-F230 PolarHBondContact O-N 2.98Å; G228-F230 VanDerWaalsContact O-N 3.15Å
229	T	97.8	Very high	96.9	Very high	70 Å²	70	48.5 Å²	48.5	43%	0.429	24%	0.241	S	C	.	.			trans	-61.7	119.1	173.1	-69.2	0	0	0	0	110.3	F224 Q225 D227 L231	F224-T229 CarbonylContact C-O 3.49Å; F224-T229 VanDerWaalsContact CA-O 3.28Å; F224-T229 WeakPolarHBondContact CA-O 3.37Å; Q225-T229 PolarHBondContact N-O 3.27Å; D227-T229 WeakPolarHBondContact OD1-CB 3.41Å; D227-T229 PolarHBondContact OD1-N 3.08Å; D227-T229 PolarHBondContact OD1-OG1 3.21Å; T229-L231 HydrophobicContact CG2-CD2 4.48Å; T229-L231 PolarHBondContact O-N 2.86Å
230	F	98.1	Very high	96.8	Very high	60 Å²	60	47.1 Å²	47.1	26%	0.263	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	130.8	172	171.7	-98.2	0	0	0	110.5	Y197 A222 F224 G228 Y232 R233	Y197-F230 HydrophobicContact CD1-CB 4.02Å; Y197-F230 HydrophobicContact CD1-CD1 4Å; Y197-F230 AromaticContact CD1-CD2 3.49Å; Y197-F230 HydrophobicContact CD1-CD2 3.49Å; Y197-F230 VanDerWaalsContact CD1-CD2 3.49Å; Y197-F230 HydrophobicContact CD1-CE1 4.37Å; Y197-F230 AromaticContact CD1-CE2 3.91Å; Y197-F230 HydrophobicContact CD1-CE2 3.91Å; Y197-F230 AromaticContact CD1-CG 3.54Å; Y197-F230 HydrophobicContact CD1-CG 3.54Å; Y197-F230 HydrophobicContact CD1-CZ 4.32Å; Y197-F230 HydrophobicContact CD2-CB 4.38Å; Y197-F230 HydrophobicContact CE1-CB 3.56Å; Y197-F230 AromaticContact CE1-CD1 3.6Å; Y197-F230 HydrophobicContact CE1-CD1 3.6Å; Y197-F230 AromaticContact CE1-CD2 3.86Å; Y197-F230 HydrophobicContact CE1-CD2 3.86Å; Y197-F230 HydrophobicContact CE1-CE1 4.26Å; Y197-F230 HydrophobicContact CE1-CE2 4.48Å; Y197-F230 AromaticContact CE1-CG 3.36Å; Y197-F230 HydrophobicContact CE1-CG 3.36Å; Y197-F230 HydrophobicContact CE2-CB 3.95Å; Y197-F230 HydrophobicContact CG-CB 4.4Å; Y197-F230 AromaticContact CG-CD2 3.92Å; Y197-F230 HydrophobicContact CG-CD2 3.92Å; Y197-F230 HydrophobicContact CG-CG 4.21Å; Y197-F230 AromaticContact CZ-CG 3.91Å; A222-F230 HydrophobicContact CB-CE2 4.33Å; F224-F230 HydrophobicContact CD1-CB 4.02Å; F224-F230 HydrophobicContact CD1-CD2 4.34Å; F224-F230 HydrophobicContact CE1-CB 3.96Å; F224-F230 AromaticContact CE1-CD2 3.86Å; F224-F230 HydrophobicContact CE1-CD2 3.86Å; F224-F230 HydrophobicContact CE1-CG 4.41Å; F224-F230 HydrophobicContact CZ-CD2 4.17Å; G228-F230 PolarHBondContact O-N 2.98Å; G228-F230 VanDerWaalsContact O-N 3.15Å; F230-Y232 WeakPolarHBondContact CE2-O 3.49Å; F230-R233 HydrophobicContact CE2-CG 4.1Å; F230-R233 HydrophobicContact CZ-CG 3.97Å
231	L	96.9	Very high	96.7	Very high	58 Å²	58	47.7 Å²	47.7	30%	0.304	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-66.7	-179.9	-63.4	-178	0	0	0	111.5	V223 Q225 T229	V223-L231 HydrophobicContact CB-CB 4.48Å; V223-L231 HydrophobicContact CG1-CD1 4.19Å; V223-L231 PolarHBondContact O-N 2.99Å; Q225-L231 HydrophobicContact CG-CD1 3.77Å; Q225-L231 HydrophobicContact CG-CD2 3.79Å; Q225-L231 HydrophobicContact CG-CG 3.92Å; T229-L231 HydrophobicContact CG2-CD2 4.48Å; T229-L231 PolarHBondContact O-N 2.86Å
232	Y	97.1	Very high	96.6	Very high	64 Å²	64	50.5 Å²	50.5	25%	0.251	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	178.3	-176.4	52.9	-86.6	0	0	0	111	V223 F230 I234 R271	V223-Y232 HydrophobicContact CB-CE2 4.38Å; V223-Y232 HydrophobicContact CG2-CD2 4.16Å; V223-Y232 HydrophobicContact CG2-CE2 3.88Å; V223-Y232 PolarHBondContact N-O 3.49Å; F230-Y232 WeakPolarHBondContact CE2-O 3.49Å; Y232-I234 HydrophobicContact CD2-CG1 3.96Å; Y232-I234 HydrophobicContact CE2-CD1 3.89Å; Y232-I234 HydrophobicContact CE2-CG1 3.72Å; Y232-R271 WeakPolarHBondContact CE2-O 3.25Å; Y232-R271 PolarHBondContact OH-O 3.21Å
233	R	97.6	Very high	96.6	Very high	107 Å²	107	50.5 Å²	50.5	40%	0.404	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	147.3	172.9	-68.3	176.4	-170.8	-79.1	-2.8	111	Y197 V221 F230	Y197-R233 PolarHBondContact O-NH1 3.49Å; Y197-R233 PolarHBondContact O-NH2 2.91Å; V221-R233 CarbonylContact O-C 3.52Å; V221-R233 VanDerWaalsContact O-CA 3.25Å; V221-R233 WeakPolarHBondContact O-CA 3.48Å; F230-R233 HydrophobicContact CE2-CG 4.1Å; F230-R233 HydrophobicContact CZ-CG 3.97Å
234	I	97.9	Very high	96.4	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	136.6	171.7	-53.2	177.5	0	0	0	108.2	Y212 C220 V221 V223 Y232 V254 I256 Y269	Y212-I234 HydrophobicContact CD1-CD1 4.11Å; Y212-I234 HydrophobicContact CE1-CD1 4.01Å; C220-I234 CarbonylContact C-O 3.53Å; C220-I234 WeakPolarHBondContact CA-O 3.28Å; C220-I234 VanDerWaalsContact CB-O 3.31Å; C220-I234 WeakPolarHBondContact CB-O 3.27Å; V221-I234 HydrophobicContact CB-CB 4.37Å; V221-I234 PolarHBondContact N-O 2.82Å; V221-I234 PolarHBondContact O-N 2.87Å; V223-I234 HydrophobicContact CG2-CD1 3.89Å; V223-I234 HydrophobicContact CG2-CG1 4.03Å; Y232-I234 HydrophobicContact CD2-CG1 3.96Å; Y232-I234 HydrophobicContact CE2-CD1 3.89Å; Y232-I234 HydrophobicContact CE2-CG1 3.72Å; I234-V254 HydrophobicContact CD1-CB 4.25Å; I234-V254 HydrophobicContact CD1-CG1 4.15Å; I234-V254 HydrophobicContact CD1-CG2 3.98Å; I234-I256 HydrophobicContact CB-CD1 4.21Å; I234-I256 HydrophobicContact CG2-CD1 3.7Å; I234-Y269 HydrophobicContact CG2-CD1 3.45Å; I234-Y269 VanDerWaalsContact CG2-CD1 3.45Å; I234-Y269 HydrophobicContact CG2-CD2 3.56Å; I234-Y269 HydrophobicContact CG2-CE1 3.98Å; I234-Y269 HydrophobicContact CG2-CE2 4.07Å; I234-Y269 HydrophobicContact CG2-CG 3.23Å
235	G	96.8	Very high	96.4	Very high	19 Å²	19	51.1 Å²	51.1	20%	0.196	25%	0.254	C	S	.	.			trans	83.9	173.4	179.2	0	0	0	0	0	114.8	T240 Y269	G235-T240 VanDerWaalsContact CA-OG1 3.26Å; G235-T240 WeakPolarHBondContact CA-OG1 3.21Å; G235-Y269 WeakPolarHBondContact CA-OH 3.29Å
236	N	96.2	Very high	96.4	Very high	72 Å²	72	47.6 Å²	47.6	39%	0.385	24%	0.237	S	C	.	.			trans	-163.8	172.5	-178.9	60.4	69	0	0	0	111.2	H219 K238 V239 T240	H219-N236 CarbonylContact O-C 3.59Å; H219-N236 VanDerWaalsContact O-CA 3.29Å; H219-N236 WeakPolarHBondContact O-CA 3.17Å; H219-N236 PolarHBondContact O-N 2.83Å; N236-K238 PolarHBondContact O-N 2.8Å; N236-K238 WeakPolarHBondContact OD1-CA 3.39Å; N236-K238 VanDerWaalsContact OD1-CB 3.28Å; N236-K238 WeakPolarHBondContact OD1-CB 3.37Å; N236-K238 PolarHBondContact OD1-N 3.35Å; N236-V239 PolarHBondContact O-N 2.85Å; N236-V239 VanDerWaalsContact O-N 3.1Å; N236-V239 PolarHBondContact OD1-N 2.88Å; N236-T240 PolarHBondContact N-OG1 3.46Å; N236-T240 PolarHBondContact O-N 3.28Å; N236-T240 PolarHBondContact O-OG1 2.94Å
237	E	95.8	Very high	96.6	Very high	134 Å²	134	47 Å²	47	63%	0.626	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-9.3	179.8	65.8	175.8	-166.7	0	0	116.3	H219 C241	H219-E237 HydrophobicContact CB-CB 4.07Å; E237-C241 PolarHBondContact O-SG 3.12Å
238	K	93.9	Very high	96.7	Very high	156 Å²	156	43.8 Å²	43.8	68%	0.678	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-22.3	177.6	-58.3	179.4	-178.9	172.9	0	112.9	N236	N236-K238 PolarHBondContact O-N 2.8Å; N236-K238 WeakPolarHBondContact OD1-CA 3.39Å; N236-K238 VanDerWaalsContact OD1-CB 3.28Å; N236-K238 WeakPolarHBondContact OD1-CB 3.37Å; N236-K238 PolarHBondContact OD1-N 3.35Å
239	V	95.6	Very high	96.5	Very high	20 Å²	20	44.2 Å²	44.2	12%	0.121	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119	-55.8	-171.7	-177.8	0	0	0	0	111.1	N236 C241 H265 A267 Y269 L275 E278	N236-V239 PolarHBondContact O-N 2.85Å; N236-V239 VanDerWaalsContact O-N 3.1Å; N236-V239 PolarHBondContact OD1-N 2.88Å; V239-C241 PolarHBondContact O-N 2.87Å; V239-H265 PolarHBondContact O-CE1 2.82Å; V239-H265 PolarHBondContact O-ND1 2.94Å; V239-A267 HydrophobicContact CG1-CB 3.68Å; V239-Y269 VanDerWaalsContact CG1-OH 3.23Å; V239-Y269 WeakPolarHBondContact CG1-OH 3.05Å; V239-L275 HydrophobicContact CG1-CD1 4.18Å; V239-L275 HydrophobicContact CG1-CD2 4.3Å; V239-L275 HydrophobicContact CG2-CD2 4.29Å; V239-E278 HydrophobicContact CG1-CG 4.23Å
240	T	96.1	Very high	96.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.238	C	C	.	.	S	Bend	trans	-102.3	61.4	-174.9	47.4	0	0	0	0	110.3	H219 G235 N236 F242 P243 I256 A267 Y269	H219-T240 CarbonylContact C-O 3.55Å; H219-T240 WeakPolarHBondContact CA-O 3.34Å; H219-T240 VanDerWaalsContact O-O 3.12Å; H219-T240 PolarHBondContact O-OG1 3.46Å; G235-T240 VanDerWaalsContact CA-OG1 3.26Å; G235-T240 WeakPolarHBondContact CA-OG1 3.21Å; N236-T240 PolarHBondContact N-OG1 3.46Å; N236-T240 PolarHBondContact O-N 3.28Å; N236-T240 PolarHBondContact O-OG1 2.94Å; T240-F242 PolarHBondContact O-N 3.25Å; T240-F242 VanDerWaalsContact O-N 3.08Å; T240-P243 WeakPolarHBondContact O-CD 3.46Å; T240-I256 HydrophobicContact CG2-CB 3.87Å; T240-I256 HydrophobicContact CG2-CD1 4.02Å; T240-I256 HydrophobicContact CG2-CG2 3.66Å; T240-A267 HydrophobicContact CG2-CB 3.94Å; T240-Y269 HydrophobicContact CG2-CE2 3.8Å
241	C	96	Very high	95.8	Very high	21 Å²	21	49.8 Å²	49.8	14%	0.142	26%	0.26	C	S	.	.			trans	-70.4	105.5	-172.5	-67.5	0	0	0	0	111.5	E237 V239 D258 H260	E237-C241 PolarHBondContact O-SG 3.12Å; V239-C241 PolarHBondContact O-N 2.87Å; C241-D258 VanDerWaalsContact O-CB 3.26Å; C241-D258 WeakPolarHBondContact O-CB 3.44Å; C241-H260 HydrophobicContact CB-CB 3.59Å
242	F	96.9	Very high	95.5	Very high	60 Å²	60	47.2 Å²	47.2	26%	0.263	25%	0.247	S	C	.	.	S	Bend	trans	62.2	62.3	178.7	-54.8	-85.3	0	0	0	112.6	F216 K217 H219 T240 N244 H260	F216-F242 HydrophobicContact CD1-CD1 4Å; F216-F242 HydrophobicContact CD2-CB 3.87Å; F216-F242 HydrophobicContact CE1-CB 4.35Å; F216-F242 AromaticContact CE1-CD1 3.63Å; F216-F242 HydrophobicContact CE1-CD1 3.63Å; F216-F242 HydrophobicContact CE1-CE1 4.35Å; F216-F242 HydrophobicContact CE1-CG 4.38Å; F216-F242 HydrophobicContact CE2-CB 3.55Å; F216-F242 HydrophobicContact CE2-CD1 4.37Å; F216-F242 HydrophobicContact CE2-CG 4.37Å; F216-F242 HydrophobicContact CG-CB 4.42Å; F216-F242 HydrophobicContact CG-CD1 4.49Å; F216-F242 HydrophobicContact CZ-CB 3.79Å; F216-F242 AromaticContact CZ-CD1 3.83Å; F216-F242 HydrophobicContact CZ-CD1 3.83Å; F216-F242 HydrophobicContact CZ-CG 4.13Å; F216-F242 VanDerWaalsContact O-CA 3.3Å; F216-F242 WeakPolarHBondContact O-CA 3.42Å; F216-F242 WeakPolarHBondContact O-CD1 3.46Å; K217-F242 HydrophobicContact CD-CE1 4.4Å; H219-F242 AromaticContact CE1-CD1 3.64Å; H219-F242 AromaticContact CE1-CD2 3.77Å; H219-F242 AromaticContact CE1-CE1 3.42Å; H219-F242 VanDerWaalsContact CE1-CE1 3.42Å; H219-F242 WeakPolarHBondContact CE1-CE1 3.24Å; H219-F242 AromaticContact CE1-CE2 3.56Å; H219-F242 AromaticContact CE1-CG 3.83Å; H219-F242 AromaticContact CE1-CZ 3.41Å; H219-F242 VanDerWaalsContact CE1-CZ 3.41Å; H219-F242 WeakPolarHBondContact CE1-CZ 3.15Å; H219-F242 AromaticContact ND1-CD1 3.89Å; H219-F242 AromaticContact ND1-CD2 3.87Å; H219-F242 AromaticContact ND1-CG 3.77Å; H219-F242 PolarHBondContact ND1-N 3.07Å; T240-F242 PolarHBondContact O-N 3.25Å; T240-F242 VanDerWaalsContact O-N 3.08Å; F242-N244 PolarHBondContact O-N 3.17Å; F242-H260 AromaticContact CD2-ND1 3.56Å; F242-H260 AromaticContact CE2-CE1 3.93Å; F242-H260 AromaticContact CE2-ND1 3.67Å
243	P	97.6	Very high	95.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.241	C	C	.	.			trans	-62.8	134.7	-173.5	29.5	-35.5	0	0	0	110.1	S202 C214 D215 T240 I256 G257	S202-P243 PolarHBondContact OG-O 3.48Å; C214-P243 HydrophobicContact CB-CB 4.35Å; C214-P243 HydrophobicContact CB-CG 4.26Å; D215-P243 WeakPolarHBondContact O-CD 3.39Å; D215-P243 WeakPolarHBondContact O-CG 3.22Å; T240-P243 WeakPolarHBondContact O-CD 3.46Å; P243-I256 HydrophobicContact CB-CG2 3.59Å; P243-G257 WeakPolarHBondContact CA-O 3.39Å
244	N	95.4	Very high	95.4	Very high	12 Å²	12	40.3 Å²	40.3	6%	0.064	22%	0.222	C	C	.	.			trans	-129.8	2.3	-174.3	61.9	30.5	0	0	0	113.5	F242 G257 S259 C289 G291	F242-N244 PolarHBondContact O-N 3.17Å; N244-G257 PolarHBondContact N-O 2.81Å; N244-G257 PolarHBondContact OD1-O 3.26Å; N244-S259 PolarHBondContact ND2-N 2.97Å; N244-S259 PolarHBondContact ND2-OG 2.89Å; N244-C289 VanDerWaalsContact CB-O 3.27Å; N244-C289 WeakPolarHBondContact CB-O 3.27Å; N244-C289 PolarHBondContact ND2-O 3.4Å; N244-G291 PolarHBondContact O-N 2.88Å
245	G	96.9	Very high	95.4	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	148.2	175.3	0	0	0	0	0	111.2	D203 G257	D203-G245 WeakPolarHBondContact OD2-CA 3.33Å; G245-G257 PolarHBondContact N-O 3.21Å; G245-G257 PolarHBondContact O-N 3.33Å
246	I	98.2	Very high	95.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	143.9	174.9	-173.7	172.5	0	0	0	111	D203 A205 Y212 C214 V221 V254 L255 L292 K293	D203-I246 HydrophobicContact CB-CG2 4.18Å; D203-I246 PolarHBondContact OD2-N 3.21Å; A205-I246 HydrophobicContact CB-CB 4.43Å; A205-I246 HydrophobicContact CB-CD1 4.32Å; A205-I246 HydrophobicContact CB-CG1 4Å; A205-I246 HydrophobicContact CB-CG2 3.85Å; Y212-I246 HydrophobicContact CG-CD1 4.49Å; C214-I246 VanDerWaalsContact SG-CB 3.52Å; C214-I246 VanDerWaalsContact SG-CG2 3.52Å; V221-I246 HydrophobicContact CB-CD1 4.45Å; V221-I246 HydrophobicContact CG1-CD1 3.75Å; V221-I246 HydrophobicContact CG2-CD1 3.85Å; I246-V254 HydrophobicContact CD1-CG1 3.94Å; I246-V254 HydrophobicContact CG1-CG1 4.27Å; I246-L255 VanDerWaalsContact CA-O 3.31Å; I246-L255 WeakPolarHBondContact CA-O 3.21Å; I246-L292 CarbonylContact C-O 3.58Å; I246-L292 VanDerWaalsContact O-O 3.06Å; I246-K293 PolarHBondContact O-NZ 2.83Å
247	D	97.7	Very high	95.4	Very high	28 Å²	28	36.2 Å²	36.2	15%	0.15	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	163.4	164.9	-144.6	24.9	0	0	0	111	L255 L292 K293 I294	D247-L255 PolarHBondContact N-O 3.34Å; D247-L255 VanDerWaalsContact N-O 3.07Å; D247-L255 PolarHBondContact O-N 3.49Å; D247-L292 HydrophobicContact CB-CD2 3.72Å; D247-K293 HydrophobicContact CB-CD 4.37Å; D247-K293 WeakPolarHBondContact OD1-CD 3.48Å; D247-K293 IonicContact OD1-NZ 3.13Å; D247-K293 PolarHBondContact OD1-NZ 3.16Å; D247-K293 WeakPolarHBondContact OD2-CA 3.18Å; D247-K293 WeakPolarHBondContact OD2-CD 3.31Å; D247-I294 HydrophobicContact CB-CD1 3.92Å; D247-I294 HydrophobicContact CB-CG1 3.99Å; D247-I294 PolarHBondContact OD2-N 2.77Å
248	I	95.9	Very high	95.5	Very high	22 Å²	22	30 Å²	30	11%	0.113	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	126.1	-177.7	-50.3	164.3	0	0	0	108.7	A205 R207 Y212 D253	A205-I248 HydrophobicContact CB-CD1 3.77Å; A205-I248 HydrophobicContact CB-CG1 3.79Å; R207-I248 HydrophobicContact CB-CD1 3.66Å; R207-I248 HydrophobicContact CB-CG2 4.31Å; Y212-I248 HydrophobicContact CD2-CD1 3.29Å; Y212-I248 HydrophobicContact CD2-CG1 4.43Å; Y212-I248 HydrophobicContact CE2-CD1 3.46Å; Y212-I248 VanDerWaalsContact CE2-CD1 3.46Å; Y212-I248 HydrophobicContact CG-CD1 3.9Å; I248-D253 CarbonylContact C-O 3.5Å; I248-D253 WeakPolarHBondContact CA-O 2.99Å; I248-D253 WeakPolarHBondContact CG2-O 3.45Å
249	S	93.1	Very high	95.5	Very high	24 Å²	24	23.3 Å²	23.3	17%	0.168	14%	0.14	C	C	.	.			trans	-68.1	162.5	-179.7	85.9	0	0	0	0	111.3	A251 G252 D253	S249-A251 PolarHBondContact O-N 2.89Å; S249-A251 PolarHBondContact OG-N 2.82Å; S249-G252 WeakPolarHBondContact O-CA 3.34Å; S249-G252 PolarHBondContact O-N 2.86Å; S249-G252 PolarHBondContact OG-N 3.47Å; S249-D253 PolarHBondContact N-O 2.95Å; S249-D253 WeakPolarHBondContact OG-CB 3.39Å; S249-D253 PolarHBondContact OG-N 2.72Å; S249-D253 PolarHBondContact OG-OD2 2.9Å
250	N	89.1	Confident	95.3	Very high	161 Å²	161	27.3 Å²	27.3	86%	0.861	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-26.1	172.4	-70.9	-23.7	0	0	0	112.9	G252	N250-G252 VanDerWaalsContact C-N 3.26Å
251	A	90.3	Very high	95	Very high	87 Å²	87	29.8 Å²	29.8	72%	0.719	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-11.3	173.9	0	0	0	0	0	112.5	S249	S249-A251 PolarHBondContact O-N 2.89Å; S249-A251 PolarHBondContact OG-N 2.82Å
252	G	92.3	Very high	94.8	Very high	3 Å²	3	32.9 Å²	32.9	3%	0.031	20%	0.198	C	C	.	.			trans	96.7	5.6	178.5	0	0	0	0	0	114.8	R207 S249 N250	R207-G252 VanDerWaalsContact NH2-CA 3.35Å; R207-G252 PolarHBondContact NH2-O 3.36Å; S249-G252 WeakPolarHBondContact O-CA 3.34Å; S249-G252 PolarHBondContact O-N 2.86Å; S249-G252 PolarHBondContact OG-N 3.47Å; N250-G252 VanDerWaalsContact C-N 3.26Å
253	D	94.1	Very high	94.5	Very high	27 Å²	27	36 Å²	36	14%	0.144	21%	0.208	C	C	.	.			trans	-67.5	135.9	175.4	-45.1	-66.7	0	0	0	110.2	I248 S249 L255 Y269 Q276	I248-D253 CarbonylContact C-O 3.5Å; I248-D253 WeakPolarHBondContact CA-O 2.99Å; I248-D253 WeakPolarHBondContact CG2-O 3.45Å; S249-D253 PolarHBondContact N-O 2.95Å; S249-D253 WeakPolarHBondContact OG-CB 3.39Å; S249-D253 PolarHBondContact OG-N 2.72Å; S249-D253 PolarHBondContact OG-OD2 2.9Å; D253-L255 HydrophobicContact CB-CD1 4.1Å; D253-L255 WeakPolarHBondContact O-CD1 3.4Å; D253-Y269 CarbonylContact C-O 3.45Å; D253-Y269 WeakPolarHBondContact CA-O 3.5Å; D253-Q276 PolarHBondContact OD1-NE2 3.27Å; D253-Q276 PolarHBondContact OD1-OE1 3.2Å
254	V	97.1	Very high	94.3	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	112	-178.5	-175.1	0	0	0	0	108.5	Y212 I234 I246 I256 Y269	Y212-V254 HydrophobicContact CD1-CG1 4.16Å; Y212-V254 HydrophobicContact CD1-CG2 4.06Å; Y212-V254 HydrophobicContact CE1-CG2 3.64Å; I234-V254 HydrophobicContact CD1-CB 4.25Å; I234-V254 HydrophobicContact CD1-CG1 4.15Å; I234-V254 HydrophobicContact CD1-CG2 3.98Å; I246-V254 HydrophobicContact CD1-CG1 3.94Å; I246-V254 HydrophobicContact CG1-CG1 4.27Å; V254-I256 HydrophobicContact CG1-CD1 4.37Å; V254-I256 HydrophobicContact CG1-CG1 4.05Å; V254-Y269 PolarHBondContact N-O 2.7Å; V254-Y269 PolarHBondContact O-N 3.31Å
255	L	97.6	Very high	94.4	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.026	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	119.3	178.7	-71.9	76.4	0	0	0	109.7	I246 D247 D253 V266 L292 I294 L316	I246-L255 VanDerWaalsContact CA-O 3.31Å; I246-L255 WeakPolarHBondContact CA-O 3.21Å; D247-L255 PolarHBondContact N-O 3.34Å; D247-L255 VanDerWaalsContact N-O 3.07Å; D247-L255 PolarHBondContact O-N 3.49Å; D253-L255 HydrophobicContact CB-CD1 4.1Å; D253-L255 WeakPolarHBondContact O-CD1 3.4Å; L255-V266 HydrophobicContact CB-CG1 4.1Å; L255-V266 HydrophobicContact CD2-CG1 4.13Å; L255-V266 HydrophobicContact CG-CG1 4.39Å; L255-L292 HydrophobicContact CB-CD2 3.95Å; L255-I294 HydrophobicContact CB-CD1 3.99Å; L255-I294 HydrophobicContact CD1-CD1 3.39Å; L255-I294 HydrophobicContact CD2-CD1 3.32Å; L255-I294 HydrophobicContact CD2-CG1 3.81Å; L255-I294 HydrophobicContact CG-CD1 3.72Å; L255-L316 HydrophobicContact CD2-CD1 3.38Å; L255-L316 HydrophobicContact CD2-CG 4.42Å; L255-L316 HydrophobicContact CG-CD1 4.45Å
256	I	98.1	Very high	94.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	117.3	-177.6	-54.4	173.6	0	0	0	108	V221 I234 T240 P243 V254 V266 A267 Y269	V221-I256 HydrophobicContact CB-CD1 4.13Å; V221-I256 HydrophobicContact CG2-CD1 3.5Å; V221-I256 VanDerWaalsContact CG2-CD1 3.5Å; V221-I256 HydrophobicContact CG2-CG1 3.86Å; V221-I256 HydrophobicContact CG2-CG2 4.16Å; I234-I256 HydrophobicContact CB-CD1 4.21Å; I234-I256 HydrophobicContact CG2-CD1 3.7Å; T240-I256 HydrophobicContact CG2-CB 3.87Å; T240-I256 HydrophobicContact CG2-CD1 4.02Å; T240-I256 HydrophobicContact CG2-CG2 3.66Å; P243-I256 HydrophobicContact CB-CG2 3.59Å; V254-I256 HydrophobicContact CG1-CD1 4.37Å; V254-I256 HydrophobicContact CG1-CG1 4.05Å; I256-V266 WeakPolarHBondContact O-CA 3.39Å; I256-A267 PolarHBondContact N-O 3.02Å; I256-A267 PolarHBondContact O-N 2.99Å; I256-Y269 HydrophobicContact CD1-CD2 3.83Å; I256-Y269 HydrophobicContact CD1-CE2 3.93Å; I256-Y269 HydrophobicContact CG1-CD2 4.42Å
257	G	96.8	Very high	94.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	137.9	179.2	0	0	0	0	0	112.2	P243 N244 G245 H265	P243-G257 WeakPolarHBondContact CA-O 3.39Å; N244-G257 PolarHBondContact N-O 2.81Å; N244-G257 PolarHBondContact OD1-O 3.26Å; G245-G257 PolarHBondContact N-O 3.21Å; G245-G257 PolarHBondContact O-N 3.33Å; G257-H265 WeakPolarHBondContact CA-O 3.43Å
258	D	96.4	Very high	94.2	Very high	5 Å²	5	35 Å²	35	3%	0.027	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	168.2	166.5	79.1	78.9	0	0	0	111.9	C241 H260 F264 H265	C241-D258 VanDerWaalsContact O-CB 3.26Å; C241-D258 WeakPolarHBondContact O-CB 3.44Å; D258-H260 WeakPolarHBondContact OD1-CB 3.43Å; D258-H260 PolarHBondContact OD1-N 3.26Å; D258-F264 WeakPolarHBondContact O-CD2 3.15Å; D258-H265 PolarHBondContact N-O 2.96Å; D258-H265 PolarHBondContact O-N 3.27Å; D258-H265 IonicContact OD2-CE1 3.59Å; D258-H265 IonicContact OD2-CG 3.23Å; D258-H265 IonicContact OD2-ND1 2.86Å; D258-H265 PolarHBondContact OD2-ND1 3.39Å
259	S	94.8	Very high	94.2	Very high	15 Å²	15	34.4 Å²	34.4	11%	0.105	20%	0.198	C	C	.	.			trans	-128.5	30.3	176.3	71.9	0	0	0	0	112.8	N244 R263 R288 C289	N244-S259 PolarHBondContact ND2-N 2.97Å; N244-S259 PolarHBondContact ND2-OG 2.89Å; S259-R263 CarbonylContact C-O 3.57Å; S259-R263 WeakPolarHBondContact CA-O 3.2Å; S259-R288 PolarHBondContact OG-N 2.83Å; S259-C289 PolarHBondContact OG-N 3.45Å; S259-C289 VanDerWaalsContact OG-N 3.17Å
260	H	91.5	Very high	94.3	Very high	103 Å²	103	34 Å²	34	48%	0.477	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-67	148.5	179.3	-171.6	75.2	0	0	0	110.7	C241 F242 D258 N262	C241-H260 HydrophobicContact CB-CB 3.59Å; F242-H260 AromaticContact CD2-ND1 3.56Å; F242-H260 AromaticContact CE2-CE1 3.93Å; F242-H260 AromaticContact CE2-ND1 3.67Å; D258-H260 WeakPolarHBondContact OD1-CB 3.43Å; D258-H260 PolarHBondContact OD1-N 3.26Å; H260-N262 PolarHBondContact O-N 2.86Å
261	G	89.5	Confident	94.3	Very high	52 Å²	52	30.7 Å²	30.7	54%	0.536	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	67.4	16.6	-177.9	0	0	0	0	0	115.1	R263	G261-R263 VanDerWaalsContact C-N 3.35Å
262	N	91.2	Very high	94.4	Very high	87 Å²	87	33.6 Å²	33.6	47%	0.465	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	63.6	30.9	-177.8	-55.4	-54.9	0	0	0	115	H260 K285 V286	H260-N262 PolarHBondContact O-N 2.86Å; N262-K285 VanDerWaalsContact O-CA 3.28Å; N262-K285 WeakPolarHBondContact O-CA 3.11Å; N262-V286 CarbonylContact C-O 3.54Å; N262-V286 VanDerWaalsContact C-O 3.24Å; N262-V286 WeakPolarHBondContact CA-O 3.4Å; N262-V286 PolarHBondContact O-N 3.34Å
263	R	91	Very high	94.4	Very high	126 Å²	126	34.5 Å²	34.5	48%	0.475	18%	0.179	S	C	.	.	S	Bend	trans	-131.9	143.5	177.9	-54.8	-172.9	-54.2	-155.8	9.9	108.6	S259 G261 H265 E280	S259-R263 CarbonylContact C-O 3.57Å; S259-R263 WeakPolarHBondContact CA-O 3.2Å; G261-R263 VanDerWaalsContact C-N 3.35Å; R263-H265 PolarHBondContact O-N 2.85Å; R263-E280 HydrophobicContact CB-CG 4.16Å; R263-E280 WeakPolarHBondContact CD-OE1 3.18Å; R263-E280 VanDerWaalsContact CZ-CD 3.5Å; R263-E280 IonicContact CZ-OE1 2.67Å; R263-E280 VanDerWaalsContact CZ-OE1 3.3Å; R263-E280 IonicContact CZ-OE2 3.45Å; R263-E280 IonicContact NE-OE1 3.39Å; R263-E280 PolarHBondContact NE-OE1 3.39Å; R263-E280 IonicContact NE-OE2 3.4Å; R263-E280 PolarHBondContact NE-OE2 2.89Å; R263-E280 IonicContact NH1-OE1 3.46Å; R263-E280 IonicContact NH1-OE2 3.73Å; R263-E280 IonicContact NH2-OE1 2.89Å; R263-E280 IonicContact NH2-OE2 3.6Å; R263-E280 PolarHBondContact NH2-OE2 3.01Å
264	F	94.6	Very high	94.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	117	174.5	-174.2	-121.1	0	0	0	108.4	M47 D258 V266 E280 C281 V286 C289 L292 V300 T302 L313	M47-F264 HydrophobicContact CE-CD1 3.73Å; M47-F264 HydrophobicContact CE-CE1 4.12Å; D258-F264 WeakPolarHBondContact O-CD2 3.15Å; F264-V266 HydrophobicContact CD1-CG2 4.21Å; F264-V266 HydrophobicContact CE1-CG2 3.52Å; F264-V266 HydrophobicContact CE2-CG2 4.48Å; F264-V266 HydrophobicContact CZ-CG2 3.68Å; F264-E280 CarbonylContact O-C 3.5Å; F264-E280 WeakPolarHBondContact O-CA 3.29Å; F264-C281 HydrophobicContact CB-CB 4.19Å; F264-C281 PolarHBondContact O-N 3Å; F264-V286 HydrophobicContact CB-CG2 3.72Å; F264-V286 VanDerWaalsContact N-CG2 3.28Å; F264-C289 HydrophobicContact CD2-CB 4.24Å; F264-C289 HydrophobicContact CE2-CB 4.4Å; F264-L292 HydrophobicContact CZ-CD1 3.96Å; F264-L292 HydrophobicContact CZ-CG 4.47Å; F264-V300 HydrophobicContact CE1-CG1 3.87Å; F264-V300 HydrophobicContact CZ-CG1 4.17Å; F264-T302 HydrophobicContact CD1-CG2 3.9Å; F264-T302 HydrophobicContact CD2-CG2 3.86Å; F264-T302 HydrophobicContact CE1-CG2 3.67Å; F264-T302 HydrophobicContact CE2-CG2 3.64Å; F264-T302 WeakPolarHBondContact CE2-OG1 3.48Å; F264-T302 HydrophobicContact CG-CG2 3.99Å; F264-T302 VanDerWaalsContact CZ-CB 3.45Å; F264-T302 HydrophobicContact CZ-CG2 3.53Å; F264-L313 HydrophobicContact CD1-CD1 3.39Å; F264-L313 HydrophobicContact CE1-CD1 3.51Å
265	H	95.6	Very high	94.4	Very high	19 Å²	19	39.5 Å²	39.5	9%	0.088	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	141.4	-178.5	171.8	-109.8	0	0	0	109.5	V239 G257 D258 R263 E278 F279	V239-H265 PolarHBondContact O-CE1 2.82Å; V239-H265 PolarHBondContact O-ND1 2.94Å; G257-H265 WeakPolarHBondContact CA-O 3.43Å; D258-H265 PolarHBondContact N-O 2.96Å; D258-H265 PolarHBondContact O-N 3.27Å; D258-H265 IonicContact OD2-CE1 3.59Å; D258-H265 IonicContact OD2-CG 3.23Å; D258-H265 IonicContact OD2-ND1 2.86Å; D258-H265 PolarHBondContact OD2-ND1 3.39Å; R263-H265 PolarHBondContact O-N 2.85Å; H265-E278 IonicContact CE1-OE2 2.66Å; H265-E278 IonicContact NE2-OE2 3.52Å; H265-E278 PolarHBondContact NE2-OE2 2.89Å; H265-F279 CarbonylContact C-O 3.56Å; H265-F279 WeakPolarHBondContact CA-O 3.39Å; H265-F279 PolarHBondContact CD2-O 3.46Å
266	V	96.5	Very high	94.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	120.1	175.6	-176.8	0	0	0	0	108.7	M47 L255 I256 F264 F279 L292 V300 L316	M47-V266 HydrophobicContact CE-CG2 3.92Å; M47-V266 HydrophobicContact SD-CG2 4.33Å; L255-V266 HydrophobicContact CB-CG1 4.1Å; L255-V266 HydrophobicContact CD2-CG1 4.13Å; L255-V266 HydrophobicContact CG-CG1 4.39Å; I256-V266 WeakPolarHBondContact O-CA 3.39Å; F264-V266 HydrophobicContact CD1-CG2 4.21Å; F264-V266 HydrophobicContact CE1-CG2 3.52Å; F264-V266 HydrophobicContact CE2-CG2 4.48Å; F264-V266 HydrophobicContact CZ-CG2 3.68Å; V266-F279 HydrophobicContact CB-CB 4.41Å; V266-F279 PolarHBondContact N-O 3.31Å; V266-F279 PolarHBondContact O-N 2.67Å; V266-L292 HydrophobicContact CB-CD1 4.31Å; V266-L292 HydrophobicContact CG1-CD1 3.78Å; V266-L292 HydrophobicContact CG2-CD1 3.6Å; V266-V300 HydrophobicContact CG2-CG1 4.35Å; V266-L316 HydrophobicContact CB-CD1 4.48Å; V266-L316 HydrophobicContact CG1-CD1 3.91Å
267	A	96.7	Very high	94	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.2	170.4	0	0	0	0	0	109.8	V239 T240 I256 Y269 L275	V239-A267 HydrophobicContact CG1-CB 3.68Å; T240-A267 HydrophobicContact CG2-CB 3.94Å; I256-A267 PolarHBondContact N-O 3.02Å; I256-A267 PolarHBondContact O-N 2.99Å; A267-Y269 HydrophobicContact CB-CD2 4.23Å; A267-Y269 HydrophobicContact CB-CE2 3.53Å; A267-L275 HydrophobicContact CB-CD1 4.16Å
268	C	96.4	Very high	93.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.3	177.4	-167.4	0	0	0	0	109.7	Q276 S277 F279 V318	C268-Q276 PolarHBondContact O-N 2.65Å; C268-Q276 PolarHBondContact SG-OE1 3.23Å; C268-Q276 VanDerWaalsContact SG-OE1 3.4Å; C268-S277 WeakPolarHBondContact CB-OG 3.34Å; C268-S277 PolarHBondContact N-O 2.77Å; C268-S277 PolarHBondContact O-N 3.43Å; C268-F279 HydrophobicContact CB-CE2 4.28Å; C268-V318 HydrophobicContact CB-CG2 4.41Å; C268-V318 VanDerWaalsContact SG-CG2 3.53Å
269	Y	96.9	Very high	93.8	Very high	8 Å²	8	46.4 Å²	46.4	3%	0.031	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	147	178.4	-68.8	-97.5	0	0	0	110.5	I234 G235 V239 T240 D253 V254 I256 A267 G273 A274 L275 Q276	I234-Y269 HydrophobicContact CG2-CD1 3.45Å; I234-Y269 VanDerWaalsContact CG2-CD1 3.45Å; I234-Y269 HydrophobicContact CG2-CD2 3.56Å; I234-Y269 HydrophobicContact CG2-CE1 3.98Å; I234-Y269 HydrophobicContact CG2-CE2 4.07Å; I234-Y269 HydrophobicContact CG2-CG 3.23Å; G235-Y269 WeakPolarHBondContact CA-OH 3.29Å; V239-Y269 VanDerWaalsContact CG1-OH 3.23Å; V239-Y269 WeakPolarHBondContact CG1-OH 3.05Å; T240-Y269 HydrophobicContact CG2-CE2 3.8Å; D253-Y269 CarbonylContact C-O 3.45Å; D253-Y269 WeakPolarHBondContact CA-O 3.5Å; V254-Y269 PolarHBondContact N-O 2.7Å; V254-Y269 PolarHBondContact O-N 3.31Å; I256-Y269 HydrophobicContact CD1-CD2 3.83Å; I256-Y269 HydrophobicContact CD1-CE2 3.93Å; I256-Y269 HydrophobicContact CG1-CD2 4.42Å; A267-Y269 HydrophobicContact CB-CD2 4.23Å; A267-Y269 HydrophobicContact CB-CE2 3.53Å; Y269-G273 WeakPolarHBondContact CD1-O 3.28Å; Y269-A274 CarbonylContact C-O 3.45Å; Y269-A274 WeakPolarHBondContact CA-O 3.45Å; Y269-L275 HydrophobicContact CD1-CB 3.98Å; Y269-L275 HydrophobicContact CD1-CD1 4.33Å; Y269-L275 HydrophobicContact CD2-CD1 4.37Å; Y269-L275 HydrophobicContact CE1-CB 3.62Å; Y269-L275 HydrophobicContact CE1-CD1 3.89Å; Y269-L275 HydrophobicContact CE1-CG 4.32Å; Y269-L275 HydrophobicContact CE2-CD1 3.93Å; Y269-Q276 VanDerWaalsContact C-OE1 3.27Å; Y269-Q276 PolarHBondContact O-OE1 3.43Å
270	S	94.9	Very high	93.8	Very high	15 Å²	15	47.3 Å²	47.3	11%	0.105	25%	0.25	C	S	.	.			trans	-64.4	165.7	165.6	86	0	0	0	0	110.3	E272 G273 A274	S270-E272 WeakPolarHBondContact CB-OE2 3.43Å; S270-E272 PolarHBondContact O-N 2.87Å; S270-E272 PolarHBondContact OG-N 2.77Å; S270-E272 PolarHBondContact OG-OE2 3.16Å; S270-G273 PolarHBondContact O-N 3Å; S270-A274 PolarHBondContact N-O 3.01Å; S270-A274 PolarHBondContact OG-N 3.23Å
271	R	89.3	Confident	93.8	Very high	93 Å²	93	42.5 Å²	42.5	35%	0.351	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-38.5	175.3	-176.1	-179.7	-168.6	168	4.1	111.4	D210 Y232 G273	D210-R271 IonicContact OD2-CZ 3.58Å; D210-R271 IonicContact OD2-NE 3.54Å; D210-R271 IonicContact OD2-NH2 2.77Å; D210-R271 PolarHBondContact OD2-NH2 3.43Å; Y232-R271 WeakPolarHBondContact CE2-O 3.25Å; Y232-R271 PolarHBondContact OH-O 3.21Å; R271-G273 PolarHBondContact O-N 2.95Å
272	E	90.6	Very high	93.6	Very high	147 Å²	147	43.5 Å²	43.5	69%	0.687	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-0.7	-178.9	-54.7	68.9	-145.1	0	0	113.1	S270	S270-E272 WeakPolarHBondContact CB-OE2 3.43Å; S270-E272 PolarHBondContact O-N 2.87Å; S270-E272 PolarHBondContact OG-N 2.77Å; S270-E272 PolarHBondContact OG-OE2 3.16Å
273	G	92.9	Very high	93.3	Very high	23 Å²	23	44.3 Å²	44.3	24%	0.237	23%	0.226	C	C	.	.	S	Bend	trans	87.2	13.5	177.2	0	0	0	0	0	114.6	Y269 S270 R271	Y269-G273 WeakPolarHBondContact CD1-O 3.28Å; S270-G273 PolarHBondContact O-N 3Å; R271-G273 PolarHBondContact O-N 2.95Å
274	A	95.1	Very high	92.9	Very high	56 Å²	56	39.4 Å²	39.4	46%	0.463	21%	0.21	S	C	.	.			trans	-80.5	128.9	174.4	0	0	0	0	0	110.9	Y269 S270 Q276	Y269-A274 CarbonylContact C-O 3.45Å; Y269-A274 WeakPolarHBondContact CA-O 3.45Å; S270-A274 PolarHBondContact N-O 3.01Å; S270-A274 PolarHBondContact OG-N 3.23Å; A274-Q276 PolarHBondContact O-N 3.36Å
275	L	95.7	Very high	92.7	Very high	75 Å²	75	47.5 Å²	47.5	39%	0.393	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	120.3	175.6	179.1	65.4	0	0	0	109.7	V239 A267 Y269 E278	V239-L275 HydrophobicContact CG1-CD1 4.18Å; V239-L275 HydrophobicContact CG1-CD2 4.3Å; V239-L275 HydrophobicContact CG2-CD2 4.29Å; A267-L275 HydrophobicContact CB-CD1 4.16Å; Y269-L275 HydrophobicContact CD1-CB 3.98Å; Y269-L275 HydrophobicContact CD1-CD1 4.33Å; Y269-L275 HydrophobicContact CD2-CD1 4.37Å; Y269-L275 HydrophobicContact CE1-CB 3.62Å; Y269-L275 HydrophobicContact CE1-CD1 3.89Å; Y269-L275 HydrophobicContact CE1-CG 4.32Å; Y269-L275 HydrophobicContact CE2-CD1 3.93Å; L275-E278 HydrophobicContact CD1-CG 4.16Å; L275-E278 HydrophobicContact CD2-CG 4.36Å
276	Q	94.4	Very high	92.4	Very high	82 Å²	82	46.7 Å²	46.7	38%	0.383	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-46.6	178	-68.3	165.6	-46.6	0	0	111.3	D253 C268 Y269 A274 V318	D253-Q276 PolarHBondContact OD1-NE2 3.27Å; D253-Q276 PolarHBondContact OD1-OE1 3.2Å; C268-Q276 PolarHBondContact O-N 2.65Å; C268-Q276 PolarHBondContact SG-OE1 3.23Å; C268-Q276 VanDerWaalsContact SG-OE1 3.4Å; Y269-Q276 VanDerWaalsContact C-OE1 3.27Å; Y269-Q276 PolarHBondContact O-OE1 3.43Å; A274-Q276 PolarHBondContact O-N 3.36Å; Q276-V318 HydrophobicContact CB-CG1 4.1Å
277	S	93.8	Very high	92	Very high	27 Å²	27	48.3 Å²	48.3	19%	0.189	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	155.4	-173.1	54.6	0	0	0	0	112.7	C268 F279	C268-S277 WeakPolarHBondContact CB-OG 3.34Å; C268-S277 PolarHBondContact N-O 2.77Å; C268-S277 PolarHBondContact O-N 3.43Å; S277-F279 WeakPolarHBondContact OG-CE2 3.41Å; S277-F279 WeakPolarHBondContact OG-CZ 3.31Å
278	E	94.6	Very high	91.5	Very high	35 Å²	35	56.1 Å²	56.1	16%	0.164	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	141.5	174.6	-67.8	174.5	-92.4	0	0	109.6	A44 T45 V239 H265 L275	A44-E278 CarbonylContact C-O 3.57Å; A44-E278 WeakPolarHBondContact CA-O 3.45Å; A44-E278 HydrophobicContact CB-CB 4.02Å; T45-E278 PolarHBondContact N-O 2.92Å; V239-E278 HydrophobicContact CG1-CG 4.23Å; H265-E278 IonicContact CE1-OE2 2.66Å; H265-E278 IonicContact NE2-OE2 3.52Å; H265-E278 PolarHBondContact NE2-OE2 2.89Å; L275-E278 HydrophobicContact CD1-CG 4.16Å; L275-E278 HydrophobicContact CD2-CG 4.36Å
279	F	94.3	Very high	91.3	Very high	12 Å²	12	56.4 Å²	56.4	5%	0.053	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	146.2	-179	-56.6	-90.6	0	0	0	110.9	T45 M47 H265 V266 C268 S277 L316	T45-F279 HydrophobicContact CG2-CD1 4.01Å; T45-F279 HydrophobicContact CG2-CE1 4.12Å; T45-F279 CarbonylContact O-C 3.58Å; T45-F279 VanDerWaalsContact O-CA 3.22Å; T45-F279 WeakPolarHBondContact O-CA 3.36Å; M47-F279 HydrophobicContact CE-CB 4.12Å; M47-F279 HydrophobicContact CG-CB 3.83Å; M47-F279 HydrophobicContact SD-CB 3.97Å; H265-F279 CarbonylContact C-O 3.56Å; H265-F279 WeakPolarHBondContact CA-O 3.39Å; H265-F279 PolarHBondContact CD2-O 3.46Å; V266-F279 HydrophobicContact CB-CB 4.41Å; V266-F279 PolarHBondContact N-O 3.31Å; V266-F279 PolarHBondContact O-N 2.67Å; C268-F279 HydrophobicContact CB-CE2 4.28Å; S277-F279 WeakPolarHBondContact OG-CE2 3.41Å; S277-F279 WeakPolarHBondContact OG-CZ 3.31Å; F279-L316 HydrophobicContact CB-CD2 4.07Å; F279-L316 HydrophobicContact CD1-CD2 3.64Å; F279-L316 HydrophobicContact CD2-CB 4.45Å; F279-L316 HydrophobicContact CD2-CD1 3.63Å; F279-L316 HydrophobicContact CD2-CD2 3.9Å; F279-L316 HydrophobicContact CD2-CG 4.2Å; F279-L316 HydrophobicContact CE1-CB 4.2Å; F279-L316 HydrophobicContact CE1-CD2 3.96Å; F279-L316 HydrophobicContact CE2-CB 3.88Å; F279-L316 HydrophobicContact CE2-CD1 3.73Å; F279-L316 HydrophobicContact CE2-CD2 4.16Å; F279-L316 HydrophobicContact CE2-CG 4.14Å; F279-L316 HydrophobicContact CG-CD1 4.18Å; F279-L316 HydrophobicContact CG-CD2 3.61Å; F279-L316 HydrophobicContact CG-CG 4.4Å; F279-L316 HydrophobicContact CZ-CB 3.77Å; F279-L316 HydrophobicContact CZ-CD1 4.42Å; F279-L316 HydrophobicContact CZ-CD2 4.21Å; F279-L316 HydrophobicContact CZ-CG 4.34Å
280	E	93.8	Very high	91.1	Very high	34 Å²	34	56.8 Å²	56.8	16%	0.159	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	141.9	180	-177.3	178.5	118.3	0	0	111.1	A44 T45 P46 M47 R263 F264 P282	A44-E280 HydrophobicContact CB-CB 3.93Å; T45-E280 PolarHBondContact O-N 3.43Å; P46-E280 CarbonylContact C-O 3.53Å; P46-E280 WeakPolarHBondContact CA-O 3.29Å; M47-E280 PolarHBondContact N-O 3.39Å; R263-E280 HydrophobicContact CB-CG 4.16Å; R263-E280 WeakPolarHBondContact CD-OE1 3.18Å; R263-E280 VanDerWaalsContact CZ-CD 3.5Å; R263-E280 IonicContact CZ-OE1 2.67Å; R263-E280 VanDerWaalsContact CZ-OE1 3.3Å; R263-E280 IonicContact CZ-OE2 3.45Å; R263-E280 IonicContact NE-OE1 3.39Å; R263-E280 PolarHBondContact NE-OE1 3.39Å; R263-E280 IonicContact NE-OE2 3.4Å; R263-E280 PolarHBondContact NE-OE2 2.89Å; R263-E280 IonicContact NH1-OE1 3.46Å; R263-E280 IonicContact NH1-OE2 3.73Å; R263-E280 IonicContact NH2-OE1 2.89Å; R263-E280 IonicContact NH2-OE2 3.6Å; R263-E280 PolarHBondContact NH2-OE2 3.01Å; F264-E280 CarbonylContact O-C 3.5Å; F264-E280 WeakPolarHBondContact O-CA 3.29Å; E280-P282 VanDerWaalsContact O-CD 3.27Å; E280-P282 WeakPolarHBondContact O-CD 3.45Å
281	C	91.4	Very high	91.1	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.007	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	108.8	167.6	-179.1	0	0	0	0	110.3	M47 F264 H283 L313	M47-C281 HydrophobicContact CE-CB 4.34Å; F264-C281 HydrophobicContact CB-CB 4.19Å; F264-C281 PolarHBondContact O-N 3Å; C281-H283 VanDerWaalsContact C-N 3.33Å; C281-H283 PolarHBondContact O-N 2.87Å; C281-L313 HydrophobicContact CB-CD2 4.01Å
282	P	85.8	Confident	91.5	Very high	73 Å²	73	51.9 Å²	51.9	47%	0.474	27%	0.268	S	S	.	.			trans	-82	-12.5	-176.9	33.6	-35.7	0	0	0	113.3	P46 M47 E280	P46-P282 HydrophobicContact CB-CG 4.18Å; M47-P282 WeakPolarHBondContact O-CD 3.5Å; E280-P282 VanDerWaalsContact O-CD 3.27Å; E280-P282 WeakPolarHBondContact O-CD 3.45Å
283	H	84.2	Confident	91.8	Very high	105 Å²	105	46.4 Å²	46.4	49%	0.486	24%	0.242	S	C	.	.	S	Bend	trans	-90.8	-23.8	-163.6	-57.8	-60.2	0	0	0	114.3	Q48 I49 C281	Q48-H283 PolarHBondContact OE1-NE2 3.37Å; I49-H283 HydrophobicContact CD1-CB 4.08Å; C281-H283 VanDerWaalsContact C-N 3.33Å; C281-H283 PolarHBondContact O-N 2.87Å
284	V	84.6	Confident	91.9	Very high	22 Å²	22	46.7 Å²	46.7	13%	0.133	24%	0.238	C	C	.	.			trans	-133.8	121.2	-174.5	177.1	0	0	0	0	109.5	I49 V286	I49-V284 HydrophobicContact CD1-CB 4.22Å; I49-V284 HydrophobicContact CD1-CG2 3.35Å; V284-V286 HydrophobicContact CG1-CG1 3.94Å; V284-V286 PolarHBondContact O-N 2.8Å
285	K	89.4	Confident	91.9	Very high	171 Å²	171	44.6 Å²	44.6	74%	0.743	22%	0.22	S	C	*	.			trans	-69.6	115.1	167	-68.4	-175.4	179.9	179.7	0	108.8	N262 N307	N262-K285 VanDerWaalsContact O-CA 3.28Å; N262-K285 WeakPolarHBondContact O-CA 3.11Å; K285-N307 PolarHBondContact O-ND2 2.84Å
286	V	89.8	Confident	91.6	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.006	23%	0.231	C	C	.	.			trans	-110.1	153	176.6	-65.8	0	0	0	0	110.1	N262 F264 V284 A304 N307 L311	N262-V286 CarbonylContact C-O 3.54Å; N262-V286 VanDerWaalsContact C-O 3.24Å; N262-V286 WeakPolarHBondContact CA-O 3.4Å; N262-V286 PolarHBondContact O-N 3.34Å; F264-V286 HydrophobicContact CB-CG2 3.72Å; F264-V286 VanDerWaalsContact N-CG2 3.28Å; V284-V286 HydrophobicContact CG1-CG1 3.94Å; V284-V286 PolarHBondContact O-N 2.8Å; V286-A304 HydrophobicContact CB-CB 4.1Å; V286-A304 HydrophobicContact CG1-CB 3.78Å; V286-N307 WeakPolarHBondContact CA-OD1 3.29Å; V286-L311 HydrophobicContact CG1-CD1 3.61Å
287	S	86.8	Confident	91.4	Very high	35 Å²	35	45.6 Å²	45.6	25%	0.245	23%	0.232	C	C	.	.			trans	-138.8	136	173.7	-177.3	0	0	0	0	110.2	C289 N306 N307	S287-C289 PolarHBondContact O-N 3.11Å; S287-N306 PolarHBondContact O-N 3.48Å; S287-N306 PolarHBondContact OG-ND2 3.23Å; S287-N306 VanDerWaalsContact OG-ND2 3.14Å; S287-N307 PolarHBondContact N-OD1 3.19Å
288	R	87.2	Confident	91.2	Very high	164 Å²	164	45 Å²	45	62%	0.619	23%	0.231	S	C	*	.	S	Bend	trans	51.1	55.2	-179	-62.9	-167.3	174.1	160.3	-3.7	111.8	S259 K305	S259-R288 PolarHBondContact OG-N 2.83Å; R288-K305 WeakPolarHBondContact O-CB 3.39Å
289	C	92	Very high	91.1	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.034	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	150.9	167.4	-69.3	0	0	0	0	109.9	N244 S259 F264 S287 L303	N244-C289 VanDerWaalsContact CB-O 3.27Å; N244-C289 WeakPolarHBondContact CB-O 3.27Å; N244-C289 PolarHBondContact ND2-O 3.4Å; S259-C289 PolarHBondContact OG-N 3.45Å; S259-C289 VanDerWaalsContact OG-N 3.17Å; F264-C289 HydrophobicContact CD2-CB 4.24Å; F264-C289 HydrophobicContact CE2-CB 4.4Å; S287-C289 PolarHBondContact O-N 3.11Å; C289-L303 CarbonylContact C-O 3.59Å; C289-L303 VanDerWaalsContact CA-O 3.28Å; C289-L303 WeakPolarHBondContact CA-O 3.47Å
290	C	93.1	Very high	91.2	Very high	16 Å²	16	45 Å²	45	11%	0.108	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	124	176.5	53.7	0	0	0	0	108.4	H67 F69 L303	H67-C290 VanDerWaalsContact C-SG 3.59Å; H67-C290 WeakPolarHBondContact O-CB 3.39Å; H67-C290 PolarHBondContact O-SG 3.14Å; F69-C290 VanDerWaalsContact CD1-O 3.32Å; F69-C290 WeakPolarHBondContact CD1-O 3.47Å; F69-C290 WeakPolarHBondContact CE1-O 3.35Å; C290-L303 PolarHBondContact N-O 3.15Å; C290-L303 WeakPolarHBondContact SG-CD2 3.37Å; C290-L303 PolarHBondContact SG-O 3.35Å
291	G	94.5	Very high	91.4	Very high	5 Å²	5	43.4 Å²	43.4	5%	0.052	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	75.5	154.3	-174.8	0	0	0	0	0	114.1	N244 T302	N244-G291 PolarHBondContact O-N 2.88Å; G291-T302 PolarHBondContact O-OG1 2.96Å
292	L	97	Very high	91.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	131.2	166.7	-179.7	154.1	0	0	0	105.9	I246 D247 L255 F264 V266 I294 V300 V301	I246-L292 CarbonylContact C-O 3.58Å; I246-L292 VanDerWaalsContact O-O 3.06Å; D247-L292 HydrophobicContact CB-CD2 3.72Å; L255-L292 HydrophobicContact CB-CD2 3.95Å; F264-L292 HydrophobicContact CZ-CD1 3.96Å; F264-L292 HydrophobicContact CZ-CG 4.47Å; V266-L292 HydrophobicContact CB-CD1 4.31Å; V266-L292 HydrophobicContact CG1-CD1 3.78Å; V266-L292 HydrophobicContact CG2-CD1 3.6Å; L292-I294 HydrophobicContact CD2-CG1 4.03Å; L292-V300 HydrophobicContact CD1-CG1 4.12Å; L292-V300 HydrophobicContact CG-CG1 3.99Å; L292-V301 WeakPolarHBondContact CA-O 3.38Å
293	K	97.3	Very high	92.2	Very high	33 Å²	33	39.9 Å²	39.9	14%	0.143	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	147.4	172.1	-66.2	-66.2	160.2	-140.1	0	111.5	F69 L71 I246 D247 V301	F69-K293 HydrophobicContact CE2-CB 3.94Å; F69-K293 HydrophobicContact CE2-CG 3.88Å; F69-K293 HydrophobicContact CZ-CB 4.22Å; F69-K293 HydrophobicContact CZ-CG 4.09Å; L71-K293 HydrophobicContact CD1-CB 3.73Å; L71-K293 HydrophobicContact CG-CB 3.72Å; L71-K293 HydrophobicContact CG-CG 4.29Å; I246-K293 PolarHBondContact O-NZ 2.83Å; D247-K293 HydrophobicContact CB-CD 4.37Å; D247-K293 WeakPolarHBondContact OD1-CD 3.48Å; D247-K293 IonicContact OD1-NZ 3.13Å; D247-K293 PolarHBondContact OD1-NZ 3.16Å; D247-K293 WeakPolarHBondContact OD2-CA 3.18Å; D247-K293 WeakPolarHBondContact OD2-CD 3.31Å; K293-V301 PolarHBondContact N-O 2.67Å; K293-V301 PolarHBondContact O-N 2.95Å
294	I	95.4	Very high	92.8	Very high	29 Å²	29	34.9 Å²	34.9	15%	0.149	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129	-178.4	-48.8	158.6	0	0	0	108	D247 L255 L292 Y299	D247-I294 HydrophobicContact CB-CD1 3.92Å; D247-I294 HydrophobicContact CB-CG1 3.99Å; D247-I294 PolarHBondContact OD2-N 2.77Å; L255-I294 HydrophobicContact CB-CD1 3.99Å; L255-I294 HydrophobicContact CD1-CD1 3.39Å; L255-I294 HydrophobicContact CD2-CD1 3.32Å; L255-I294 HydrophobicContact CD2-CG1 3.81Å; L255-I294 HydrophobicContact CG-CD1 3.72Å; L292-I294 HydrophobicContact CD2-CG1 4.03Å; I294-Y299 WeakPolarHBondContact CA-O 3.22Å
295	T	94.2	Very high	93.1	Very high	12 Å²	12	35.6 Å²	35.6	7%	0.074	18%	0.177	C	C	.	.			trans	-75.6	164.4	172.1	61.8	0	0	0	0	110.8	L71 E297 G298 Y299 V301	L71-T295 HydrophobicContact CD1-CG2 4.06Å; T295-E297 PolarHBondContact O-N 3.1Å; T295-G298 VanDerWaalsContact O-CA 3.31Å; T295-G298 WeakPolarHBondContact O-CA 3.49Å; T295-G298 PolarHBondContact O-N 3.49Å; T295-G298 PolarHBondContact OG1-N 3.42Å; T295-Y299 PolarHBondContact N-O 3.37Å; T295-Y299 WeakPolarHBondContact OG1-CA 3.43Å; T295-Y299 VanDerWaalsContact OG1-CB 3.25Å; T295-Y299 WeakPolarHBondContact OG1-CB 3.36Å; T295-Y299 PolarHBondContact OG1-N 3.07Å; T295-Y299 PolarHBondContact OG1-O 3.41Å; T295-V301 HydrophobicContact CG2-CG2 4.18Å
296	S	90.7	Very high	93.2	Very high	90 Å²	90	30.8 Å²	30.8	63%	0.629	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-26.8	172	63.1	0	0	0	0	113.2	E75 G298	E75-S296 WeakPolarHBondContact OE1-CA 3.46Å; E75-S296 WeakPolarHBondContact OE1-CB 3.43Å; E75-S296 PolarHBondContact OE1-N 3.36Å; E75-S296 PolarHBondContact OE1-OG 3.09Å; S296-G298 PolarHBondContact O-N 2.77Å
297	E	89	Confident	93.5	Very high	87 Å²	87	33.4 Å²	33.4	41%	0.407	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-2.2	171.4	-62.6	178.8	141.2	0	0	112.4	K92 T295 Y299 T315	K92-E297 VanDerWaalsContact NZ-CD 3.33Å; K92-E297 IonicContact NZ-OE1 3.3Å; K92-E297 PolarHBondContact NZ-OE1 3.47Å; K92-E297 IonicContact NZ-OE2 2.74Å; K92-E297 PolarHBondContact NZ-OE2 2.72Å; T295-E297 PolarHBondContact O-N 3.1Å; E297-Y299 HydrophobicContact CB-CD2 4.19Å; E297-Y299 HydrophobicContact CB-CE1 4.26Å; E297-Y299 HydrophobicContact CB-CE2 3.93Å; E297-Y299 HydrophobicContact CB-CG 4.5Å; E297-Y299 WeakPolarHBondContact OE2-CE2 3.24Å; E297-T315 PolarHBondContact O-OG1 3.26Å
298	G	89.9	Confident	93.9	Very high	16 Å²	16	33.2 Å²	33.2	17%	0.165	17%	0.169	C	C	.	.			trans	82.9	5	177.8	0	0	0	0	0	114.8	T295 S296 T315	T295-G298 VanDerWaalsContact O-CA 3.31Å; T295-G298 WeakPolarHBondContact O-CA 3.49Å; T295-G298 PolarHBondContact O-N 3.49Å; T295-G298 PolarHBondContact OG1-N 3.42Å; S296-G298 PolarHBondContact O-N 2.77Å; G298-T315 VanDerWaalsContact O-CA 3.31Å; G298-T315 WeakPolarHBondContact O-CA 3.46Å
299	Y	93.6	Very high	94.3	Very high	46 Å²	46	25.8 Å²	25.8	18%	0.18	14%	0.141	C	C	.	.			trans	-65.3	136.7	175.8	-53.2	-29.7	0	0	0	111.5	I294 T295 E297 V312 L313 T315	I294-Y299 WeakPolarHBondContact CA-O 3.22Å; T295-Y299 PolarHBondContact N-O 3.37Å; T295-Y299 WeakPolarHBondContact OG1-CA 3.43Å; T295-Y299 VanDerWaalsContact OG1-CB 3.25Å; T295-Y299 WeakPolarHBondContact OG1-CB 3.36Å; T295-Y299 PolarHBondContact OG1-N 3.07Å; T295-Y299 PolarHBondContact OG1-O 3.41Å; E297-Y299 HydrophobicContact CB-CD2 4.19Å; E297-Y299 HydrophobicContact CB-CE1 4.26Å; E297-Y299 HydrophobicContact CB-CE2 3.93Å; E297-Y299 HydrophobicContact CB-CG 4.5Å; E297-Y299 WeakPolarHBondContact OE2-CE2 3.24Å; Y299-V312 HydrophobicContact CD2-CG1 4.47Å; Y299-V312 HydrophobicContact CG-CG1 4.5Å; Y299-L313 VanDerWaalsContact CA-O 3.29Å; Y299-L313 WeakPolarHBondContact CA-O 3.44Å; Y299-L313 VanDerWaalsContact CB-O 3.31Å; Y299-L313 WeakPolarHBondContact CB-O 3.33Å; Y299-T315 WeakPolarHBondContact CD1-OG1 3.43Å; Y299-T315 WeakPolarHBondContact CE1-OG1 3.38Å
300	V	95.8	Very high	94.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	126.7	176.5	-178.4	0	0	0	0	109.4	F264 V266 L292 V312 L313 L316	F264-V300 HydrophobicContact CE1-CG1 3.87Å; F264-V300 HydrophobicContact CZ-CG1 4.17Å; V266-V300 HydrophobicContact CG2-CG1 4.35Å; L292-V300 HydrophobicContact CD1-CG1 4.12Å; L292-V300 HydrophobicContact CG-CG1 3.99Å; V300-V312 CarbonylContact O-C 3.57Å; V300-V312 WeakPolarHBondContact O-CA 3.4Å; V300-L313 HydrophobicContact CB-CB 4.27Å; V300-L313 PolarHBondContact N-O 3.41Å; V300-L313 VanDerWaalsContact N-O 3.1Å; V300-L313 PolarHBondContact O-N 2.73Å; V300-L316 HydrophobicContact CG2-CD1 3.76Å; V300-L316 HydrophobicContact CG2-CD2 4.04Å; V300-L316 HydrophobicContact CG2-CG 3.62Å
301	V	97.6	Very high	94.7	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135.4	176.4	-170.5	0	0	0	0	108.9	F69 L71 I77 L292 K293 T295 V310 L311 V312	F69-V301 HydrophobicContact CD2-CG1 4.31Å; F69-V301 HydrophobicContact CE2-CB 3.99Å; F69-V301 HydrophobicContact CE2-CG1 3.66Å; F69-V301 HydrophobicContact CZ-CB 4.36Å; F69-V301 HydrophobicContact CZ-CG1 4.19Å; F69-V301 VanDerWaalsContact CZ-O 3.29Å; F69-V301 WeakPolarHBondContact CZ-O 3.36Å; L71-V301 HydrophobicContact CD2-CG2 4.31Å; I77-V301 HydrophobicContact CD1-CG1 3.99Å; I77-V301 HydrophobicContact CG1-CG1 4.33Å; I77-V301 HydrophobicContact CG2-CG1 4.42Å; L292-V301 WeakPolarHBondContact CA-O 3.38Å; K293-V301 PolarHBondContact N-O 2.67Å; K293-V301 PolarHBondContact O-N 2.95Å; T295-V301 HydrophobicContact CG2-CG2 4.18Å; V301-V310 HydrophobicContact CG1-CG1 3.74Å; V301-L311 WeakPolarHBondContact CA-O 3.38Å; V301-V312 HydrophobicContact CG1-CG2 4.31Å; V301-V312 HydrophobicContact CG2-CG1 4.34Å; V301-V312 HydrophobicContact CG2-CG2 4.2Å
302	T	97.4	Very high	94.8	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	155.8	170.9	-169.5	0	0	0	0	111.2	F264 G291 V310 L311	F264-T302 HydrophobicContact CD1-CG2 3.9Å; F264-T302 HydrophobicContact CD2-CG2 3.86Å; F264-T302 HydrophobicContact CE1-CG2 3.67Å; F264-T302 HydrophobicContact CE2-CG2 3.64Å; F264-T302 WeakPolarHBondContact CE2-OG1 3.48Å; F264-T302 HydrophobicContact CG-CG2 3.99Å; F264-T302 VanDerWaalsContact CZ-CB 3.45Å; F264-T302 HydrophobicContact CZ-CG2 3.53Å; G291-T302 PolarHBondContact O-OG1 2.96Å; T302-V310 WeakPolarHBondContact O-CA 3.38Å; T302-L311 HydrophobicContact CG2-CB 4.01Å; T302-L311 HydrophobicContact CG2-CD1 4.32Å; T302-L311 PolarHBondContact N-O 3.23Å; T302-L311 PolarHBondContact O-N 3.31Å
303	L	97.5	Very high	94.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	110.8	177.6	175	64.3	0	0	0	109.9	P66 F69 V79 C289 C290 K305 V310	P66-L303 HydrophobicContact CB-CD1 3.99Å; P66-L303 HydrophobicContact CB-CD2 3.73Å; P66-L303 HydrophobicContact CB-CG 4.26Å; P66-L303 HydrophobicContact CG-CD1 3.67Å; P66-L303 HydrophobicContact CG-CD2 4.11Å; P66-L303 HydrophobicContact CG-CG 4.1Å; F69-L303 HydrophobicContact CB-CD2 4.28Å; F69-L303 HydrophobicContact CD1-CB 3.51Å; F69-L303 HydrophobicContact CD1-CD2 4.33Å; F69-L303 HydrophobicContact CE1-CB 4.01Å; F69-L303 HydrophobicContact CG-CB 4.25Å; V79-L303 HydrophobicContact CG1-CD1 4.38Å; V79-L303 HydrophobicContact CG1-CD2 4.12Å; C289-L303 CarbonylContact C-O 3.59Å; C289-L303 VanDerWaalsContact CA-O 3.28Å; C289-L303 WeakPolarHBondContact CA-O 3.47Å; C290-L303 PolarHBondContact N-O 3.15Å; C290-L303 WeakPolarHBondContact SG-CD2 3.37Å; C290-L303 PolarHBondContact SG-O 3.35Å; L303-K305 PolarHBondContact O-N 3.37Å; L303-K305 VanDerWaalsContact O-N 3.12Å; L303-V310 HydrophobicContact CD1-CG2 3.79Å
304	A	95.3	Very high	94.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	85.8	176.1	0	0	0	0	0	110.2	V286 N306 N307 H308 H309	V286-A304 HydrophobicContact CB-CB 4.1Å; V286-A304 HydrophobicContact CG1-CB 3.78Å; A304-N306 PolarHBondContact O-N 3.3Å; A304-N307 HydrophobicContact CB-CB 4.05Å; A304-N307 CarbonylContact O-C 3.59Å; A304-N307 PolarHBondContact O-N 3.24Å; A304-H308 PolarHBondContact O-N 3.14Å; A304-H309 PolarHBondContact N-O 2.97Å
305	K	92.6	Very high	93.1	Very high	37 Å²	37	25.3 Å²	25.3	16%	0.161	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-48.9	-53.8	-172.1	172.9	176.3	159.7	175.9	0	114.2	P66 H67 R288 L303 N307 H308	P66-K305 WeakPolarHBondContact O-CB 3.25Å; P66-K305 VanDerWaalsContact O-CG 3.29Å; P66-K305 WeakPolarHBondContact O-CG 3.09Å; H67-K305 VanDerWaalsContact CD2-CE 3.48Å; H67-K305 WeakPolarHBondContact CD2-CE 3.04Å; H67-K305 PolarHBondContact CD2-NZ 3.05Å; H67-K305 PolarHBondContact CE1-NZ 3.48Å; H67-K305 WeakPolarHBondContact NE2-CE 3.29Å; H67-K305 PolarHBondContact NE2-NZ 2.82Å; R288-K305 WeakPolarHBondContact O-CB 3.39Å; L303-K305 PolarHBondContact O-N 3.37Å; L303-K305 VanDerWaalsContact O-N 3.12Å; K305-N307 PolarHBondContact O-N 3.27Å; K305-H308 PolarHBondContact O-N 3.09Å
306	N	91.4	Very high	92	Very high	69 Å²	69	25.7 Å²	25.7	37%	0.369	14%	0.141	S	C	.	.	G	3₁₀ helix	trans	-72.9	-17.2	-175.3	-73.2	-8.4	0	0	0	112.6	S287 A304 H308	S287-N306 PolarHBondContact O-N 3.48Å; S287-N306 PolarHBondContact OG-ND2 3.23Å; S287-N306 VanDerWaalsContact OG-ND2 3.14Å; A304-N306 PolarHBondContact O-N 3.3Å; N306-H308 PolarHBondContact O-CD2 3.42Å
307	N	94.4	Very high	90.5	Very high	57 Å²	57	29.9 Å²	29.9	31%	0.305	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-100.1	-2.4	178.9	-54	78.8	0	0	0	112.9	K285 V286 S287 A304 K305 H309	K285-N307 PolarHBondContact O-ND2 2.84Å; V286-N307 WeakPolarHBondContact CA-OD1 3.29Å; S287-N307 PolarHBondContact N-OD1 3.19Å; A304-N307 HydrophobicContact CB-CB 4.05Å; A304-N307 CarbonylContact O-C 3.59Å; A304-N307 PolarHBondContact O-N 3.24Å; K305-N307 PolarHBondContact O-N 3.27Å; N307-H309 VanDerWaalsContact C-N 3.3Å; N307-H309 WeakPolarHBondContact CB-CE1 3.4Å; N307-H309 VanDerWaalsContact CB-ND1 3.25Å; N307-H309 WeakPolarHBondContact CB-ND1 3.32Å; N307-H309 PolarHBondContact O-N 3.36Å; N307-H309 PolarHBondContact O-ND1 3.09Å
308	H	96.4	Very high	88.8	Confident	30 Å²	30	27.8 Å²	27.8	14%	0.139	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	39.2	176.4	-53.8	-95	0	0	0	113.8	G54 S55 L56 F63 S65 A304 K305 N306	G54-H308 CarbonylContact C-O 3.03Å; G54-H308 WeakPolarHBondContact CA-O 3.42Å; S55-H308 WeakPolarHBondContact CA-O 3.49Å; S55-H308 PolarHBondContact N-O 2.85Å; S55-H308 VanDerWaalsContact N-O 3.09Å; L56-H308 HydrophobicContact CB-CB 4.23Å; L56-H308 WeakPolarHBondContact CD1-CE1 3.44Å; F63-H308 HydrophobicContact CB-CB 4.38Å; F63-H308 WeakPolarHBondContact CD2-O 3.16Å; F63-H308 PolarHBondContact O-ND1 3.14Å; S65-H308 PolarHBondContact N-CE1 3.45Å; A304-H308 PolarHBondContact O-N 3.14Å; K305-H308 PolarHBondContact O-N 3.09Å; N306-H308 PolarHBondContact O-CD2 3.42Å
309	H	95.3	Very high	86.7	Confident	8 Å²	8	38.6 Å²	38.6	4%	0.037	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	151.3	176.1	58.7	-105	0	0	0	112.7	K52 F53 A304 N307 L311	K52-H309 HydrophobicContact CG-CB 4.27Å; F53-H309 CarbonylContact O-C 3.52Å; F53-H309 WeakPolarHBondContact O-CA 3.49Å; F53-H309 WeakPolarHBondContact O-CB 3.45Å; A304-H309 PolarHBondContact N-O 2.97Å; N307-H309 VanDerWaalsContact C-N 3.3Å; N307-H309 WeakPolarHBondContact CB-CE1 3.4Å; N307-H309 VanDerWaalsContact CB-ND1 3.25Å; N307-H309 WeakPolarHBondContact CB-ND1 3.32Å; N307-H309 PolarHBondContact O-N 3.36Å; N307-H309 PolarHBondContact O-ND1 3.09Å; H309-L311 VanDerWaalsContact CD2-CD2 3.43Å; H309-L311 WeakPolarHBondContact CD2-CD2 2.87Å
310	V	97.8	Very high	86.3	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	140.2	165.6	176.9	0	0	0	0	108.2	K52 F53 F63 I77 V79 V301 T302 L303 V312	K52-V310 WeakPolarHBondContact CA-O 3.35Å; F53-V310 HydrophobicContact CD1-CB 4.2Å; F53-V310 HydrophobicContact CD1-CG1 4.5Å; F53-V310 HydrophobicContact CD2-CB 4.33Å; F53-V310 HydrophobicContact CE1-CB 3.68Å; F53-V310 HydrophobicContact CE1-CG1 3.63Å; F53-V310 HydrophobicContact CE1-CG2 4.48Å; F53-V310 HydrophobicContact CE2-CB 3.82Å; F53-V310 HydrophobicContact CE2-CG1 4.41Å; F53-V310 HydrophobicContact CE2-CG2 3.8Å; F53-V310 HydrophobicContact CZ-CB 3.48Å; F53-V310 VanDerWaalsContact CZ-CB 3.48Å; F53-V310 HydrophobicContact CZ-CG1 3.59Å; F53-V310 HydrophobicContact CZ-CG2 3.78Å; F53-V310 PolarHBondContact N-O 2.9Å; F53-V310 PolarHBondContact O-N 3.43Å; F63-V310 HydrophobicContact CE2-CG2 4.17Å; F63-V310 HydrophobicContact CZ-CG2 4.42Å; I77-V310 HydrophobicContact CD1-CG1 4.25Å; I77-V310 HydrophobicContact CG2-CG1 4.24Å; I77-V310 HydrophobicContact CG2-CG2 4.39Å; V79-V310 HydrophobicContact CG2-CG2 3.99Å; V301-V310 HydrophobicContact CG1-CG1 3.74Å; T302-V310 WeakPolarHBondContact O-CA 3.38Å; L303-V310 HydrophobicContact CD1-CG2 3.79Å; V310-V312 HydrophobicContact CG1-CG2 4.41Å
311	L	96.6	Very high	85.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	129	169.6	-61.4	178.1	0	0	0	108.8	I49 K52 V286 V301 T302 H309 L313	I49-L311 HydrophobicContact CD1-CD2 4.28Å; K52-L311 HydrophobicContact CB-CD2 4.01Å; K52-L311 HydrophobicContact CD-CD2 3.94Å; K52-L311 HydrophobicContact CG-CD2 3.81Å; V286-L311 HydrophobicContact CG1-CD1 3.61Å; V301-L311 WeakPolarHBondContact CA-O 3.38Å; T302-L311 HydrophobicContact CG2-CB 4.01Å; T302-L311 HydrophobicContact CG2-CD1 4.32Å; T302-L311 PolarHBondContact N-O 3.23Å; T302-L311 PolarHBondContact O-N 3.31Å; H309-L311 VanDerWaalsContact CD2-CD2 3.43Å; H309-L311 WeakPolarHBondContact CD2-CD2 2.87Å; L311-L313 HydrophobicContact CB-CD1 4.48Å; L311-L313 HydrophobicContact CB-CG 4.45Å
312	V	96.5	Very high	85.2	Confident	4 Å²	4	42.4 Å²	42.4	2%	0.024	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	119.7	165.5	-176.2	0	0	0	0	107.4	R50 C51 F53 I77 Y299 V300 V301 V310	R50-V312 HydrophobicContact CB-CG1 4.48Å; R50-V312 PolarHBondContact N-O 2.99Å; C51-V312 PolarHBondContact N-O 3.25Å; C51-V312 PolarHBondContact O-N 3.47Å; C51-V312 WeakPolarHBondContact SG-CB 3.36Å; C51-V312 WeakPolarHBondContact SG-CG2 3.38Å; F53-V312 HydrophobicContact CE1-CG2 4.34Å; I77-V312 HydrophobicContact CD1-CG2 3.81Å; Y299-V312 HydrophobicContact CD2-CG1 4.47Å; Y299-V312 HydrophobicContact CG-CG1 4.5Å; V300-V312 CarbonylContact O-C 3.57Å; V300-V312 WeakPolarHBondContact O-CA 3.4Å; V301-V312 HydrophobicContact CG1-CG2 4.31Å; V301-V312 HydrophobicContact CG2-CG1 4.34Å; V301-V312 HydrophobicContact CG2-CG2 4.2Å; V310-V312 HydrophobicContact CG1-CG2 4.41Å
313	L	94.8	Very high	84.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	153.8	-172.6	-63	151.5	0	0	0	109.5	M47 Q48 I49 F264 C281 Y299 V300 L311	M47-L313 HydrophobicContact CB-CB 4.35Å; M47-L313 HydrophobicContact CB-CD2 4.04Å; M47-L313 HydrophobicContact CE-CD1 4.17Å; M47-L313 HydrophobicContact SD-CB 4.28Å; M47-L313 HydrophobicContact SD-CD1 4.06Å; Q48-L313 CarbonylContact O-C 3.57Å; Q48-L313 VanDerWaalsContact O-CA 3.3Å; Q48-L313 WeakPolarHBondContact O-CA 3.33Å; I49-L313 HydrophobicContact CB-CD2 4.5Å; I49-L313 HydrophobicContact CG1-CD2 3.69Å; F264-L313 HydrophobicContact CD1-CD1 3.39Å; F264-L313 HydrophobicContact CE1-CD1 3.51Å; C281-L313 HydrophobicContact CB-CD2 4.01Å; Y299-L313 VanDerWaalsContact CA-O 3.29Å; Y299-L313 WeakPolarHBondContact CA-O 3.44Å; Y299-L313 VanDerWaalsContact CB-O 3.31Å; Y299-L313 WeakPolarHBondContact CB-O 3.33Å; V300-L313 HydrophobicContact CB-CB 4.27Å; V300-L313 PolarHBondContact N-O 3.41Å; V300-L313 VanDerWaalsContact N-O 3.1Å; V300-L313 PolarHBondContact O-N 2.73Å; L311-L313 HydrophobicContact CB-CD1 4.48Å; L311-L313 HydrophobicContact CB-CG 4.45Å
314	N	89.6	Confident	83.6	Confident	45 Å²	45	47.7 Å²	47.7	24%	0.241	23%	0.228	C	C	.	.			trans	-62.3	162.9	-179.6	66.9	-30.6	0	0	0	113.4	M47 Q48 R50	M47-N314 WeakPolarHBondContact CA-OD1 3.48Å; Q48-N314 HydrophobicContact CB-CB 4.44Å; Q48-N314 PolarHBondContact N-OD1 2.87Å; Q48-N314 PolarHBondContact O-N 2.84Å; Q48-N314 PolarHBondContact O-OD1 3.21Å; R50-N314 HydrophobicContact CG-CB 4.29Å
315	T	69.8	Low	82.9	Confident	30 Å²	30	50.9 Å²	50.9	18%	0.184	24%	0.243	C	C	.	.			trans	-58	133.5	-177.1	-49.2	0	0	0	0	112.3	E297 G298 Y299 Y317	E297-T315 PolarHBondContact O-OG1 3.26Å; G298-T315 VanDerWaalsContact O-CA 3.31Å; G298-T315 WeakPolarHBondContact O-CA 3.46Å; Y299-T315 WeakPolarHBondContact CD1-OG1 3.43Å; Y299-T315 WeakPolarHBondContact CE1-OG1 3.38Å; T315-Y317 PolarHBondContact O-N 3.23Å
316	L	69.3	Low	82.2	Confident	20 Å²	20	51.9 Å²	51.9	11%	0.105	25%	0.249	C	C	.	.			trans	-81.9	105	167.3	-50.1	-170.9	0	0	0	107.4	M47 L255 V266 F279 V300 V318	M47-L316 HydrophobicContact CG-CD2 3.93Å; M47-L316 HydrophobicContact SD-CD2 3.75Å; L255-L316 HydrophobicContact CD2-CD1 3.38Å; L255-L316 HydrophobicContact CD2-CG 4.42Å; L255-L316 HydrophobicContact CG-CD1 4.45Å; V266-L316 HydrophobicContact CB-CD1 4.48Å; V266-L316 HydrophobicContact CG1-CD1 3.91Å; F279-L316 HydrophobicContact CB-CD2 4.07Å; F279-L316 HydrophobicContact CD1-CD2 3.64Å; F279-L316 HydrophobicContact CD2-CB 4.45Å; F279-L316 HydrophobicContact CD2-CD1 3.63Å; F279-L316 HydrophobicContact CD2-CD2 3.9Å; F279-L316 HydrophobicContact CD2-CG 4.2Å; F279-L316 HydrophobicContact CE1-CB 4.2Å; F279-L316 HydrophobicContact CE1-CD2 3.96Å; F279-L316 HydrophobicContact CE2-CB 3.88Å; F279-L316 HydrophobicContact CE2-CD1 3.73Å; F279-L316 HydrophobicContact CE2-CD2 4.16Å; F279-L316 HydrophobicContact CE2-CG 4.14Å; F279-L316 HydrophobicContact CG-CD1 4.18Å; F279-L316 HydrophobicContact CG-CD2 3.61Å; F279-L316 HydrophobicContact CG-CG 4.4Å; F279-L316 HydrophobicContact CZ-CB 3.77Å; F279-L316 HydrophobicContact CZ-CD1 4.42Å; F279-L316 HydrophobicContact CZ-CD2 4.21Å; F279-L316 HydrophobicContact CZ-CG 4.34Å; V300-L316 HydrophobicContact CG2-CD1 3.76Å; V300-L316 HydrophobicContact CG2-CD2 4.04Å; V300-L316 HydrophobicContact CG2-CG 3.62Å; L316-V318 PolarHBondContact O-N 3.12Å
317	Y	61	Low	81.4	Confident	178 Å²	178	50.5 Å²	50.5	70%	0.698	24%	0.239	S	C	*	.			trans	-77.9	99.3	165.8	-65.6	-81.3	0	0	0	107	T315	T315-Y317 PolarHBondContact O-N 3.23Å
318	V	53	Low	80.4	Confident	43 Å²	43	50 Å²	50	26%	0.261	23%	0.234	S	C	.	.			trans	-80.9	116.1	166	-167	0	0	0	0	105.3	C268 Q276 L316	C268-V318 HydrophobicContact CB-CG2 4.41Å; C268-V318 VanDerWaalsContact SG-CG2 3.53Å; Q276-V318 HydrophobicContact CB-CG1 4.1Å; L316-V318 PolarHBondContact O-N 3.12Å
319	H	44.3	Very low	78.9	Confident	242 Å²	242	51.8 Å²	51.8	100%	1.12	24%	0.243	S	C	*	.			trans	-81.5	0	177.4	-76.1	-57.8	0	0	0	111.4

Retrieved 319 of 319 residues in 171 ms (Link to these results)

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