A0A087X5B0_POEFO Loading...

Spindlin-Z-like

AlphaFold DB (A0A3B3W1B6), UniProt , Accession A0A087X5B0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 261 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.4	Very low	32.4	Very low	229 Å²	229	146.1 Å²	146.1	100%	1.128	84%	0.84	S	S	*	*				0	164.5	0	-72.9	-167.9	-177.7	0	0	109.7	T3	M1-T3 PolarHBondContact O-N 3.3Å
2	K	29.8	Very low	32.8	Very low	169 Å²	169	154.3 Å²	154.3	74%	0.735	85%	0.847	S	S	*	*			trans	-76.3	117.8	-166.1	-71.9	-174.6	172.7	-172.9	0	114.8	E143	K2-E143 WeakPolarHBondContact CE-OE1 3.32Å; K2-E143 WeakPolarHBondContact CE-OE2 3.33Å; K2-E143 WeakPolarHBondContact CG-OE1 3.44Å
3	T	37.2	Very low	32.7	Very low	121 Å²	121	152.3 Å²	152.3	74%	0.742	85%	0.846	S	S	*	*			trans	-86.7	143.9	162.7	54.8	0	0	0	0	110.6	M1	M1-T3 PolarHBondContact O-N 3.3Å
4	P	40.3	Very low	32.4	Very low	124 Å²	124	158.8 Å²	158.8	81%	0.805	85%	0.851	S	S	*	*			trans	-127.7	87.6	169.9	36.6	-22.6	0	0	0	113	K6	P4-K6 PolarHBondContact O-N 2.88Å
5	F	31	Very low	32	Very low	197 Å²	197	154.5 Å²	154.5	86%	0.864	85%	0.846	S	S	*	*			trans	-70.4	112.4	161.2	-84.3	-85.6	0	0	0	110.4
6	K	29.7	Very low	31.9	Very low	203 Å²	203	155.3 Å²	155.3	88%	0.883	85%	0.849	S	S	*	*			trans	177.3	126.6	142.6	-101.8	155.3	-174.9	169.6	0	113.8	P4	P4-K6 PolarHBondContact O-N 2.88Å
7	S	37.4	Very low	31.6	Very low	125 Å²	125	150.4 Å²	150.4	87%	0.874	84%	0.843	S	S	*	*			trans	-85.6	138.3	164.7	-53.1	0	0	0	0	111.5
8	P	31.7	Very low	31.2	Very low	111 Å²	111	145.2 Å²	145.2	72%	0.721	83%	0.829	S	S	*	*			trans	-117.1	151.4	158.2	35.6	-26.4	0	0	0	112.4
9	A	27.9	Very low	31.2	Very low	106 Å²	106	147 Å²	147	88%	0.876	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-75.9	166.1	-173.8	0	0	0	0	0	114.8
10	A	31	Very low	31	Very low	99 Å²	99	145.2 Å²	145.2	82%	0.818	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-90.6	148.1	-169.9	0	0	0	0	0	115.3
11	P	29.5	Very low	30.7	Very low	123 Å²	123	141.8 Å²	141.8	80%	0.799	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-96.3	154.5	156	-2.4	22.9	0	0	0	112.7
12	R	37.1	Very low	30.4	Very low	244 Å²	244	137.5 Å²	137.5	92%	0.921	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-84.2	160.2	173.9	-58	172.3	179.5	162.3	-2.1	111.8
13	P	30.5	Very low	30.2	Very low	129 Å²	129	135 Å²	135	84%	0.838	81%	0.813	S	S	*	*				-129.4	-178.1	129.1	37	-28.5	0	0	0	113.6
14	R	28.6	Very low	29.6	Very low	243 Å²	243	132.8 Å²	132.8	92%	0.917	81%	0.808	S	S	*	*			trans	-118.8	142.7	-172.1	-78.6	175.7	163.9	166.1	-7.1	112.9
15	A	27.4	Very low	28.8	Very low	94 Å²	94	133.6 Å²	133.6	78%	0.777	81%	0.805	S	S	*	*			trans	52.2	119.6	131.3	0	0	0	0	0	123.1
16	D	29.4	Very low	28.5	Very low	167 Å²	167	131.3 Å²	131.3	89%	0.893	80%	0.799	S	S	*	*				82.5	152.4	126.5	-148.5	0.8	0	0	0	120.5
17	G	26.9	Very low	28.3	Very low	72 Å²	72	128.3 Å²	128.3	74%	0.742	79%	0.79	S	S	*	*			trans	173.4	-1.2	-174.5	0	0	0	0	0	122.8
18	G	25.4	Very low	27.8	Very low	57 Å²	57	131.1 Å²	131.1	59%	0.588	79%	0.786	S	S	*	*			trans	72.4	142.6	153.8	0	0	0	0	0	124.8
19	H	30.2	Very low	27.7	Very low	180 Å²	180	135.3 Å²	135.3	83%	0.833	79%	0.793	S	S	*	*			trans	76.3	92.8	132.5	-69.6	-71.9	0	0	0	125.9
20	S	26.8	Very low	27.6	Very low	111 Å²	111	140.2 Å²	140.2	78%	0.776	80%	0.795	S	S	*	*				47	129.9	113.5	63.4	0	0	0	0	124.2
21	G	25.3	Very low	27.7	Very low	74 Å²	74	142.9 Å²	142.9	76%	0.763	80%	0.795	S	S	*	*			trans	-172.1	144.7	158.7	0	0	0	0	0	112.9
22	V	24.6	Very low	28.3	Very low	138 Å²	138	141.7 Å²	141.7	84%	0.836	79%	0.788	S	S	*	*			trans	-146.5	150.3	-166.5	176.5	0	0	0	0	113.8
23	S	26.3	Very low	28.2	Very low	116 Å²	116	139.4 Å²	139.4	81%	0.811	79%	0.787	S	S	*	*			trans	71.2	164.2	164.8	-82.2	0	0	0	0	119.1
24	A	24	Very low	28.6	Very low	76 Å²	76	142.8 Å²	142.8	63%	0.628	79%	0.788	S	S	*	*			cis	-178.7	154	-33	0	0	0	0	0	110.1
25	N	24.3	Very low	28.9	Very low	140 Å²	140	141.1 Å²	141.1	75%	0.749	79%	0.788	S	S	*	*			trans	165.7	125.4	147.7	-88.7	-36.3	0	0	0	109.7
26	M	24.6	Very low	29.2	Very low	149 Å²	149	145.8 Å²	145.8	73%	0.734	79%	0.793	S	S	*	*				58.7	131.1	84.3	-76.4	178.5	22.6	0	0	113.8
27	M	25.2	Very low	29.4	Very low	140 Å²	140	149 Å²	149	69%	0.69	79%	0.793	S	S	*	*			cis	-154.3	-168.9	13.9	-120.4	-177.8	-169.1	0	0	109.4
28	K	27	Very low	29.8	Very low	184 Å²	184	152.1 Å²	152.1	80%	0.8	80%	0.798	S	S	*	*			cis	-145.2	-109.9	14.6	-143.3	142.9	-172.3	160.9	0	113.3
29	K	28.8	Very low	30.5	Very low	199 Å²	199	154.7 Å²	154.7	87%	0.865	81%	0.807	S	S	*	*			trans	-161.7	153	-177.2	-79.5	-177.6	177.7	173.3	0	113.3
30	K	27.5	Very low	31.1	Very low	210 Å²	210	152.6 Å²	152.6	91%	0.913	81%	0.807	S	S	*	*				-163.7	147.1	128.9	-109.8	172.6	-176.2	-180	0	112.5
31	N	32.7	Very low	31.7	Very low	155 Å²	155	149.9 Å²	149.9	83%	0.829	80%	0.796	S	S	*	*			trans	-157.7	165.9	177.2	-126.6	-6.9	0	0	0	105.2
32	P	42.3	Very low	32.4	Very low	98 Å²	98	152.7 Å²	152.7	64%	0.636	80%	0.801	S	S	*	*			cis	-143.9	179.8	31.5	43.8	-25.9	0	0	0	116.6
33	H	33.5	Very low	33.1	Very low	195 Å²	195	150.8 Å²	150.8	90%	0.903	79%	0.794	S	S	*	*				-149.2	164.2	129.7	-94.3	-56.3	0	0	0	110.4
34	K	39.2	Very low	34.1	Very low	200 Å²	200	154.1 Å²	154.1	87%	0.87	79%	0.794	S	S	*	*			trans	-134.9	115	-156.7	176.8	-172.7	177.5	-173.9	0	111.9
35	K	35.6	Very low	34.9	Very low	208 Å²	208	157 Å²	157	90%	0.904	80%	0.803	S	S	*	*			trans	-134.7	163.3	161.4	-75.1	-164.9	174.4	-177.2	0	110.9
36	Q	32.5	Very low	35.8	Very low	192 Å²	192	157.5 Å²	157.5	90%	0.897	81%	0.805	S	S	*	*			trans	-62.8	156	-153	-83.3	145.7	-85.6	0	0	117.6
37	R	33.8	Very low	36.6	Very low	234 Å²	234	155.9 Å²	155.9	88%	0.883	80%	0.803	S	S	*	*			trans	-82.7	132.8	165.7	-63.7	161.4	71.4	177.4	3.6	109.6
38	T	36.1	Very low	37.6	Very low	138 Å²	138	154.1 Å²	154.1	85%	0.847	80%	0.802	S	S	*	*			trans	-118.8	115.7	146.9	43.8	0	0	0	0	106.7	V40	T38-V40 PolarHBondContact O-N 2.73Å
39	S	39.8	Very low	38.8	Very low	112 Å²	112	150.9 Å²	150.9	78%	0.783	80%	0.8	S	S	*	*			trans	-86	101.1	-174	50.9	0	0	0	0	111.2
40	V	42.3	Very low	40.6	Very low	136 Å²	136	148.9 Å²	148.9	82%	0.824	79%	0.787	S	S	*	*			trans	-89	137.8	152.9	-171.6	0	0	0	0	107	T38	T38-V40 PolarHBondContact O-N 2.73Å
41	G	40.1	Very low	43.2	Very low	53 Å²	53	148.9 Å²	148.9	55%	0.546	78%	0.782	S	S	.	*			trans	-65.3	174.1	-178.7	0	0	0	0	0	113	S43	G41-S43 PolarHBondContact O-N 3.17Å
42	P	40	Very low	45.9	Very low	133 Å²	133	146.9 Å²	146.9	86%	0.864	77%	0.771	S	S	*	*			trans	-59.1	106.8	173.5	26.4	-33.5	0	0	0	108.8	K44	P42-K44 PolarHBondContact O-N 2.83Å
43	S	40.3	Very low	48.4	Very low	99 Å²	99	142.2 Å²	142.2	69%	0.692	74%	0.741	S	S	*	*			trans	-58.1	124.4	174.9	-166.9	0	0	0	0	107.5	G41 T45	G41-S43 PolarHBondContact O-N 3.17Å; S43-T45 PolarHBondContact O-N 2.79Å
44	K	45.8	Very low	51.3	Low	186 Å²	186	134.8 Å²	134.8	81%	0.809	71%	0.709	S	S	*	*			trans	-51	136.4	170.1	-66.3	-178.2	179.5	-179.2	0	107	P42 L46	P42-K44 PolarHBondContact O-N 2.83Å; K44-L46 VanDerWaalsContact C-N 3.34Å; K44-L46 PolarHBondContact O-N 3.33Å
45	T	40.8	Very low	54	Low	135 Å²	135	126.1 Å²	126.1	83%	0.828	68%	0.676	S	S	*	*			trans	-55.2	103.4	172	18	0	0	0	0	107.9	S43 V47	S43-T45 PolarHBondContact O-N 2.79Å; T45-V47 PolarHBondContact O-N 3.4Å
46	L	43	Very low	56.8	Low	151 Å²	151	117.5 Å²	117.5	79%	0.791	64%	0.642	S	S	*	*			trans	-67.5	93	174.1	-72.3	172.2	0	0	0	105.8	K44 P48	K44-L46 VanDerWaalsContact C-N 3.34Å; K44-L46 PolarHBondContact O-N 3.33Å; L46-P48 WeakPolarHBondContact O-CD 3.25Å; L46-P48 VanDerWaalsContact O-N 3.07Å
47	V	42.1	Very low	59.9	Low	115 Å²	115	110.3 Å²	110.3	70%	0.697	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-47.8	118.1	164.2	179.5	0	0	0	0	105.2	T45	T45-V47 PolarHBondContact O-N 3.4Å
48	P	46.9	Very low	63	Low	103 Å²	103	99.2 Å²	99.2	67%	0.669	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-52.9	135.7	-179.2	-26.8	34.9	0	0	0	108.5	L46 R50	L46-P48 WeakPolarHBondContact O-CD 3.25Å; L46-P48 VanDerWaalsContact O-N 3.07Å; P48-R50 PolarHBondContact O-N 2.89Å
49	P	51.8	Low	65.9	Low	117 Å²	117	94.2 Å²	94.2	76%	0.76	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-52.4	119.7	-179.9	21.6	-32.5	0	0	0	107.8	R51	P49-R51 PolarHBondContact O-N 2.91Å
50	R	67.4	Low	68.7	Low	156 Å²	156	89 Å²	89	59%	0.589	50%	0.495	S	S	*	.			trans	-52	115.4	-176.1	-77.5	-174.9	173.2	-176.7	-4.5	106.8	P48 N52	P48-R50 PolarHBondContact O-N 2.89Å; R50-N52 PolarHBondContact O-N 3.29Å
51	R	80.2	Confident	71.4	Confident	210 Å²	210	85.6 Å²	85.6	79%	0.792	47%	0.472	S	S	*	.			trans	-58.4	133.3	179.7	-73.6	-178.2	173	177	-2.4	107.3	P49 I53	P49-R51 PolarHBondContact O-N 2.91Å; R51-I53 PolarHBondContact O-N 2.86Å; R51-I53 VanDerWaalsContact O-N 3.17Å
52	N	90.3	Very high	74.2	Confident	113 Å²	113	84.5 Å²	84.5	60%	0.604	45%	0.451	S	S	*	.			trans	-61.1	121.8	167.9	-173.8	-3.6	0	0	0	107.7	R50 V54	R50-N52 PolarHBondContact O-N 3.29Å; N52-V54 VanDerWaalsContact OD1-CB 3.31Å; N52-V54 WeakPolarHBondContact OD1-CB 3.33Å; N52-V54 WeakPolarHBondContact OD1-CG2 3.25Å; N52-V54 PolarHBondContact OD1-N 2.81Å
53	I	94.9	Very high	76.9	Confident	1 Å²	1	82.6 Å²	82.6	1%	0.005	43%	0.429	C	S	.	.			trans	-102.2	-4	179.2	59.9	172.1	0	0	0	112.6	R51 G55 C56 V75 Y86 L101 Y102 V112	R51-I53 PolarHBondContact O-N 2.86Å; R51-I53 VanDerWaalsContact O-N 3.17Å; I53-G55 PolarHBondContact O-N 3.23Å; I53-C56 WeakPolarHBondContact O-CB 3.39Å; I53-C56 PolarHBondContact O-N 3.33Å; I53-V75 HydrophobicContact CD1-CG2 4.14Å; I53-V75 HydrophobicContact CG1-CG1 4.44Å; I53-V75 HydrophobicContact CG1-CG2 4.24Å; I53-V75 WeakPolarHBondContact O-CB 3.3Å; I53-Y86 HydrophobicContact CD1-CD1 4.05Å; I53-Y86 HydrophobicContact CD1-CE1 3.84Å; I53-Y86 HydrophobicContact CD1-CG 4.45Å; I53-Y86 HydrophobicContact CG1-CD1 4Å; I53-Y86 HydrophobicContact CG1-CE1 3.6Å; I53-L101 HydrophobicContact CD1-CD1 3.83Å; I53-Y102 HydrophobicContact CD1-CE2 4.02Å; I53-V112 HydrophobicContact CG2-CG2 3.63Å
54	V	95.4	Very high	79.4	Confident	38 Å²	38	83.7 Å²	83.7	23%	0.23	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	131.2	174.4	-179.4	0	0	0	0	109.6	N52 C56 V75 Q78 I160	N52-V54 VanDerWaalsContact OD1-CB 3.31Å; N52-V54 WeakPolarHBondContact OD1-CB 3.33Å; N52-V54 WeakPolarHBondContact OD1-CG2 3.25Å; N52-V54 PolarHBondContact OD1-N 2.81Å; V54-C56 VanDerWaalsContact C-N 3.25Å; V54-C56 PolarHBondContact O-N 2.91Å; V54-V75 HydrophobicContact CB-CG1 4.49Å; V54-V75 HydrophobicContact CG2-CG1 4.13Å; V54-Q78 HydrophobicContact CG2-CB 3.69Å; V54-I160 HydrophobicContact CG1-CD1 4.22Å; V54-I160 HydrophobicContact CG1-CG1 4.38Å
55	G	94.6	Very high	81.6	Confident	18 Å²	18	78.8 Å²	78.8	19%	0.186	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	-7.9	-172.1	0	0	0	0	0	115.1	I53 V75	I53-G55 PolarHBondContact O-N 3.23Å; G55-V75 PolarHBondContact N-O 3.17Å
56	C	95.4	Very high	84	Confident	27 Å²	27	78.4 Å²	78.4	18%	0.182	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	152.1	175.4	-62	0	0	0	0	112.3	I53 V54 V75 V112	I53-C56 WeakPolarHBondContact O-CB 3.39Å; I53-C56 PolarHBondContact O-N 3.33Å; V54-C56 VanDerWaalsContact C-N 3.25Å; V54-C56 PolarHBondContact O-N 2.91Å; C56-V75 PolarHBondContact O-N 2.95Å; C56-V75 VanDerWaalsContact O-N 3.1Å; C56-V112 HydrophobicContact CB-CG1 3.81Å
57	R	97.1	Very high	86.5	Confident	42 Å²	42	77.5 Å²	77.5	16%	0.158	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	140	162.2	-64.8	-72.6	-66.5	163.8	2.6	109.1	G73 T74 D91 L113 D115	R57-G73 CarbonylContact C-O 3.59Å; R57-G73 WeakPolarHBondContact CA-O 3.37Å; R57-G73 PolarHBondContact NH1-O 2.98Å; R57-T74 VanDerWaalsContact CD-OG1 3.32Å; R57-T74 WeakPolarHBondContact CD-OG1 3.27Å; R57-T74 PolarHBondContact NH1-OG1 2.87Å; R57-D91 IonicContact CZ-OD1 3.23Å; R57-D91 VanDerWaalsContact CZ-OD1 3.23Å; R57-D91 IonicContact CZ-OD2 3.78Å; R57-D91 IonicContact NH1-OD1 2.71Å; R57-D91 PolarHBondContact NH1-OD1 3.1Å; R57-D91 IonicContact NH1-OD2 3.98Å; R57-D91 IonicContact NH2-OD1 2.87Å; R57-D91 PolarHBondContact NH2-OD1 2.95Å; R57-D91 IonicContact NH2-OD2 2.71Å; R57-D91 PolarHBondContact NH2-OD2 3.07Å; R57-L113 HydrophobicContact CB-CB 3.91Å; R57-L113 HydrophobicContact CB-CD1 4.2Å; R57-L113 PolarHBondContact O-N 3.02Å; R57-D115 HydrophobicContact CB-CB 4.32Å; R57-D115 VanDerWaalsContact CB-O 3.3Å; R57-D115 WeakPolarHBondContact CB-O 3.4Å; R57-D115 HydrophobicContact CG-CB 4.08Å; R57-D115 VanDerWaalsContact CG-O 3.25Å; R57-D115 WeakPolarHBondContact CG-O 3.48Å
58	I	97.8	Very high	89.1	Confident	1 Å²	1	76 Å²	76	1%	0.005	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	155.8	179.2	58.5	166.8	0	0	0	110.9	K72 G73 V75 I88 L101 L110 E111 V112	I58-K72 WeakPolarHBondContact O-CA 3.2Å; I58-G73 PolarHBondContact N-O 2.83Å; I58-G73 PolarHBondContact O-N 2.71Å; I58-G73 VanDerWaalsContact O-N 3.09Å; I58-V75 HydrophobicContact CD1-CG2 3.82Å; I58-V75 HydrophobicContact CG1-CG2 4.16Å; I58-V75 HydrophobicContact CG2-CG2 3.92Å; I58-I88 HydrophobicContact CD1-CD1 4.4Å; I58-I88 HydrophobicContact CD1-CG2 4.44Å; I58-L101 HydrophobicContact CD1-CD1 3.83Å; I58-L101 HydrophobicContact CD1-CD2 4.29Å; I58-L110 HydrophobicContact CB-CD1 4.16Å; I58-L110 HydrophobicContact CD1-CD1 4.11Å; I58-L110 HydrophobicContact CG2-CD1 4.43Å; I58-E111 CarbonylContact C-O 3.59Å; I58-E111 WeakPolarHBondContact CA-O 3.26Å; I58-V112 HydrophobicContact CG2-CG2 4.47Å
59	Q	98.4	Very high	91.5	Very high	32 Å²	32	73.6 Å²	73.6	15%	0.15	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	150.3	161.2	70.7	177.9	3.4	0	0	110.8	W71 K72 E111 L113	Q59-W71 VanDerWaalsContact CA-O 3.25Å; Q59-W71 WeakPolarHBondContact CA-O 3.36Å; Q59-K72 HydrophobicContact CB-CG 3.9Å; Q59-E111 HydrophobicContact CG-CB 3.95Å; Q59-E111 PolarHBondContact N-O 2.87Å; Q59-E111 PolarHBondContact NE2-OE2 3.08Å; Q59-E111 PolarHBondContact O-N 2.94Å; Q59-L113 HydrophobicContact CB-CD1 4.31Å; Q59-L113 HydrophobicContact CB-CD2 4.38Å; Q59-L113 HydrophobicContact CB-CG 4.4Å; Q59-L113 HydrophobicContact CG-CD2 3.89Å; Q59-L113 HydrophobicContact CG-CG 4.33Å
60	H	98.6	Very high	93.7	Very high	3 Å²	3	74.3 Å²	74.3	1%	0.014	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	170.4	169.3	63.5	94.5	0	0	0	110.5	W71 Y90 V107 L110	H60-W71 PolarHBondContact N-O 2.93Å; H60-W71 VanDerWaalsContact N-O 3.08Å; H60-W71 PolarHBondContact O-N 3.5Å; H60-Y90 PolarHBondContact CE1-OH 2.71Å; H60-Y90 AromaticContact NE2-CE1 3.44Å; H60-Y90 WeakPolarHBondContact NE2-CE1 3.32Å; H60-Y90 AromaticContact NE2-CZ 3.52Å; H60-Y90 PolarHBondContact NE2-OH 3.45Å; H60-V107 HydrophobicContact CB-CG1 4.02Å; H60-L110 HydrophobicContact CB-CB 4.4Å; H60-L110 HydrophobicContact CB-CD1 4.18Å
61	I	98.4	Very high	95.1	Very high	65 Å²	65	69.6 Å²	69.6	33%	0.333	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	139.2	162.3	-60.3	172.5	0	0	0	107.9	K63 S69 V108	I61-K63 HydrophobicContact CG2-CG 4.06Å; I61-S69 CarbonylContact C-O 3.5Å; I61-S69 WeakPolarHBondContact CA-O 3.44Å; I61-V108 HydrophobicContact CB-CB 4.36Å; I61-V108 WeakPolarHBondContact CB-O 3.49Å; I61-V108 PolarHBondContact N-O 2.97Å; I61-V108 PolarHBondContact O-N 2.82Å
62	W	98.2	Very high	96	Very high	29 Å²	29	64 Å²	64	11%	0.11	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134	160.6	-175.2	-106.5	0	0	0	108.6	S68 S69 W71 L99 R106 V107 F250	W62-S68 VanDerWaalsContact O-CA 3.27Å; W62-S68 WeakPolarHBondContact O-CA 3.4Å; W62-S69 PolarHBondContact N-O 2.77Å; W62-S69 PolarHBondContact O-N 3.08Å; W62-W71 VanDerWaalsContact CB-CD1 3.43Å; W62-W71 HydrophobicContact CB-CG 4.48Å; W62-W71 VanDerWaalsContact CB-NE1 3.35Å; W62-L99 HydrophobicContact CE3-CD1 4.47Å; W62-L99 HydrophobicContact CH2-CD1 4.49Å; W62-L99 HydrophobicContact CH2-CD2 3.83Å; W62-L99 HydrophobicContact CZ3-CD1 3.83Å; W62-L99 HydrophobicContact CZ3-CD2 3.87Å; W62-R106 CarbonylContact C-O 3.57Å; W62-R106 WeakPolarHBondContact CA-O 3.15Å; W62-R106 HydrophobicContact CD2-CB 4Å; W62-R106 HydrophobicContact CE3-CB 3.76Å; W62-R106 HydrophobicContact CH2-CB 3.94Å; W62-R106 HydrophobicContact CH2-CG 4.49Å; W62-R106 VanDerWaalsContact CH2-CZ 3.41Å; W62-R106 VanDerWaalsContact CH2-NE 3.27Å; W62-R106 HydrophobicContact CZ2-CB 4.14Å; W62-R106 HydrophobicContact CZ2-CG 4.48Å; W62-R106 HydrophobicContact CZ3-CB 3.72Å; W62-V107 HydrophobicContact CE3-CG2 4.09Å; W62-V107 HydrophobicContact CZ3-CG2 3.92Å; W62-F250 HydrophobicContact CH2-CD1 4.24Å; W62-F250 HydrophobicContact CZ2-CD1 4.03Å; W62-F250 HydrophobicContact CZ2-CE1 4.21Å
63	K	97.2	Very high	96.4	Very high	94 Å²	94	58.6 Å²	58.6	41%	0.409	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	132.6	176.4	-68.1	-171.4	-178.5	174.8	0	111.3	I61 K67 R106 V108	I61-K63 HydrophobicContact CG2-CG 4.06Å; K63-K67 WeakPolarHBondContact CA-O 3.19Å; K63-R106 PolarHBondContact N-O 2.89Å; K63-R106 WeakPolarHBondContact O-CB 2.99Å; K63-R106 WeakPolarHBondContact O-CG 3.21Å; K63-V108 HydrophobicContact CD-CB 4.49Å; K63-V108 HydrophobicContact CD-CG2 3.81Å; K63-V108 HydrophobicContact CG-CG2 4.21Å
64	E	93.6	Very high	96.5	Very high	121 Å²	121	58.8 Å²	58.8	57%	0.565	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.6	96.2	174.3	-172	176.2	-117.4	0	0	109.1	S66 K67	E64-S66 PolarHBondContact O-N 2.88Å; E64-S66 VanDerWaalsContact O-N 3.16Å; E64-K67 PolarHBondContact N-O 2.9Å; E64-K67 WeakPolarHBondContact O-CB 3.39Å; E64-K67 PolarHBondContact O-N 3.09Å
65	G	90.8	Very high	96.6	Very high	84 Å²	84	57 Å²	57	87%	0.866	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	-116	-170.5	0	0	0	0	0	111.6
66	S	91.3	Very high	96.7	Very high	127 Å²	127	56.1 Å²	56.1	89%	0.888	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-8.4	176	56.2	0	0	0	0	114.5	E64	E64-S66 PolarHBondContact O-N 2.88Å; E64-S66 VanDerWaalsContact O-N 3.16Å
67	K	95.3	Very high	96.8	Very high	131 Å²	131	57.5 Å²	57.5	57%	0.57	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	145.7	178.7	-61.7	176.1	-175.9	170.1	0	110.5	K63 E64	K63-K67 WeakPolarHBondContact CA-O 3.19Å; E64-K67 PolarHBondContact N-O 2.9Å; E64-K67 WeakPolarHBondContact O-CB 3.39Å; E64-K67 PolarHBondContact O-N 3.09Å
68	S	96.5	Very high	96.8	Very high	85 Å²	85	58.4 Å²	58.4	59%	0.594	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.2	140.1	170	54.2	0	0	0	0	111.4	W62	W62-S68 VanDerWaalsContact O-CA 3.27Å; W62-S68 WeakPolarHBondContact O-CA 3.4Å
69	S	97.6	Very high	96.8	Very high	52 Å²	52	58.5 Å²	58.5	36%	0.364	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	146.6	174.2	42.6	0	0	0	0	110	I61 W62 W71	I61-S69 CarbonylContact C-O 3.5Å; I61-S69 WeakPolarHBondContact CA-O 3.44Å; W62-S69 PolarHBondContact N-O 2.77Å; W62-S69 PolarHBondContact O-N 3.08Å; S69-W71 PolarHBondContact OG-NE1 2.89Å
70	Q	98	Very high	96.7	Very high	132 Å²	132	62 Å²	62	62%	0.617	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	131.4	175.8	-172.7	178.3	17.3	0	0	109.5
71	W	98.4	Very high	96.7	Very high	57 Å²	57	64.5 Å²	64.5	22%	0.216	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146	-178.5	-65.5	77	0	0	0	110.5	Q59 H60 W62 S69 Y90 F93	Q59-W71 VanDerWaalsContact CA-O 3.25Å; Q59-W71 WeakPolarHBondContact CA-O 3.36Å; H60-W71 PolarHBondContact N-O 2.93Å; H60-W71 VanDerWaalsContact N-O 3.08Å; H60-W71 PolarHBondContact O-N 3.5Å; W62-W71 VanDerWaalsContact CB-CD1 3.43Å; W62-W71 HydrophobicContact CB-CG 4.48Å; W62-W71 VanDerWaalsContact CB-NE1 3.35Å; S69-W71 PolarHBondContact OG-NE1 2.89Å; W71-Y90 HydrophobicContact CB-CD1 3.9Å; W71-Y90 HydrophobicContact CB-CE1 3.7Å; W71-Y90 AromaticContact CE3-CD1 3.84Å; W71-Y90 HydrophobicContact CE3-CD1 3.84Å; W71-Y90 HydrophobicContact CE3-CD2 4.35Å; W71-Y90 HydrophobicContact CE3-CE1 4.34Å; W71-Y90 AromaticContact CE3-CG 3.85Å; W71-Y90 HydrophobicContact CE3-CG 3.85Å; W71-Y90 HydrophobicContact CG-CE1 4.44Å; W71-Y90 HydrophobicContact CZ3-CG 4.42Å; W71-F93 HydrophobicContact CE3-CD2 4.38Å; W71-F93 HydrophobicContact CE3-CE2 4.15Å; W71-F93 HydrophobicContact CH2-CD2 4.41Å; W71-F93 AromaticContact CH2-CE1 3.97Å; W71-F93 HydrophobicContact CH2-CE1 3.97Å; W71-F93 AromaticContact CH2-CE2 3.81Å; W71-F93 HydrophobicContact CH2-CE2 3.81Å; W71-F93 AromaticContact CH2-CZ 3.56Å; W71-F93 HydrophobicContact CH2-CZ 3.56Å; W71-F93 HydrophobicContact CZ3-CD1 4.35Å; W71-F93 AromaticContact CZ3-CD2 3.62Å; W71-F93 HydrophobicContact CZ3-CD2 3.62Å; W71-F93 HydrophobicContact CZ3-CE1 4.1Å; W71-F93 AromaticContact CZ3-CE2 3.34Å; W71-F93 HydrophobicContact CZ3-CE2 3.34Å; W71-F93 HydrophobicContact CZ3-CG 4.13Å; W71-F93 AromaticContact CZ3-CZ 3.6Å; W71-F93 HydrophobicContact CZ3-CZ 3.6Å
72	K	98.3	Very high	96.6	Very high	92 Å²	92	63 Å²	63	40%	0.4	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	140.1	174.7	-68.9	-171.5	175.1	-174.6	0	109.2	I58 Q59 Y90 D91	I58-K72 WeakPolarHBondContact O-CA 3.2Å; Q59-K72 HydrophobicContact CB-CG 3.9Å; K72-Y90 WeakPolarHBondContact O-CD1 3.37Å; K72-D91 WeakPolarHBondContact CB-OD2 3.29Å; K72-D91 PolarHBondContact O-N 2.86Å
73	G	97.4	Very high	96.5	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	179.4	-173.8	0	0	0	0	0	113.7	R57 I58 K89	R57-G73 CarbonylContact C-O 3.59Å; R57-G73 WeakPolarHBondContact CA-O 3.37Å; R57-G73 PolarHBondContact NH1-O 2.98Å; I58-G73 PolarHBondContact N-O 2.83Å; I58-G73 PolarHBondContact O-N 2.71Å; I58-G73 VanDerWaalsContact O-N 3.09Å; G73-K89 CarbonylContact C-O 3.47Å; G73-K89 WeakPolarHBondContact CA-O 3.38Å
74	T	97.6	Very high	96.5	Very high	4 Å²	4	63 Å²	63	3%	0.025	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	126.7	178.8	-60.5	0	0	0	0	108.8	R57 L76 I88 K89 V117 I160 M161	R57-T74 VanDerWaalsContact CD-OG1 3.32Å; R57-T74 WeakPolarHBondContact CD-OG1 3.27Å; R57-T74 PolarHBondContact NH1-OG1 2.87Å; T74-L76 HydrophobicContact CG2-CD2 4.03Å; T74-L76 PolarHBondContact O-N 3.04Å; T74-I88 WeakPolarHBondContact O-CA 3.33Å; T74-K89 PolarHBondContact N-O 3.31Å; T74-K89 PolarHBondContact O-N 2.87Å; T74-V117 HydrophobicContact CG2-CG2 3.43Å; T74-V117 VanDerWaalsContact CG2-CG2 3.43Å; T74-I160 HydrophobicContact CG2-CG2 3.95Å; T74-M161 HydrophobicContact CG2-CG 4.22Å; T74-M161 HydrophobicContact CG2-SD 3.97Å
75	V	97.6	Very high	96.7	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	117.1	168.9	-176	0	0	0	0	108.6	I53 V54 G55 C56 I58 Y86 L87 L101	I53-V75 HydrophobicContact CD1-CG2 4.14Å; I53-V75 HydrophobicContact CG1-CG1 4.44Å; I53-V75 HydrophobicContact CG1-CG2 4.24Å; I53-V75 WeakPolarHBondContact O-CB 3.3Å; V54-V75 HydrophobicContact CB-CG1 4.49Å; V54-V75 HydrophobicContact CG2-CG1 4.13Å; G55-V75 PolarHBondContact N-O 3.17Å; C56-V75 PolarHBondContact O-N 2.95Å; C56-V75 VanDerWaalsContact O-N 3.1Å; I58-V75 HydrophobicContact CD1-CG2 3.82Å; I58-V75 HydrophobicContact CG1-CG2 4.16Å; I58-V75 HydrophobicContact CG2-CG2 3.92Å; V75-Y86 HydrophobicContact CG1-CD1 3.77Å; V75-Y86 HydrophobicContact CG1-CG 4.39Å; V75-L87 CarbonylContact C-O 3.52Å; V75-L101 HydrophobicContact CG2-CD1 4.34Å
76	L	97.1	Very high	97.1	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-40.7	-178.1	-54.8	179.4	0	0	0	112.1	T74 L87 K89 V96 I160 M161 Y166 M177	T74-L76 HydrophobicContact CG2-CD2 4.03Å; T74-L76 PolarHBondContact O-N 3.04Å; L76-L87 HydrophobicContact CB-CB 4.35Å; L76-L87 PolarHBondContact N-O 2.94Å; L76-K89 HydrophobicContact CD1-CB 4.18Å; L76-K89 HydrophobicContact CD2-CB 4.21Å; L76-K89 HydrophobicContact CG-CB 4.4Å; L76-V96 HydrophobicContact CD1-CG1 3.97Å; L76-V96 HydrophobicContact CD1-CG2 4.14Å; L76-I160 VanDerWaalsContact O-CG1 3.27Å; L76-I160 WeakPolarHBondContact O-CG1 3.17Å; L76-M161 HydrophobicContact CD2-CG 4.28Å; L76-M161 HydrophobicContact CD2-SD 4.07Å; L76-Y166 HydrophobicContact CD1-CE1 3.96Å; L76-M177 HydrophobicContact CD1-SD 3.81Å; L76-M177 HydrophobicContact CD2-CE 4.36Å; L76-M177 HydrophobicContact CD2-SD 4.29Å
77	D	97.1	Very high	97.5	Very high	55 Å²	55	48 Å²	48	29%	0.294	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	166	-174.3	-168.2	25.5	0	0	0	112.1	Y86 L87	D77-Y86 WeakPolarHBondContact O-CA 3.44Å; D77-L87 HydrophobicContact CB-CB 4.2Å; D77-L87 HydrophobicContact CB-CD1 4.23Å; D77-L87 HydrophobicContact CB-CG 4.28Å; D77-L87 PolarHBondContact O-N 2.98Å
78	Q	97.6	Very high	97.6	Very high	61 Å²	61	41.7 Å²	41.7	29%	0.285	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	115.1	171.2	-179.5	-177.9	13.1	0	0	108.7	V54 P80 P83 Y86	V54-Q78 HydrophobicContact CG2-CB 3.69Å; Q78-P80 WeakPolarHBondContact O-CD 3.47Å; Q78-P83 PolarHBondContact NE2-O 3.16Å; Q78-Y86 HydrophobicContact CB-CD1 3.91Å; Q78-Y86 HydrophobicContact CB-CE1 3.84Å; Q78-Y86 HydrophobicContact CG-CD1 4.07Å; Q78-Y86 HydrophobicContact CG-CE1 3.68Å; Q78-Y86 PolarHBondContact NE2-OH 3.11Å
79	V	97.6	Very high	97.7	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.018	21%	0.208	C	C	.	.			trans	-64.7	121.3	-165.7	174.4	0	0	0	0	111.6	V81 N82 L85 L87 I232	V79-V81 VanDerWaalsContact C-N 3.32Å; V79-V81 HydrophobicContact CG1-CG2 3.68Å; V79-V81 PolarHBondContact O-N 2.88Å; V79-N82 CarbonylContact O-C 3.56Å; V79-N82 PolarHBondContact O-N 3.41Å; V79-L85 HydrophobicContact CB-CB 4.27Å; V79-L85 HydrophobicContact CB-CD2 4.22Å; V79-L85 HydrophobicContact CB-CG 4.34Å; V79-L85 HydrophobicContact CG1-CD2 4.45Å; V79-L85 HydrophobicContact CG2-CB 4.31Å; V79-L85 HydrophobicContact CG2-CD2 3.83Å; V79-L85 HydrophobicContact CG2-CG 3.88Å; V79-L85 PolarHBondContact N-O 2.84Å; V79-L87 HydrophobicContact CG2-CD2 4.1Å; V79-L87 HydrophobicContact CG2-CG 4.16Å; V79-I232 HydrophobicContact CG1-CB 3.71Å; V79-I232 HydrophobicContact CG1-CG2 3.86Å; V79-I232 HydrophobicContact CG2-CB 4.5Å; V79-I232 HydrophobicContact CG2-CD1 4.18Å
80	P	96.8	Very high	97.7	Very high	105 Å²	105	36 Å²	36	68%	0.682	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-35.4	-174.7	-28.2	36.1	0	0	0	114.8	Q78 N82	Q78-P80 WeakPolarHBondContact O-CD 3.47Å; P80-N82 VanDerWaalsContact C-N 3.35Å
81	V	97.4	Very high	97.7	Very high	57 Å²	57	33.2 Å²	33.2	35%	0.345	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-11.7	178.1	-63.4	0	0	0	0	113.9	V79 V213 M230 I232	V79-V81 VanDerWaalsContact C-N 3.32Å; V79-V81 HydrophobicContact CG1-CG2 3.68Å; V79-V81 PolarHBondContact O-N 2.88Å; V81-V213 HydrophobicContact CG1-CG1 3.69Å; V81-V213 HydrophobicContact CG2-CG1 4.47Å; V81-M230 HydrophobicContact CG2-SD 4.17Å; V81-I232 HydrophobicContact CG2-CG2 4.37Å
82	N	97.4	Very high	97.6	Very high	32 Å²	32	33.7 Å²	33.7	17%	0.171	20%	0.204	C	C	.	.			trans	-146.5	88.7	169.6	-179.4	-0.2	0	0	0	110.6	V79 P80 S84 L85 E100 M230	V79-N82 CarbonylContact O-C 3.56Å; V79-N82 PolarHBondContact O-N 3.41Å; P80-N82 VanDerWaalsContact C-N 3.35Å; N82-S84 PolarHBondContact O-N 2.77Å; N82-S84 WeakPolarHBondContact OD1-CB 3.45Å; N82-S84 PolarHBondContact OD1-N 3.38Å; N82-S84 VanDerWaalsContact OD1-N 3.08Å; N82-L85 HydrophobicContact CB-CB 4.16Å; N82-L85 WeakPolarHBondContact O-CB 3.27Å; N82-L85 PolarHBondContact O-N 3.43Å; N82-E100 PolarHBondContact ND2-OE1 2.92Å; N82-M230 HydrophobicContact CB-CE 3.71Å
83	P	96.6	Very high	97.5	Very high	79 Å²	79	33.5 Å²	33.5	51%	0.513	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-2	-179.5	-25	36.1	0	0	0	115.9	Q78	Q78-P83 PolarHBondContact NE2-O 3.16Å
84	S	96.9	Very high	97.5	Very high	45 Å²	45	36.1 Å²	36.1	32%	0.315	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-28.1	166.2	-66.2	0	0	0	0	112.3	N82 Y86 E100	N82-S84 PolarHBondContact O-N 2.77Å; N82-S84 WeakPolarHBondContact OD1-CB 3.45Å; N82-S84 PolarHBondContact OD1-N 3.38Å; N82-S84 VanDerWaalsContact OD1-N 3.08Å; S84-Y86 WeakPolarHBondContact O-CD2 3.37Å; S84-Y86 VanDerWaalsContact O-CE2 3.24Å; S84-Y86 WeakPolarHBondContact O-CE2 3.31Å; S84-E100 VanDerWaalsContact CB-CD 3.42Å; S84-E100 VanDerWaalsContact CB-OE2 3.25Å; S84-E100 WeakPolarHBondContact CB-OE2 3.41Å; S84-E100 WeakPolarHBondContact O-CA 3.24Å
85	L	98.4	Very high	97.5	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.016	22%	0.221	C	C	.	.			trans	-88.8	126	-171.9	-179.9	64.4	0	0	0	111.8	V79 N82 G98 E100 I232 K245	V79-L85 HydrophobicContact CB-CB 4.27Å; V79-L85 HydrophobicContact CB-CD2 4.22Å; V79-L85 HydrophobicContact CB-CG 4.34Å; V79-L85 HydrophobicContact CG1-CD2 4.45Å; V79-L85 HydrophobicContact CG2-CB 4.31Å; V79-L85 HydrophobicContact CG2-CD2 3.83Å; V79-L85 HydrophobicContact CG2-CG 3.88Å; V79-L85 PolarHBondContact N-O 2.84Å; N82-L85 HydrophobicContact CB-CB 4.16Å; N82-L85 WeakPolarHBondContact O-CB 3.27Å; N82-L85 PolarHBondContact O-N 3.43Å; L85-G98 VanDerWaalsContact CD1-C 3.42Å; L85-E100 HydrophobicContact CB-CG 4.36Å; L85-E100 HydrophobicContact CD1-CG 4.47Å; L85-I232 HydrophobicContact CD2-CG2 4.12Å; L85-K245 HydrophobicContact CD1-CG 4.45Å; L85-K245 HydrophobicContact CD2-CB 4.14Å; L85-K245 HydrophobicContact CD2-CG 3.88Å
86	Y	98.5	Very high	97.6	Very high	6 Å²	6	36.6 Å²	36.6	2%	0.024	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141.9	177.3	-64.2	-92.1	0	0	0	110.6	I53 V75 D77 Q78 S84 G98 L99 L101 Y102	I53-Y86 HydrophobicContact CD1-CD1 4.05Å; I53-Y86 HydrophobicContact CD1-CE1 3.84Å; I53-Y86 HydrophobicContact CD1-CG 4.45Å; I53-Y86 HydrophobicContact CG1-CD1 4Å; I53-Y86 HydrophobicContact CG1-CE1 3.6Å; V75-Y86 HydrophobicContact CG1-CD1 3.77Å; V75-Y86 HydrophobicContact CG1-CG 4.39Å; D77-Y86 WeakPolarHBondContact O-CA 3.44Å; Q78-Y86 HydrophobicContact CB-CD1 3.91Å; Q78-Y86 HydrophobicContact CB-CE1 3.84Å; Q78-Y86 HydrophobicContact CG-CD1 4.07Å; Q78-Y86 HydrophobicContact CG-CE1 3.68Å; Q78-Y86 PolarHBondContact NE2-OH 3.11Å; S84-Y86 WeakPolarHBondContact O-CD2 3.37Å; S84-Y86 VanDerWaalsContact O-CE2 3.24Å; S84-Y86 WeakPolarHBondContact O-CE2 3.31Å; Y86-G98 WeakPolarHBondContact O-CA 3.17Å; Y86-L99 PolarHBondContact N-O 3.03Å; Y86-L99 PolarHBondContact O-N 2.84Å; Y86-L101 HydrophobicContact CD2-CB 3.97Å; Y86-L101 HydrophobicContact CD2-CD1 4.02Å; Y86-L101 HydrophobicContact CD2-CG 4.17Å; Y86-L101 HydrophobicContact CE2-CB 4.43Å; Y86-L101 HydrophobicContact CG-CD1 3.97Å; Y86-Y102 AromaticContact CE2-CD2 3.92Å; Y86-Y102 HydrophobicContact CE2-CD2 3.92Å; Y86-Y102 HydrophobicContact CE2-CE2 4.05Å
87	L	98.6	Very high	97.6	Very high	7 Å²	7	37.8 Å²	37.8	4%	0.037	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.7	171.2	-57.1	-169.3	0	0	0	109.9	V75 L76 D77 V79 V96 Y97 I232 I252	V75-L87 CarbonylContact C-O 3.52Å; L76-L87 HydrophobicContact CB-CB 4.35Å; L76-L87 PolarHBondContact N-O 2.94Å; D77-L87 HydrophobicContact CB-CB 4.2Å; D77-L87 HydrophobicContact CB-CD1 4.23Å; D77-L87 HydrophobicContact CB-CG 4.28Å; D77-L87 PolarHBondContact O-N 2.98Å; V79-L87 HydrophobicContact CG2-CD2 4.1Å; V79-L87 HydrophobicContact CG2-CG 4.16Å; L87-V96 HydrophobicContact CB-CG1 4.09Å; L87-Y97 CarbonylContact C-O 3.57Å; L87-Y97 WeakPolarHBondContact CA-O 2.9Å; L87-I232 HydrophobicContact CD2-CD1 4.22Å; L87-I252 HydrophobicContact CD2-CD1 3.73Å; L87-I252 HydrophobicContact CD2-CG1 3.75Å
88	I	98.4	Very high	97.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	131.4	-167.2	-48.2	169	0	0	0	110.5	I58 T74 Y90 Y97 L99 L101	I58-I88 HydrophobicContact CD1-CD1 4.4Å; I58-I88 HydrophobicContact CD1-CG2 4.44Å; T74-I88 WeakPolarHBondContact O-CA 3.33Å; I88-Y90 HydrophobicContact CB-CE2 4.12Å; I88-Y90 HydrophobicContact CD1-CE2 4.4Å; I88-Y90 HydrophobicContact CG2-CD1 4.31Å; I88-Y90 HydrophobicContact CG2-CD2 4.08Å; I88-Y90 HydrophobicContact CG2-CE1 4.04Å; I88-Y90 HydrophobicContact CG2-CE2 3.79Å; I88-Y90 HydrophobicContact CG2-CG 4.34Å; I88-Y97 PolarHBondContact N-O 2.98Å; I88-Y97 PolarHBondContact O-N 3.09Å; I88-L99 HydrophobicContact CD1-CB 4.13Å; I88-L99 HydrophobicContact CD1-CD1 4.27Å; I88-L99 HydrophobicContact CD1-CG 4.49Å; I88-L101 HydrophobicContact CD1-CD1 3.83Å; I88-L101 HydrophobicContact CD1-CD2 3.75Å; I88-L101 HydrophobicContact CD1-CG 3.89Å
89	K	98.1	Very high	97.8	Very high	9 Å²	9	32.6 Å²	32.6	4%	0.039	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	120.5	161.4	-175.3	70.1	155.6	71.1	0	108.1	G73 T74 L76 F93 D94 M161 W164 M177	G73-K89 CarbonylContact C-O 3.47Å; G73-K89 WeakPolarHBondContact CA-O 3.38Å; T74-K89 PolarHBondContact N-O 3.31Å; T74-K89 PolarHBondContact O-N 2.87Å; L76-K89 HydrophobicContact CD1-CB 4.18Å; L76-K89 HydrophobicContact CD2-CB 4.21Å; L76-K89 HydrophobicContact CG-CB 4.4Å; K89-F93 WeakPolarHBondContact CD-O 3.24Å; K89-F93 WeakPolarHBondContact CE-O 3.21Å; K89-F93 PolarHBondContact NZ-O 3.38Å; K89-D94 IonicContact NZ-OD1 3.85Å; K89-D94 PolarHBondContact NZ-OD1 2.91Å; K89-M161 HydrophobicContact CB-SD 4.3Å; K89-M161 HydrophobicContact CG-SD 4.44Å; K89-W164 VanDerWaalsContact CE-CZ3 3.48Å; K89-M177 HydrophobicContact CB-CE 3.87Å; K89-M177 HydrophobicContact CD-CB 4.23Å; K89-M177 HydrophobicContact CD-CE 3.88Å; K89-M177 WeakPolarHBondContact CE-O 3.4Å; K89-M177 HydrophobicContact CG-CE 3.64Å
90	Y	98.3	Very high	97.8	Very high	7 Å²	7	35.6 Å²	35.6	3%	0.027	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	153.7	174.1	-73.7	-76.1	0	0	0	111.6	H60 W71 K72 I88 G92 F93 Y97 L99	H60-Y90 PolarHBondContact CE1-OH 2.71Å; H60-Y90 AromaticContact NE2-CE1 3.44Å; H60-Y90 WeakPolarHBondContact NE2-CE1 3.32Å; H60-Y90 AromaticContact NE2-CZ 3.52Å; H60-Y90 PolarHBondContact NE2-OH 3.45Å; W71-Y90 HydrophobicContact CB-CD1 3.9Å; W71-Y90 HydrophobicContact CB-CE1 3.7Å; W71-Y90 AromaticContact CE3-CD1 3.84Å; W71-Y90 HydrophobicContact CE3-CD1 3.84Å; W71-Y90 HydrophobicContact CE3-CD2 4.35Å; W71-Y90 HydrophobicContact CE3-CE1 4.34Å; W71-Y90 AromaticContact CE3-CG 3.85Å; W71-Y90 HydrophobicContact CE3-CG 3.85Å; W71-Y90 HydrophobicContact CG-CE1 4.44Å; W71-Y90 HydrophobicContact CZ3-CG 4.42Å; K72-Y90 WeakPolarHBondContact O-CD1 3.37Å; I88-Y90 HydrophobicContact CB-CE2 4.12Å; I88-Y90 HydrophobicContact CD1-CE2 4.4Å; I88-Y90 HydrophobicContact CG2-CD1 4.31Å; I88-Y90 HydrophobicContact CG2-CD2 4.08Å; I88-Y90 HydrophobicContact CG2-CE1 4.04Å; I88-Y90 HydrophobicContact CG2-CE2 3.79Å; I88-Y90 HydrophobicContact CG2-CG 4.34Å; Y90-G92 PolarHBondContact O-N 3.05Å; Y90-F93 PolarHBondContact O-N 2.93Å; Y90-Y97 AromaticContact CD2-CD2 3.58Å; Y90-Y97 HydrophobicContact CD2-CD2 3.58Å; Y90-Y97 HydrophobicContact CD2-CE2 4.14Å; Y90-Y97 AromaticContact CD2-CG 3.87Å; Y90-Y97 HydrophobicContact CD2-CG 3.87Å; Y90-Y97 HydrophobicContact CE2-CD2 4.15Å; Y90-Y97 AromaticContact CE2-CG 3.96Å; Y90-Y97 HydrophobicContact CE2-CG 3.96Å; Y90-L99 VanDerWaalsContact OH-CD1 3.29Å; Y90-L99 WeakPolarHBondContact OH-CD1 3.2Å
91	D	96.8	Very high	97.8	Very high	74 Å²	74	30.9 Å²	30.9	40%	0.396	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	119.7	179.6	-63	-12	0	0	0	110.3	R57 K72 F93	R57-D91 IonicContact CZ-OD1 3.23Å; R57-D91 VanDerWaalsContact CZ-OD1 3.23Å; R57-D91 IonicContact CZ-OD2 3.78Å; R57-D91 IonicContact NH1-OD1 2.71Å; R57-D91 PolarHBondContact NH1-OD1 3.1Å; R57-D91 IonicContact NH1-OD2 3.98Å; R57-D91 IonicContact NH2-OD1 2.87Å; R57-D91 PolarHBondContact NH2-OD1 2.95Å; R57-D91 IonicContact NH2-OD2 2.71Å; R57-D91 PolarHBondContact NH2-OD2 3.07Å; K72-D91 WeakPolarHBondContact CB-OD2 3.29Å; K72-D91 PolarHBondContact O-N 2.86Å; D91-F93 WeakPolarHBondContact O-CD2 3.37Å
92	G	96.3	Very high	97.8	Very high	67 Å²	67	32.6 Å²	32.6	69%	0.691	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.4	11.1	179.7	0	0	0	0	0	115.8	Y90	Y90-G92 PolarHBondContact O-N 3.05Å
93	F	97.2	Very high	97.7	Very high	88 Å²	88	34.1 Å²	34.1	39%	0.386	20%	0.201	S	C	.	.			trans	-127.4	131.5	174.2	-65.3	-94.7	0	0	0	110	W71 K89 Y90 D91 Y97	W71-F93 HydrophobicContact CE3-CD2 4.38Å; W71-F93 HydrophobicContact CE3-CE2 4.15Å; W71-F93 HydrophobicContact CH2-CD2 4.41Å; W71-F93 AromaticContact CH2-CE1 3.97Å; W71-F93 HydrophobicContact CH2-CE1 3.97Å; W71-F93 AromaticContact CH2-CE2 3.81Å; W71-F93 HydrophobicContact CH2-CE2 3.81Å; W71-F93 AromaticContact CH2-CZ 3.56Å; W71-F93 HydrophobicContact CH2-CZ 3.56Å; W71-F93 HydrophobicContact CZ3-CD1 4.35Å; W71-F93 AromaticContact CZ3-CD2 3.62Å; W71-F93 HydrophobicContact CZ3-CD2 3.62Å; W71-F93 HydrophobicContact CZ3-CE1 4.1Å; W71-F93 AromaticContact CZ3-CE2 3.34Å; W71-F93 HydrophobicContact CZ3-CE2 3.34Å; W71-F93 HydrophobicContact CZ3-CG 4.13Å; W71-F93 AromaticContact CZ3-CZ 3.6Å; W71-F93 HydrophobicContact CZ3-CZ 3.6Å; K89-F93 WeakPolarHBondContact CD-O 3.24Å; K89-F93 WeakPolarHBondContact CE-O 3.21Å; K89-F93 PolarHBondContact NZ-O 3.38Å; Y90-F93 PolarHBondContact O-N 2.93Å; D91-F93 WeakPolarHBondContact O-CD2 3.37Å; F93-Y97 HydrophobicContact CB-CE2 4.12Å
94	D	97.3	Very high	97.8	Very high	55 Å²	55	31.7 Å²	31.7	29%	0.294	18%	0.183	S	C	.	.			trans	-96.1	-13.3	-168.7	-58.3	-49.4	0	0	0	115.6	K89 Y176 M177 Y178	K89-D94 IonicContact NZ-OD1 3.85Å; K89-D94 PolarHBondContact NZ-OD1 2.91Å; D94-Y176 HydrophobicContact CB-CD1 4.18Å; D94-Y176 CarbonylContact O-C 3.57Å; D94-Y176 WeakPolarHBondContact O-CA 3.31Å; D94-M177 PolarHBondContact O-N 3.49Å; D94-Y178 HydrophobicContact CB-CD1 4.41Å; D94-Y178 HydrophobicContact CB-CE1 3.64Å; D94-Y178 HydrophobicContact CB-CE2 4.15Å; D94-Y178 VanDerWaalsContact CB-CZ 3.49Å; D94-Y178 WeakPolarHBondContact CB-OH 3.45Å
95	C	97.9	Very high	97.7	Very high	14 Å²	14	38.2 Å²	38.2	10%	0.095	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-67.2	152.6	167.2	-49	0	0	0	0	111.5	Y97 V174 Y176	C95-Y97 HydrophobicContact CB-CD2 4.35Å; C95-Y97 HydrophobicContact CB-CE2 3.7Å; C95-Y97 WeakPolarHBondContact O-CD2 3.42Å; C95-Y97 WeakPolarHBondContact O-CE2 3.19Å; C95-V174 HydrophobicContact CB-CG1 4.29Å; C95-Y176 WeakPolarHBondContact SG-CE1 3.26Å
96	V	98.6	Very high	97.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	127.3	166	-179.8	0	0	0	0	108.8	L76 L87 Y166 L175 M177	L76-V96 HydrophobicContact CD1-CG1 3.97Å; L76-V96 HydrophobicContact CD1-CG2 4.14Å; L87-V96 HydrophobicContact CB-CG1 4.09Å; V96-Y166 HydrophobicContact CG2-CD1 4.15Å; V96-Y166 HydrophobicContact CG2-CE1 3.84Å; V96-L175 HydrophobicContact CB-CB 4.33Å; V96-L175 HydrophobicContact CB-CD2 3.87Å; V96-L175 HydrophobicContact CB-CG 3.95Å; V96-L175 HydrophobicContact CG1-CD2 4.01Å; V96-L175 HydrophobicContact CG2-CD2 4.18Å; V96-L175 HydrophobicContact CG2-CG 4Å; V96-L175 PolarHBondContact N-O 3.26Å; V96-M177 HydrophobicContact CG2-CB 3.86Å
97	Y	98.7	Very high	97.7	Very high	27 Å²	27	43.4 Å²	43.4	11%	0.106	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	134.5	-175.1	-66.2	-98	0	0	0	110.8	L87 I88 Y90 F93 C95 F250	L87-Y97 CarbonylContact C-O 3.57Å; L87-Y97 WeakPolarHBondContact CA-O 2.9Å; I88-Y97 PolarHBondContact N-O 2.98Å; I88-Y97 PolarHBondContact O-N 3.09Å; Y90-Y97 AromaticContact CD2-CD2 3.58Å; Y90-Y97 HydrophobicContact CD2-CD2 3.58Å; Y90-Y97 HydrophobicContact CD2-CE2 4.14Å; Y90-Y97 AromaticContact CD2-CG 3.87Å; Y90-Y97 HydrophobicContact CD2-CG 3.87Å; Y90-Y97 HydrophobicContact CE2-CD2 4.15Å; Y90-Y97 AromaticContact CE2-CG 3.96Å; Y90-Y97 HydrophobicContact CE2-CG 3.96Å; F93-Y97 HydrophobicContact CB-CE2 4.12Å; C95-Y97 HydrophobicContact CB-CD2 4.35Å; C95-Y97 HydrophobicContact CB-CE2 3.7Å; C95-Y97 WeakPolarHBondContact O-CD2 3.42Å; C95-Y97 WeakPolarHBondContact O-CE2 3.19Å; Y97-F250 CarbonylContact C-O 3.03Å; Y97-F250 WeakPolarHBondContact CA-O 3.42Å; Y97-F250 HydrophobicContact CD1-CB 4.44Å; Y97-F250 AromaticContact CD1-CD2 3.55Å; Y97-F250 HydrophobicContact CD1-CD2 3.55Å; Y97-F250 HydrophobicContact CD1-CE2 4.18Å; Y97-F250 HydrophobicContact CD1-CG 4.27Å; Y97-F250 AromaticContact CE1-CD2 3.64Å; Y97-F250 HydrophobicContact CE1-CD2 3.64Å; Y97-F250 AromaticContact CE1-CE2 3.79Å; Y97-F250 HydrophobicContact CE1-CE2 3.79Å
98	G	98.5	Very high	97.7	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	107.4	173.3	0	0	0	0	0	111.4	L85 Y86 K245 F250	L85-G98 VanDerWaalsContact CD1-C 3.42Å; Y86-G98 WeakPolarHBondContact O-CA 3.17Å; G98-K245 WeakPolarHBondContact O-CE 3.45Å; G98-F250 PolarHBondContact N-O 2.89Å
99	L	98.4	Very high	97.6	Very high	6 Å²	6	47.8 Å²	47.8	3%	0.031	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	143.5	178.9	-68.3	179.4	0	0	0	113.1	W62 Y86 I88 Y90 L101 V107 F250	W62-L99 HydrophobicContact CE3-CD1 4.47Å; W62-L99 HydrophobicContact CH2-CD1 4.49Å; W62-L99 HydrophobicContact CH2-CD2 3.83Å; W62-L99 HydrophobicContact CZ3-CD1 3.83Å; W62-L99 HydrophobicContact CZ3-CD2 3.87Å; Y86-L99 PolarHBondContact N-O 3.03Å; Y86-L99 PolarHBondContact O-N 2.84Å; I88-L99 HydrophobicContact CD1-CB 4.13Å; I88-L99 HydrophobicContact CD1-CD1 4.27Å; I88-L99 HydrophobicContact CD1-CG 4.49Å; Y90-L99 VanDerWaalsContact OH-CD1 3.29Å; Y90-L99 WeakPolarHBondContact OH-CD1 3.2Å; L99-L101 VanDerWaalsContact C-N 3.29Å; L99-L101 HydrophobicContact CB-CD2 4.33Å; L99-L101 HydrophobicContact CB-CG 4.46Å; L99-L101 PolarHBondContact O-N 3.35Å; L99-L101 VanDerWaalsContact O-N 3.09Å; L99-V107 HydrophobicContact CD1-CG2 4.38Å; L99-F250 HydrophobicContact CD2-CB 3.65Å
100	E	98.1	Very high	97.6	Very high	66 Å²	66	49.4 Å²	49.4	31%	0.308	28%	0.276	S	S	.	.			trans	-83.7	73.5	167.8	-63.2	-156.6	179.8	0	0	110.9	N82 S84 L85 Y102 A103 D104	N82-E100 PolarHBondContact ND2-OE1 2.92Å; S84-E100 VanDerWaalsContact CB-CD 3.42Å; S84-E100 VanDerWaalsContact CB-OE2 3.25Å; S84-E100 WeakPolarHBondContact CB-OE2 3.41Å; S84-E100 WeakPolarHBondContact O-CA 3.24Å; L85-E100 HydrophobicContact CB-CG 4.36Å; L85-E100 HydrophobicContact CD1-CG 4.47Å; E100-Y102 PolarHBondContact O-N 2.79Å; E100-A103 HydrophobicContact CB-CB 4.16Å; E100-A103 PolarHBondContact O-N 3.01Å; E100-D104 PolarHBondContact O-N 3.05Å
101	L	97.8	Very high	97.5	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.026	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-18.4	-170.1	-76.8	177.9	0	0	0	116.9	I53 I58 V75 Y86 I88 L99 V107 L110	I53-L101 HydrophobicContact CD1-CD1 3.83Å; I58-L101 HydrophobicContact CD1-CD1 3.83Å; I58-L101 HydrophobicContact CD1-CD2 4.29Å; V75-L101 HydrophobicContact CG2-CD1 4.34Å; Y86-L101 HydrophobicContact CD2-CB 3.97Å; Y86-L101 HydrophobicContact CD2-CD1 4.02Å; Y86-L101 HydrophobicContact CD2-CG 4.17Å; Y86-L101 HydrophobicContact CE2-CB 4.43Å; Y86-L101 HydrophobicContact CG-CD1 3.97Å; I88-L101 HydrophobicContact CD1-CD1 3.83Å; I88-L101 HydrophobicContact CD1-CD2 3.75Å; I88-L101 HydrophobicContact CD1-CG 3.89Å; L99-L101 VanDerWaalsContact C-N 3.29Å; L99-L101 HydrophobicContact CB-CD2 4.33Å; L99-L101 HydrophobicContact CB-CG 4.46Å; L99-L101 PolarHBondContact O-N 3.35Å; L99-L101 VanDerWaalsContact O-N 3.09Å; L101-V107 HydrophobicContact CD2-CG1 4.11Å; L101-V107 HydrophobicContact CD2-CG2 4.38Å; L101-L110 HydrophobicContact CB-CD2 3.92Å; L101-L110 HydrophobicContact CD2-CD1 4.36Å
102	Y	96.8	Very high	97.5	Very high	93 Å²	93	54 Å²	54	37%	0.365	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	4.4	179.4	-65.1	-70.4	0	0	0	114.4	I53 Y86 E100 L110	I53-Y102 HydrophobicContact CD1-CE2 4.02Å; Y86-Y102 AromaticContact CE2-CD2 3.92Å; Y86-Y102 HydrophobicContact CE2-CD2 3.92Å; Y86-Y102 HydrophobicContact CE2-CE2 4.05Å; E100-Y102 PolarHBondContact O-N 2.79Å; Y102-L110 HydrophobicContact CD1-CD2 4.17Å; Y102-L110 HydrophobicContact CE1-CD2 3.75Å
103	A	96.3	Very high	97.5	Very high	65 Å²	65	52.1 Å²	52.1	54%	0.537	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.9	-27.8	-176.6	0	0	0	0	0	113.6	E100 E105	E100-A103 HydrophobicContact CB-CB 4.16Å; E100-A103 PolarHBondContact O-N 3.01Å; A103-E105 PolarHBondContact O-N 3.46Å
104	D	97	Very high	97.1	Very high	28 Å²	28	53.6 Å²	53.6	15%	0.15	29%	0.292	C	S	.	.			trans	-70.8	111.6	176.8	-170.3	-26	0	0	0	111.2	E100 R106 V107	E100-D104 PolarHBondContact O-N 3.05Å; D104-R106 PolarHBondContact O-N 2.8Å; D104-R106 WeakPolarHBondContact OD1-CB 3.22Å; D104-R106 VanDerWaalsContact OD1-CG 3.31Å; D104-R106 WeakPolarHBondContact OD1-CG 3.35Å; D104-R106 IonicContact OD1-CZ 2.72Å; D104-R106 PolarHBondContact OD1-N 2.93Å; D104-R106 IonicContact OD1-NE 2.79Å; D104-R106 PolarHBondContact OD1-NE 2.65Å; D104-R106 IonicContact OD1-NH2 2.67Å; D104-R106 IonicContact OD2-CZ 3.06Å; D104-R106 IonicContact OD2-NE 2.64Å; D104-R106 PolarHBondContact OD2-NE 3.33Å; D104-R106 IonicContact OD2-NH2 2.97Å; D104-R106 PolarHBondContact OD2-NH2 2.8Å; D104-V107 HydrophobicContact CB-CG2 4.06Å; D104-V107 WeakPolarHBondContact O-CB 3.28Å; D104-V107 PolarHBondContact O-N 3.23Å
105	E	96.7	Very high	96.6	Very high	182 Å²	182	55.7 Å²	55.7	85%	0.85	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-16.6	-178.4	-58.8	-169.6	156.8	0	0	114	A103 V107	A103-E105 PolarHBondContact O-N 3.46Å; E105-V107 VanDerWaalsContact C-N 3.31Å
106	R	97.4	Very high	95.6	Very high	98 Å²	98	65 Å²	65	37%	0.37	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-24.9	174.5	-57.2	173.4	-71.1	-171.8	1.9	111.7	W62 K63 D104	W62-R106 CarbonylContact C-O 3.57Å; W62-R106 WeakPolarHBondContact CA-O 3.15Å; W62-R106 HydrophobicContact CD2-CB 4Å; W62-R106 HydrophobicContact CE3-CB 3.76Å; W62-R106 HydrophobicContact CH2-CB 3.94Å; W62-R106 HydrophobicContact CH2-CG 4.49Å; W62-R106 VanDerWaalsContact CH2-CZ 3.41Å; W62-R106 VanDerWaalsContact CH2-NE 3.27Å; W62-R106 HydrophobicContact CZ2-CB 4.14Å; W62-R106 HydrophobicContact CZ2-CG 4.48Å; W62-R106 HydrophobicContact CZ3-CB 3.72Å; K63-R106 PolarHBondContact N-O 2.89Å; K63-R106 WeakPolarHBondContact O-CB 2.99Å; K63-R106 WeakPolarHBondContact O-CG 3.21Å; D104-R106 PolarHBondContact O-N 2.8Å; D104-R106 WeakPolarHBondContact OD1-CB 3.22Å; D104-R106 VanDerWaalsContact OD1-CG 3.31Å; D104-R106 WeakPolarHBondContact OD1-CG 3.35Å; D104-R106 IonicContact OD1-CZ 2.72Å; D104-R106 PolarHBondContact OD1-N 2.93Å; D104-R106 IonicContact OD1-NE 2.79Å; D104-R106 PolarHBondContact OD1-NE 2.65Å; D104-R106 IonicContact OD1-NH2 2.67Å; D104-R106 IonicContact OD2-CZ 3.06Å; D104-R106 IonicContact OD2-NE 2.64Å; D104-R106 PolarHBondContact OD2-NE 3.33Å; D104-R106 IonicContact OD2-NH2 2.97Å; D104-R106 PolarHBondContact OD2-NH2 2.8Å
107	V	98.2	Very high	94.7	Very high	19 Å²	19	66.9 Å²	66.9	12%	0.115	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	109	177.7	-177.2	0	0	0	0	109.4	H60 W62 L99 L101 D104 E105 L110	H60-V107 HydrophobicContact CB-CG1 4.02Å; W62-V107 HydrophobicContact CE3-CG2 4.09Å; W62-V107 HydrophobicContact CZ3-CG2 3.92Å; L99-V107 HydrophobicContact CD1-CG2 4.38Å; L101-V107 HydrophobicContact CD2-CG1 4.11Å; L101-V107 HydrophobicContact CD2-CG2 4.38Å; D104-V107 HydrophobicContact CB-CG2 4.06Å; D104-V107 WeakPolarHBondContact O-CB 3.28Å; D104-V107 PolarHBondContact O-N 3.23Å; E105-V107 VanDerWaalsContact C-N 3.31Å; V107-L110 HydrophobicContact CG1-CB 4.32Å
108	V	98	Very high	93.6	Very high	48 Å²	48	69.7 Å²	69.7	29%	0.291	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.9	-176.3	178.4	0	0	0	0	111	I61 K63	I61-V108 HydrophobicContact CB-CB 4.36Å; I61-V108 WeakPolarHBondContact CB-O 3.49Å; I61-V108 PolarHBondContact N-O 2.97Å; I61-V108 PolarHBondContact O-N 2.82Å; K63-V108 HydrophobicContact CD-CB 4.49Å; K63-V108 HydrophobicContact CD-CG2 3.81Å; K63-V108 HydrophobicContact CG-CG2 4.21Å
109	G	97.2	Very high	92.6	Very high	51 Å²	51	79 Å²	79	53%	0.526	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	66.8	47.4	179.2	0	0	0	0	0	112.7	E111	G109-E111 PolarHBondContact O-N 2.99Å
110	L	98.1	Very high	91.8	Very high	44 Å²	44	81.1 Å²	81.1	23%	0.23	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	117	175.1	178.7	65.6	0	0	0	110.8	I58 H60 L101 Y102 V107	I58-L110 HydrophobicContact CB-CD1 4.16Å; I58-L110 HydrophobicContact CD1-CD1 4.11Å; I58-L110 HydrophobicContact CG2-CD1 4.43Å; H60-L110 HydrophobicContact CB-CB 4.4Å; H60-L110 HydrophobicContact CB-CD1 4.18Å; L101-L110 HydrophobicContact CB-CD2 3.92Å; L101-L110 HydrophobicContact CD2-CD1 4.36Å; Y102-L110 HydrophobicContact CD1-CD2 4.17Å; Y102-L110 HydrophobicContact CE1-CD2 3.75Å; V107-L110 HydrophobicContact CG1-CB 4.32Å
111	E	97.3	Very high	90.9	Very high	108 Å²	108	89.2 Å²	89.2	51%	0.505	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	138.3	178.7	-68.6	179.1	168.4	0	0	110.4	I58 Q59 G109	I58-E111 CarbonylContact C-O 3.59Å; I58-E111 WeakPolarHBondContact CA-O 3.26Å; Q59-E111 HydrophobicContact CG-CB 3.95Å; Q59-E111 PolarHBondContact N-O 2.87Å; Q59-E111 PolarHBondContact NE2-OE2 3.08Å; Q59-E111 PolarHBondContact O-N 2.94Å; G109-E111 PolarHBondContact O-N 2.99Å
112	V	96.9	Very high	90.2	Very high	70 Å²	70	90.4 Å²	90.4	42%	0.424	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	120	170.9	-179.7	0	0	0	0	107.9	I53 C56 I58	I53-V112 HydrophobicContact CG2-CG2 3.63Å; C56-V112 HydrophobicContact CB-CG1 3.81Å; I58-V112 HydrophobicContact CG2-CG2 4.47Å
113	L	95.5	Very high	89.3	Confident	27 Å²	27	90 Å²	90	14%	0.141	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	153.2	179	-66.1	175.7	0	0	0	110.5	R57 Q59 D115	R57-L113 HydrophobicContact CB-CB 3.91Å; R57-L113 HydrophobicContact CB-CD1 4.2Å; R57-L113 PolarHBondContact O-N 3.02Å; Q59-L113 HydrophobicContact CB-CD1 4.31Å; Q59-L113 HydrophobicContact CB-CD2 4.38Å; Q59-L113 HydrophobicContact CB-CG 4.4Å; Q59-L113 HydrophobicContact CG-CD2 3.89Å; Q59-L113 HydrophobicContact CG-CG 4.33Å; L113-D115 PolarHBondContact O-N 2.93Å
114	P	89.6	Confident	89	Confident	118 Å²	118	90.4 Å²	90.4	77%	0.766	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	-24.4	176.7	29.6	-35.6	0	0	0	112.4
115	D	85.1	Confident	88.7	Confident	99 Å²	99	92.3 Å²	92.3	53%	0.529	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	135.4	-179.4	-52.8	-46.3	0	0	0	111.1	R57 L113	R57-D115 HydrophobicContact CB-CB 4.32Å; R57-D115 VanDerWaalsContact CB-O 3.3Å; R57-D115 WeakPolarHBondContact CB-O 3.4Å; R57-D115 HydrophobicContact CG-CB 4.08Å; R57-D115 VanDerWaalsContact CG-O 3.25Å; R57-D115 WeakPolarHBondContact CG-O 3.48Å; L113-D115 PolarHBondContact O-N 2.93Å
116	R	77.7	Confident	88.6	Confident	211 Å²	211	89.4 Å²	89.4	80%	0.796	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109	150.2	169.4	-65.5	-172.9	177.7	-155	-2.3	109.3	A118	R116-A118 PolarHBondContact O-N 3.23Å
117	V	78.8	Confident	88.4	Confident	39 Å²	39	86 Å²	86	24%	0.236	47%	0.472	C	S	.	.			trans	-58.6	124.2	168.7	-178.8	0	0	0	0	108.5	T74 I160 M161	T74-V117 HydrophobicContact CG2-CG2 3.43Å; T74-V117 VanDerWaalsContact CG2-CG2 3.43Å; V117-I160 HydrophobicContact CB-CG2 4.15Å; V117-I160 HydrophobicContact CG1-CG2 4.35Å; V117-I160 HydrophobicContact CG2-CG2 3.9Å; V117-M161 HydrophobicContact CG1-CG 3.92Å; V117-M161 HydrophobicContact CG2-CG 4.46Å
118	A	76.8	Confident	88.2	Confident	86 Å²	86	85.1 Å²	85.1	71%	0.711	47%	0.467	S	S	*	.			trans	-67.4	133.2	175.3	0	0	0	0	0	110	R116 A120	R116-A118 PolarHBondContact O-N 3.23Å; A118-A120 VanDerWaalsContact C-N 3.31Å; A118-A120 PolarHBondContact O-N 2.79Å
119	Q	77.3	Confident	88	Confident	196 Å²	196	88.7 Å²	88.7	92%	0.916	48%	0.481	S	S	*	.			trans	-73.9	85.9	173.8	-73.7	-174.6	-33.9	0	0	110.2
120	A	81.1	Confident	87.9	Confident	51 Å²	51	89.6 Å²	89.6	42%	0.421	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-66.7	142	167.1	0	0	0	0	0	110.4	A118 T163	A118-A120 VanDerWaalsContact C-N 3.31Å; A118-A120 PolarHBondContact O-N 2.79Å; A120-T163 HydrophobicContact CB-CG2 3.64Å
121	R	80.1	Confident	87.8	Confident	235 Å²	235	87.5 Å²	87.5	89%	0.887	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-82.7	138.1	169.6	-65.9	-177.4	-180	-179	0	109
122	V	81.8	Confident	87.7	Confident	30 Å²	30	84.9 Å²	84.9	18%	0.182	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-65.4	137.3	166.5	164.8	0	0	0	0	109	D124 A128 R157 T162 T163 L181	V122-D124 VanDerWaalsContact CG1-C 3.5Å; V122-D124 WeakPolarHBondContact CG1-O 3.5Å; V122-A128 HydrophobicContact CG1-CB 4.02Å; V122-R157 VanDerWaalsContact CG2-NH2 3.35Å; V122-T162 VanDerWaalsContact CG2-O 3.24Å; V122-T162 WeakPolarHBondContact CG2-O 3.49Å; V122-T163 HydrophobicContact CG2-CG2 4.25Å; V122-L181 HydrophobicContact CG1-CD1 3.74Å
123	S	79.5	Confident	87.7	Confident	85 Å²	85	82.5 Å²	82.5	59%	0.594	44%	0.444	S	S	*	.	S	Bend	trans	-80.6	-38.8	-175.7	33.9	0	0	0	0	112.9	K185	S123-K185 PolarHBondContact OG-NZ 3.27Å
124	D	89.7	Confident	87.8	Confident	73 Å²	73	83.4 Å²	83.4	39%	0.39	45%	0.447	S	S	.	.			trans	-132.3	109.4	170.5	-172.7	-26.4	0	0	0	108.7	V122 L126 L127 A128	V122-D124 VanDerWaalsContact CG1-C 3.5Å; V122-D124 WeakPolarHBondContact CG1-O 3.5Å; D124-L126 PolarHBondContact OD1-N 2.91Å; D124-L127 HydrophobicContact CB-CB 3.99Å; D124-L127 VanDerWaalsContact CG-CB 3.48Å; D124-L127 PolarHBondContact OD1-N 2.95Å; D124-A128 WeakPolarHBondContact O-CB 3.48Å; D124-A128 PolarHBondContact O-N 2.8Å
125	S	90.3	Very high	88.1	Confident	68 Å²	68	79.3 Å²	79.3	48%	0.476	42%	0.423	S	S	.	.	H	α-helix	trans	-78.1	-30.9	179.8	55	0	0	0	0	112.8	A128 E129	S125-A128 PolarHBondContact O-N 3.17Å; S125-E129 WeakPolarHBondContact O-CB 3.23Å; S125-E129 VanDerWaalsContact O-CG 3.32Å; S125-E129 WeakPolarHBondContact O-CG 3.16Å; S125-E129 PolarHBondContact O-N 2.84Å
126	L	93.5	Very high	88.7	Confident	121 Å²	121	74.6 Å²	74.6	63%	0.634	40%	0.397	S	S	*	.	H	α-helix	trans	-71.4	-43.7	-179.3	179	61.8	0	0	0	110	D124 E129 T130	D124-L126 PolarHBondContact OD1-N 2.91Å; L126-E129 PolarHBondContact O-N 3.07Å; L126-T130 VanDerWaalsContact O-CB 3.29Å; L126-T130 WeakPolarHBondContact O-CB 3.37Å; L126-T130 PolarHBondContact O-N 2.79Å; L126-T130 PolarHBondContact O-OG1 3.19Å
127	L	94.1	Very high	89.7	Confident	26 Å²	26	65.4 Å²	65.4	14%	0.136	36%	0.363	C	S	.	.	H	α-helix	trans	-61.7	-44.6	171.6	-178.5	59.7	0	0	0	111.1	D124 E129 T130 M131 L181 Y184 I191	D124-L127 HydrophobicContact CB-CB 3.99Å; D124-L127 VanDerWaalsContact CG-CB 3.48Å; D124-L127 PolarHBondContact OD1-N 2.95Å; L127-E129 VanDerWaalsContact C-N 3.3Å; L127-E129 PolarHBondContact O-N 2.83Å; L127-T130 PolarHBondContact O-N 2.7Å; L127-T130 VanDerWaalsContact O-N 3.16Å; L127-M131 HydrophobicContact CD1-CG 4.14Å; L127-M131 HydrophobicContact CD1-SD 4.18Å; L127-M131 HydrophobicContact CG-CG 4.42Å; L127-M131 HydrophobicContact CG-SD 3.9Å; L127-M131 WeakPolarHBondContact O-CG 3.38Å; L127-M131 PolarHBondContact O-N 2.74Å; L127-L181 HydrophobicContact CB-CD2 4.03Å; L127-L181 HydrophobicContact CD2-CD2 3.69Å; L127-L181 HydrophobicContact CG-CD2 3.71Å; L127-Y184 HydrophobicContact CD1-CE1 4.24Å; L127-Y184 HydrophobicContact CD2-CD1 3.57Å; L127-Y184 HydrophobicContact CD2-CE1 3.7Å; L127-Y184 HydrophobicContact CD2-CG 4.25Å; L127-I191 HydrophobicContact CD1-CD1 3.98Å
128	A	94.5	Very high	90.6	Very high	2 Å²	2	63.8 Å²	63.8	2%	0.017	35%	0.353	C	S	.	.	H	α-helix	trans	-57.2	-41.4	177.1	0	0	0	0	0	113.1	V122 D124 S125 I132 F165 L181	V122-A128 HydrophobicContact CG1-CB 4.02Å; D124-A128 WeakPolarHBondContact O-CB 3.48Å; D124-A128 PolarHBondContact O-N 2.8Å; S125-A128 PolarHBondContact O-N 3.17Å; A128-I132 WeakPolarHBondContact O-CG1 3.4Å; A128-F165 HydrophobicContact CB-CE1 3.96Å; A128-F165 HydrophobicContact CB-CZ 3.67Å; A128-L181 HydrophobicContact CB-CD1 4.18Å; A128-L181 HydrophobicContact CB-CD2 4.36Å
129	E	93.8	Very high	91.5	Very high	123 Å²	123	61.6 Å²	61.6	58%	0.575	33%	0.329	S	S	*	.	H	α-helix	trans	-71.9	-41.7	175.7	-73	161.9	-161.6	0	0	111.3	S125 L126 L127 M131 I132	S125-E129 WeakPolarHBondContact O-CB 3.23Å; S125-E129 VanDerWaalsContact O-CG 3.32Å; S125-E129 WeakPolarHBondContact O-CG 3.16Å; S125-E129 PolarHBondContact O-N 2.84Å; L126-E129 PolarHBondContact O-N 3.07Å; L127-E129 VanDerWaalsContact C-N 3.3Å; L127-E129 PolarHBondContact O-N 2.83Å; E129-M131 VanDerWaalsContact C-N 3.28Å; E129-M131 PolarHBondContact O-N 3.42Å; E129-I132 PolarHBondContact O-N 2.96Å
130	T	94.1	Very high	92.2	Very high	69 Å²	69	54.6 Å²	54.6	42%	0.423	30%	0.295	S	S	.	.	H	α-helix	trans	-62.2	-31.8	179.3	-58.4	0	0	0	0	113.2	L126 L127 K134	L126-T130 VanDerWaalsContact O-CB 3.29Å; L126-T130 WeakPolarHBondContact O-CB 3.37Å; L126-T130 PolarHBondContact O-N 2.79Å; L126-T130 PolarHBondContact O-OG1 3.19Å; L127-T130 PolarHBondContact O-N 2.7Å; L127-T130 VanDerWaalsContact O-N 3.16Å; T130-K134 VanDerWaalsContact O-CE 3.26Å; T130-K134 WeakPolarHBondContact O-CE 3.32Å; T130-K134 WeakPolarHBondContact O-CG 3.32Å
131	M	95.8	Very high	92.6	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-26.2	-179.9	-71.2	166.6	84.1	0	0	113.5	L127 E129 G133 K134 V154 L180 L181 L189 I191	L127-M131 HydrophobicContact CD1-CG 4.14Å; L127-M131 HydrophobicContact CD1-SD 4.18Å; L127-M131 HydrophobicContact CG-CG 4.42Å; L127-M131 HydrophobicContact CG-SD 3.9Å; L127-M131 WeakPolarHBondContact O-CG 3.38Å; L127-M131 PolarHBondContact O-N 2.74Å; E129-M131 VanDerWaalsContact C-N 3.28Å; E129-M131 PolarHBondContact O-N 3.42Å; M131-G133 PolarHBondContact O-N 3.16Å; M131-K134 VanDerWaalsContact O-CB 3.31Å; M131-K134 WeakPolarHBondContact O-CB 3.25Å; M131-K134 WeakPolarHBondContact O-CG 3.45Å; M131-K134 PolarHBondContact O-N 3.31Å; M131-K134 VanDerWaalsContact O-N 3.17Å; M131-V154 WeakPolarHBondContact O-CB 3.13Å; M131-L180 HydrophobicContact CE-CB 3.59Å; M131-L181 HydrophobicContact SD-CD2 3.89Å; M131-L189 HydrophobicContact CE-CD2 3.38Å; M131-I191 HydrophobicContact CG-CD1 3.59Å; M131-I191 HydrophobicContact CG-CG1 4.31Å
132	I	96.9	Very high	92.7	Very high	53 Å²	53	51 Å²	51	27%	0.272	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	132.9	-171.7	-69.2	166.7	0	0	0	110.7	A128 E129 K134 R157 A237	A128-I132 WeakPolarHBondContact O-CG1 3.4Å; E129-I132 PolarHBondContact O-N 2.96Å; I132-K134 PolarHBondContact O-N 3.41Å; I132-R157 HydrophobicContact CD1-CB 4.19Å; I132-A237 HydrophobicContact CG2-CB 3.53Å
133	G	96.1	Very high	92.6	Very high	21 Å²	21	56 Å²	56	22%	0.216	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	-9.2	-174.6	0	0	0	0	0	114.8	M131 V154	M131-G133 PolarHBondContact O-N 3.16Å; G133-V154 VanDerWaalsContact CA-O 3.3Å; G133-V154 WeakPolarHBondContact CA-O 3.35Å; G133-V154 PolarHBondContact N-O 2.71Å
134	K	96.9	Very high	92.4	Very high	46 Å²	46	60.2 Å²	60.2	20%	0.2	32%	0.321	C	S	.	.			trans	-76.7	144	-177.6	-56.9	-64.9	168.9	-175.4	0	112.1	T130 M131 I132 M153 V154 I191 D194	T130-K134 VanDerWaalsContact O-CE 3.26Å; T130-K134 WeakPolarHBondContact O-CE 3.32Å; T130-K134 WeakPolarHBondContact O-CG 3.32Å; M131-K134 VanDerWaalsContact O-CB 3.31Å; M131-K134 WeakPolarHBondContact O-CB 3.25Å; M131-K134 WeakPolarHBondContact O-CG 3.45Å; M131-K134 PolarHBondContact O-N 3.31Å; M131-K134 VanDerWaalsContact O-N 3.17Å; I132-K134 PolarHBondContact O-N 3.41Å; K134-M153 WeakPolarHBondContact O-CA 3.36Å; K134-V154 PolarHBondContact O-N 2.61Å; K134-I191 HydrophobicContact CB-CG2 3.93Å; K134-I191 HydrophobicContact CG-CG2 4Å; K134-D194 WeakPolarHBondContact CD-OD1 3.32Å; K134-D194 IonicContact NZ-OD1 2.81Å; K134-D194 PolarHBondContact NZ-OD1 2.95Å; K134-D194 IonicContact NZ-OD2 3.63Å; K134-D194 PolarHBondContact NZ-OD2 3.24Å
135	A	97.2	Very high	91.6	Very high	32 Å²	32	58.8 Å²	58.8	26%	0.264	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	143	159.2	0	0	0	0	0	109.4	G152 M192	A135-G152 CarbonylContact C-O 3.56Å; A135-G152 VanDerWaalsContact CA-O 3.32Å; A135-G152 WeakPolarHBondContact CA-O 3.48Å; A135-M192 HydrophobicContact CB-CB 4.14Å; A135-M192 WeakPolarHBondContact O-CB 3.42Å; A135-M192 PolarHBondContact O-N 2.72Å
136	V	97.8	Very high	91.3	Very high	0 Å²	0	61 Å²	61	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	159	-178.5	-66.1	0	0	0	0	110.5	R151 G152 V154 I167 L189 R190	V136-R151 CarbonylContact O-C 3.14Å; V136-R151 WeakPolarHBondContact O-CA 3.19Å; V136-G152 PolarHBondContact N-O 3.02Å; V136-G152 PolarHBondContact O-N 2.85Å; V136-V154 HydrophobicContact CG1-CG2 3.73Å; V136-V154 HydrophobicContact CG2-CG2 4.1Å; V136-I167 HydrophobicContact CG2-CD1 3.67Å; V136-L189 HydrophobicContact CB-CD1 3.98Å; V136-L189 HydrophobicContact CG1-CD1 4.45Å; V136-L189 HydrophobicContact CG2-CD1 4.11Å; V136-R190 CarbonylContact C-O 2.96Å; V136-R190 VanDerWaalsContact CA-O 3.23Å; V136-R190 WeakPolarHBondContact CA-O 3.42Å; V136-R190 WeakPolarHBondContact CB-O 3.47Å
137	E	97.9	Very high	90.9	Very high	17 Å²	17	59.4 Å²	59.4	8%	0.079	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	125.7	163.2	-72.3	152.2	163.5	0	0	107.7	E149 R151 L189 R190 M192	E137-E149 HydrophobicContact CB-CG 3.8Å; E137-E149 HydrophobicContact CG-CG 4.12Å; E137-R151 HydrophobicContact CG-CB 4.4Å; E137-R151 HydrophobicContact CG-CG 4.4Å; E137-L189 WeakPolarHBondContact O-CA 3.26Å; E137-R190 HydrophobicContact CB-CB 4.45Å; E137-R190 PolarHBondContact N-O 2.82Å; E137-R190 PolarHBondContact O-N 2.59Å; E137-R190 IonicContact OE1-NH2 3.73Å; E137-R190 IonicContact OE2-CZ 3.98Å; E137-R190 IonicContact OE2-NE 3.45Å; E137-R190 PolarHBondContact OE2-NE 2.98Å; E137-R190 IonicContact OE2-NH2 2.71Å; E137-R190 PolarHBondContact OE2-NH2 2.83Å; E137-M192 HydrophobicContact CG-CG 4.44Å; E137-M192 HydrophobicContact CG-SD 4.34Å; E137-M192 WeakPolarHBondContact OE1-CE 3.1Å
138	H	97.6	Very high	90.8	Very high	6 Å²	6	62.2 Å²	62.2	3%	0.028	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128	-177.7	-161.7	172.3	0	0	0	108.4	F140 W150 Y169 D183 D188 L189	H138-F140 HydrophobicContact CB-CE2 4.06Å; H138-F140 HydrophobicContact CB-CZ 4.34Å; H138-F140 AromaticContact CE1-CE1 3.92Å; H138-F140 AromaticContact CE1-CZ 3.73Å; H138-F140 AromaticContact CG-CE2 3.94Å; H138-F140 AromaticContact CG-CZ 3.74Å; H138-F140 AromaticContact ND1-CZ 3.44Å; H138-F140 WeakPolarHBondContact ND1-CZ 3.32Å; H138-W150 PolarHBondContact N-O 2.9Å; H138-W150 PolarHBondContact O-N 3.23Å; H138-Y169 HydrophobicContact CB-CE1 3.98Å; H138-Y169 AromaticContact ND1-CZ 3.9Å; H138-Y169 PolarHBondContact ND1-OH 3.33Å; H138-D183 IonicContact CE1-OD2 2.74Å; H138-D183 IonicContact NE2-OD2 2.72Å; H138-D188 PolarHBondContact CD2-O 2.86Å; H138-L189 HydrophobicContact CB-CD1 3.71Å
139	M	96.2	Very high	90.8	Very high	39 Å²	39	66.2 Å²	66.2	19%	0.192	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	117	-174.4	-70.8	79.1	85.8	0	0	110.7	K147 E148 E149 G187 D188	M139-K147 HydrophobicContact CB-CB 4.17Å; M139-K147 HydrophobicContact CB-CD 4.23Å; M139-E148 WeakPolarHBondContact CA-O 3.45Å; M139-E149 HydrophobicContact CG-CG 4.48Å; M139-E149 HydrophobicContact SD-CG 4.4Å; M139-G187 WeakPolarHBondContact CE-O 3.45Å; M139-D188 HydrophobicContact CB-CB 4.44Å; M139-D188 PolarHBondContact N-O 2.82Å
140	F	91.8	Very high	90.9	Very high	49 Å²	49	62.9 Å²	62.9	22%	0.215	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	135.4	-178.2	-67.6	-75.2	0	0	0	112.4	H138 K147 E148 W150 Y169 Y178	H138-F140 HydrophobicContact CB-CE2 4.06Å; H138-F140 HydrophobicContact CB-CZ 4.34Å; H138-F140 AromaticContact CE1-CE1 3.92Å; H138-F140 AromaticContact CE1-CZ 3.73Å; H138-F140 AromaticContact CG-CE2 3.94Å; H138-F140 AromaticContact CG-CZ 3.74Å; H138-F140 AromaticContact ND1-CZ 3.44Å; H138-F140 WeakPolarHBondContact ND1-CZ 3.32Å; F140-K147 CarbonylContact O-C 3.49Å; F140-K147 WeakPolarHBondContact O-CA 3.35Å; F140-K147 WeakPolarHBondContact O-CB 3.28Å; F140-E148 PolarHBondContact N-O 2.84Å; F140-E148 PolarHBondContact O-N 2.81Å; F140-W150 HydrophobicContact CD2-CB 4.02Å; F140-W150 AromaticContact CD2-CD1 3.77Å; F140-W150 HydrophobicContact CD2-CD2 4.36Å; F140-W150 AromaticContact CD2-CG 3.8Å; F140-W150 HydrophobicContact CD2-CG 3.8Å; F140-W150 HydrophobicContact CE2-CB 3.84Å; F140-W150 HydrophobicContact CE2-CD2 4.34Å; F140-W150 AromaticContact CE2-CG 3.93Å; F140-W150 HydrophobicContact CE2-CG 3.93Å; F140-Y169 HydrophobicContact CE2-CE1 4.36Å; F140-Y169 AromaticContact CZ-CZ 3.99Å; F140-Y178 HydrophobicContact CE1-CE1 4.19Å; F140-Y178 AromaticContact CE1-CZ 3.95Å; F140-Y178 HydrophobicContact CZ-CE2 4.34Å
141	E	88.4	Confident	91.1	Very high	154 Å²	154	64.8 Å²	64.8	72%	0.72	34%	0.337	S	S	*	.			trans	-68.2	132.4	173.6	-60.1	-164	145.9	0	0	112.2	K147	E141-K147 HydrophobicContact CG-CD 4.12Å; E141-K147 HydrophobicContact CG-CG 4.27Å; E141-K147 IonicContact OE1-NZ 3.78Å
142	T	83.3	Confident	91.2	Very high	58 Å²	58	65 Å²	65	36%	0.356	34%	0.34	S	S	.	.			trans	-102.9	150.4	174.4	65.4	0	0	0	0	110.1	D144 G145 P146 E148	T142-D144 VanDerWaalsContact C-N 3.26Å; T142-D144 PolarHBondContact O-N 2.87Å; T142-D144 VanDerWaalsContact O-N 3.16Å; T142-G145 VanDerWaalsContact OG1-CA 3.22Å; T142-G145 WeakPolarHBondContact OG1-CA 3.45Å; T142-G145 PolarHBondContact OG1-N 2.9Å; T142-G145 PolarHBondContact OG1-O 3.03Å; T142-P146 WeakPolarHBondContact CG2-O 3.37Å; T142-P146 PolarHBondContact OG1-O 3.49Å; T142-E148 HydrophobicContact CG2-CB 4.16Å
143	E	79.6	Confident	91.3	Very high	134 Å²	134	64.3 Å²	64.3	63%	0.626	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.8	-167.5	-60.2	-156.2	128.8	0	0	114.3	K2	K2-E143 WeakPolarHBondContact CE-OE1 3.32Å; K2-E143 WeakPolarHBondContact CE-OE2 3.33Å; K2-E143 WeakPolarHBondContact CG-OE1 3.44Å
144	D	75.9	Confident	91.4	Very high	173 Å²	173	63.3 Å²	63.3	93%	0.925	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.9	18.4	-176	-66.6	-71.6	0	0	0	113.5	T142	T142-D144 VanDerWaalsContact C-N 3.26Å; T142-D144 PolarHBondContact O-N 2.87Å; T142-D144 VanDerWaalsContact O-N 3.16Å
145	G	71.3	Confident	91.4	Very high	44 Å²	44	61.3 Å²	61.3	45%	0.454	32%	0.317	S	S	.	.	S	Bend	trans	-145.1	-174.2	-165.4	0	0	0	0	0	116.4	T142	T142-G145 VanDerWaalsContact OG1-CA 3.22Å; T142-G145 WeakPolarHBondContact OG1-CA 3.45Å; T142-G145 PolarHBondContact OG1-N 2.9Å; T142-G145 PolarHBondContact OG1-O 3.03Å
146	P	83.9	Confident	91.4	Very high	114 Å²	114	61.1 Å²	61.1	74%	0.74	32%	0.315	S	S	*	.	S	Bend	trans	-64.3	162.3	170.1	30.3	-35.4	0	0	0	111	T142	T142-P146 WeakPolarHBondContact CG2-O 3.37Å; T142-P146 PolarHBondContact OG1-O 3.49Å
147	K	86.8	Confident	91.3	Very high	88 Å²	88	65.9 Å²	65.9	38%	0.383	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-64.1	136.7	170.3	-58.5	-162	-176.1	-170	0	109.8	M139 F140 E141 D188	M139-K147 HydrophobicContact CB-CB 4.17Å; M139-K147 HydrophobicContact CB-CD 4.23Å; F140-K147 CarbonylContact O-C 3.49Å; F140-K147 WeakPolarHBondContact O-CA 3.35Å; F140-K147 WeakPolarHBondContact O-CB 3.28Å; E141-K147 HydrophobicContact CG-CD 4.12Å; E141-K147 HydrophobicContact CG-CG 4.27Å; E141-K147 IonicContact OE1-NZ 3.78Å; K147-D188 WeakPolarHBondContact CD-OD1 3.37Å; K147-D188 IonicContact NZ-OD1 2.62Å; K147-D188 PolarHBondContact NZ-OD1 2.9Å; K147-D188 IonicContact NZ-OD2 2.66Å; K147-D188 PolarHBondContact NZ-OD2 2.99Å
148	E	91.2	Very high	91.1	Very high	84 Å²	84	65.1 Å²	65.1	39%	0.393	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	128.9	175	-162.5	-165.8	171.6	0	0	110.2	M139 F140 T142 W150 K171	M139-E148 WeakPolarHBondContact CA-O 3.45Å; F140-E148 PolarHBondContact N-O 2.84Å; F140-E148 PolarHBondContact O-N 2.81Å; T142-E148 HydrophobicContact CG2-CB 4.16Å; E148-W150 PolarHBondContact OE1-NE1 2.93Å; E148-W150 PolarHBondContact OE2-NE1 3.34Å; E148-K171 IonicContact OE1-NZ 3.89Å; E148-K171 PolarHBondContact OE1-NZ 3.43Å
149	E	94.3	Very high	90.5	Very high	87 Å²	87	68.5 Å²	68.5	41%	0.407	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	127.9	175.8	-162.4	-178.5	62.3	0	0	110.6	E137 M139 K171 R190	E137-E149 HydrophobicContact CB-CG 3.8Å; E137-E149 HydrophobicContact CG-CG 4.12Å; M139-E149 HydrophobicContact CG-CG 4.48Å; M139-E149 HydrophobicContact SD-CG 4.4Å; E149-K171 PolarHBondContact O-NZ 3.21Å; E149-R190 IonicContact OE2-CZ 3.87Å; E149-R190 IonicContact OE2-NH2 2.61Å; E149-R190 PolarHBondContact OE2-NH2 3.4Å
150	W	97.1	Very high	90.3	Very high	53 Å²	53	69 Å²	69	20%	0.201	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	109.1	178.8	-80.5	57.4	0	0	0	109.7	H138 F140 E148 Y169 K171 D172	H138-W150 PolarHBondContact N-O 2.9Å; H138-W150 PolarHBondContact O-N 3.23Å; F140-W150 HydrophobicContact CD2-CB 4.02Å; F140-W150 AromaticContact CD2-CD1 3.77Å; F140-W150 HydrophobicContact CD2-CD2 4.36Å; F140-W150 AromaticContact CD2-CG 3.8Å; F140-W150 HydrophobicContact CD2-CG 3.8Å; F140-W150 HydrophobicContact CE2-CB 3.84Å; F140-W150 HydrophobicContact CE2-CD2 4.34Å; F140-W150 AromaticContact CE2-CG 3.93Å; F140-W150 HydrophobicContact CE2-CG 3.93Å; E148-W150 PolarHBondContact OE1-NE1 2.93Å; E148-W150 PolarHBondContact OE2-NE1 3.34Å; W150-Y169 HydrophobicContact CB-CD1 4.01Å; W150-Y169 HydrophobicContact CB-CE1 4.4Å; W150-Y169 HydrophobicContact CE3-CD1 4.38Å; W150-Y169 HydrophobicContact CE3-CD2 4.03Å; W150-Y169 AromaticContact CE3-CG 3.8Å; W150-Y169 HydrophobicContact CE3-CG 3.8Å; W150-Y169 HydrophobicContact CZ3-CD2 4.45Å; W150-K171 HydrophobicContact CD2-CD 4.06Å; W150-K171 HydrophobicContact CE3-CB 4.31Å; W150-K171 HydrophobicContact CE3-CD 4.4Å; W150-K171 HydrophobicContact CG-CD 4.42Å; W150-K171 HydrophobicContact CH2-CB 4.47Å; W150-K171 HydrophobicContact CZ2-CD 4.37Å; W150-K171 HydrophobicContact CZ3-CB 4.15Å; W150-D172 HydrophobicContact CZ3-CB 3.94Å
151	R	97.6	Very high	90.3	Very high	108 Å²	108	68 Å²	68	41%	0.408	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	135.9	175.2	-168.2	163.6	177.3	-104.9	-1	110.5	V136 E137 Y169 E170	V136-R151 CarbonylContact O-C 3.14Å; V136-R151 WeakPolarHBondContact O-CA 3.19Å; E137-R151 HydrophobicContact CG-CB 4.4Å; E137-R151 HydrophobicContact CG-CG 4.4Å; R151-Y169 WeakPolarHBondContact O-CA 3.25Å; R151-E170 VanDerWaalsContact CD-OE2 3.31Å; R151-E170 WeakPolarHBondContact CD-OE2 3.3Å; R151-E170 HydrophobicContact CG-CG 4.45Å; R151-E170 WeakPolarHBondContact CG-OE2 3.38Å; R151-E170 IonicContact CZ-OE1 2.84Å; R151-E170 IonicContact CZ-OE2 2.67Å; R151-E170 IonicContact NE-OE2 3.44Å; R151-E170 IonicContact NH1-OE1 3.22Å; R151-E170 PolarHBondContact NH1-OE1 3.28Å; R151-E170 IonicContact NH1-OE2 2.65Å; R151-E170 PolarHBondContact NH1-OE2 2.67Å; R151-E170 PolarHBondContact O-N 3.03Å
152	G	97.6	Very high	90.4	Very high	6 Å²	6	62.8 Å²	62.8	6%	0.062	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	-167.7	-173.8	0	0	0	0	0	113.5	A135 V136 T168	A135-G152 CarbonylContact C-O 3.56Å; A135-G152 VanDerWaalsContact CA-O 3.32Å; A135-G152 WeakPolarHBondContact CA-O 3.48Å; V136-G152 PolarHBondContact N-O 3.02Å; V136-G152 PolarHBondContact O-N 2.85Å; G152-T168 CarbonylContact C-O 3.55Å; G152-T168 WeakPolarHBondContact CA-O 3.38Å
153	M	98.1	Very high	90.9	Very high	38 Å²	38	61.1 Å²	61.1	19%	0.187	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	131.2	-178.3	-179.9	170.5	-79.5	0	0	111.1	K134 L155 I167 T168 K238	K134-M153 WeakPolarHBondContact O-CA 3.36Å; M153-L155 HydrophobicContact CG-CD2 4.3Å; M153-I167 WeakPolarHBondContact O-CA 3.29Å; M153-I167 WeakPolarHBondContact O-CG1 3.35Å; M153-T168 PolarHBondContact N-O 2.74Å; M153-T168 PolarHBondContact O-N 3.37Å; M153-K238 HydrophobicContact CE-CD 3.88Å; M153-K238 HydrophobicContact SD-CD 3.67Å
154	V	98.4	Very high	91.7	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	122.8	172.3	-174.2	0	0	0	0	108.5	M131 G133 K134 V136 F165 I167 L180	M131-V154 WeakPolarHBondContact O-CB 3.13Å; G133-V154 VanDerWaalsContact CA-O 3.3Å; G133-V154 WeakPolarHBondContact CA-O 3.35Å; G133-V154 PolarHBondContact N-O 2.71Å; K134-V154 PolarHBondContact O-N 2.61Å; V136-V154 HydrophobicContact CG1-CG2 3.73Å; V136-V154 HydrophobicContact CG2-CG2 4.1Å; V154-F165 HydrophobicContact CG1-CB 4.19Å; V154-F165 HydrophobicContact CG1-CD1 4.14Å; V154-I167 HydrophobicContact CG2-CD1 4.42Å; V154-L180 HydrophobicContact CB-CD1 4.41Å; V154-L180 HydrophobicContact CG1-CD1 4.02Å; V154-L180 HydrophobicContact CG2-CD1 3.59Å
155	L	98.3	Very high	92.8	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.016	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-48.6	-166.2	-58.1	163.7	0	0	0	111.4	M153 Y166 T168 L175 V235 V241 F243 V254	M153-L155 HydrophobicContact CG-CD2 4.3Å; L155-Y166 PolarHBondContact N-O 3.44Å; L155-T168 HydrophobicContact CD1-CG2 4.09Å; L155-T168 HydrophobicContact CD2-CG2 4.18Å; L155-T168 HydrophobicContact CG-CG2 4.49Å; L155-L175 HydrophobicContact CD1-CD1 3.64Å; L155-V235 HydrophobicContact CB-CG1 4.3Å; L155-V235 HydrophobicContact CD2-CG2 4.33Å; L155-V235 VanDerWaalsContact O-CG1 3.31Å; L155-V235 WeakPolarHBondContact O-CG1 3.44Å; L155-V241 HydrophobicContact CD2-CG1 4.24Å; L155-F243 HydrophobicContact CB-CZ 4.49Å; L155-F243 HydrophobicContact CD1-CE1 3.94Å; L155-F243 HydrophobicContact CD1-CZ 4.3Å; L155-V254 HydrophobicContact CD1-CG1 4.02Å; L155-V254 HydrophobicContact CD1-CG2 4.01Å; L155-V254 HydrophobicContact CD2-CG1 3.96Å
156	A	97.3	Very high	94.1	Very high	28 Å²	28	47.2 Å²	47.2	23%	0.231	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.9	169.1	-179.6	0	0	0	0	0	110.7	F165 Y166	A156-F165 CarbonylContact O-C 3.59Å; A156-F165 WeakPolarHBondContact O-CA 3.22Å; A156-Y166 HydrophobicContact CB-CD2 4.3Å; A156-Y166 PolarHBondContact O-N 2.84Å
157	R	95.6	Very high	94.8	Very high	100 Å²	100	41.8 Å²	41.8	38%	0.377	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	138.6	165.7	-177.1	174	171	-157.8	-7.4	109.9	V122 I132 T162 F165	V122-R157 VanDerWaalsContact CG2-NH2 3.35Å; I132-R157 HydrophobicContact CD1-CB 4.19Å; R157-T162 PolarHBondContact NE-O 3.09Å; R157-T162 PolarHBondContact NH2-O 2.69Å; R157-T162 PolarHBondContact NH2-OG1 2.81Å; R157-F165 HydrophobicContact CB-CD1 4.49Å
158	A	92.9	Very high	95.4	Very high	2 Å²	2	38.3 Å²	38.3	2%	0.017	19%	0.187	C	C	.	.			trans	-70.4	135.6	-177.6	0	0	0	0	0	111.7	I160 W164 Y166 M177	A158-I160 PolarHBondContact O-N 2.93Å; A158-W164 HydrophobicContact CB-CB 4.21Å; A158-W164 WeakPolarHBondContact CB-O 3.48Å; A158-W164 PolarHBondContact N-O 3.45Å; A158-Y166 HydrophobicContact CB-CE1 4.24Å; A158-M177 HydrophobicContact CB-CG 4.2Å; A158-M177 HydrophobicContact CB-SD 3.52Å; A158-M177 VanDerWaalsContact CB-SD 3.52Å
159	P	85.2	Confident	95.7	Very high	77 Å²	77	34.6 Å²	34.6	50%	0.5	17%	0.169	S	C	.	.	S	Bend	trans	-71.1	-35	-167	25.6	-34.8	0	0	0	114.2
160	I	92	Very high	95.8	Very high	50 Å²	50	36.4 Å²	36.4	26%	0.256	18%	0.178	S	C	.	.	S	Bend	trans	-98	-50.9	-178.6	-64	-58.7	0	0	0	111.5	V54 T74 L76 V117 A158 T162	V54-I160 HydrophobicContact CG1-CD1 4.22Å; V54-I160 HydrophobicContact CG1-CG1 4.38Å; T74-I160 HydrophobicContact CG2-CG2 3.95Å; L76-I160 VanDerWaalsContact O-CG1 3.27Å; L76-I160 WeakPolarHBondContact O-CG1 3.17Å; V117-I160 HydrophobicContact CB-CG2 4.15Å; V117-I160 HydrophobicContact CG1-CG2 4.35Å; V117-I160 HydrophobicContact CG2-CG2 3.9Å; A158-I160 PolarHBondContact O-N 2.93Å; I160-T162 VanDerWaalsContact C-N 3.31Å; I160-T162 WeakPolarHBondContact O-CG2 3.35Å; I160-T162 PolarHBondContact O-N 3.36Å; I160-T162 VanDerWaalsContact O-N 3.11Å
161	M	92.6	Very high	95.7	Very high	28 Å²	28	39.3 Å²	39.3	14%	0.138	19%	0.191	C	C	.	.	S	Bend	trans	-89.1	68.4	-177.3	-69.2	178.1	58.6	0	0	109.2	T74 L76 K89 V117 T163 W164 M177	T74-M161 HydrophobicContact CG2-CG 4.22Å; T74-M161 HydrophobicContact CG2-SD 3.97Å; L76-M161 HydrophobicContact CD2-CG 4.28Å; L76-M161 HydrophobicContact CD2-SD 4.07Å; K89-M161 HydrophobicContact CB-SD 4.3Å; K89-M161 HydrophobicContact CG-SD 4.44Å; V117-M161 HydrophobicContact CG1-CG 3.92Å; V117-M161 HydrophobicContact CG2-CG 4.46Å; M161-T163 PolarHBondContact O-N 2.93Å; M161-W164 HydrophobicContact CB-CB 4.32Å; M161-W164 HydrophobicContact CB-CG 4.1Å; M161-W164 HydrophobicContact CE-CD2 3.92Å; M161-W164 HydrophobicContact CE-CG 4.22Å; M161-W164 HydrophobicContact CE-CZ2 3.97Å; M161-W164 WeakPolarHBondContact O-CA 3.44Å; M161-W164 VanDerWaalsContact O-CB 3.28Å; M161-W164 WeakPolarHBondContact O-CB 3.16Å; M161-W164 PolarHBondContact O-N 3.22Å; M161-M177 HydrophobicContact CB-CE 4.03Å; M161-M177 HydrophobicContact CE-CE 3.81Å; M161-M177 HydrophobicContact CG-CE 4.41Å; M161-M177 HydrophobicContact SD-CE 3.69Å
162	T	90.4	Very high	95.7	Very high	43 Å²	43	36.5 Å²	36.5	26%	0.264	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-2	-157.5	91.3	0	0	0	0	117.2	V122 R157 I160	V122-T162 VanDerWaalsContact CG2-O 3.24Å; V122-T162 WeakPolarHBondContact CG2-O 3.49Å; R157-T162 PolarHBondContact NE-O 3.09Å; R157-T162 PolarHBondContact NH2-O 2.69Å; R157-T162 PolarHBondContact NH2-OG1 2.81Å; I160-T162 VanDerWaalsContact C-N 3.31Å; I160-T162 WeakPolarHBondContact O-CG2 3.35Å; I160-T162 PolarHBondContact O-N 3.36Å; I160-T162 VanDerWaalsContact O-N 3.11Å
163	T	93.3	Very high	95.6	Very high	24 Å²	24	38.4 Å²	38.4	15%	0.147	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-3.7	166.8	50	0	0	0	0	113.4	A120 V122 M161	A120-T163 HydrophobicContact CB-CG2 3.64Å; V122-T163 HydrophobicContact CG2-CG2 4.25Å; M161-T163 PolarHBondContact O-N 2.93Å
164	W	96.8	Very high	95.6	Very high	46 Å²	46	36.8 Å²	36.8	17%	0.174	19%	0.188	C	C	.	.			trans	-104.4	156	-179.9	-61.6	56.8	0	0	0	110.8	K89 A158 M161 M177 Y178 Q179	K89-W164 VanDerWaalsContact CE-CZ3 3.48Å; A158-W164 HydrophobicContact CB-CB 4.21Å; A158-W164 WeakPolarHBondContact CB-O 3.48Å; A158-W164 PolarHBondContact N-O 3.45Å; M161-W164 HydrophobicContact CB-CB 4.32Å; M161-W164 HydrophobicContact CB-CG 4.1Å; M161-W164 HydrophobicContact CE-CD2 3.92Å; M161-W164 HydrophobicContact CE-CG 4.22Å; M161-W164 HydrophobicContact CE-CZ2 3.97Å; M161-W164 WeakPolarHBondContact O-CA 3.44Å; M161-W164 VanDerWaalsContact O-CB 3.28Å; M161-W164 WeakPolarHBondContact O-CB 3.16Å; M161-W164 PolarHBondContact O-N 3.22Å; W164-M177 HydrophobicContact CB-CE 3.87Å; W164-M177 HydrophobicContact CB-CG 3.87Å; W164-M177 HydrophobicContact CB-SD 4.15Å; W164-M177 HydrophobicContact CD2-CE 3.75Å; W164-M177 HydrophobicContact CE3-CB 4.49Å; W164-M177 HydrophobicContact CE3-CE 3.62Å; W164-M177 HydrophobicContact CE3-CG 4.15Å; W164-M177 VanDerWaalsContact CE3-O 3.25Å; W164-M177 HydrophobicContact CG-CE 3.89Å; W164-M177 HydrophobicContact CZ3-CE 4.48Å; W164-M177 VanDerWaalsContact CZ3-O 3.23Å; W164-M177 WeakPolarHBondContact CZ3-O 3.47Å; W164-Y178 CarbonylContact C-O 3.51Å; W164-Y178 VanDerWaalsContact CA-O 3.26Å; W164-Y178 WeakPolarHBondContact CA-O 3.44Å; W164-Q179 HydrophobicContact CD2-CG 3.73Å; W164-Q179 VanDerWaalsContact CE2-CG 3.48Å; W164-Q179 VanDerWaalsContact CE2-OE1 3.28Å; W164-Q179 HydrophobicContact CE3-CG 4.41Å; W164-Q179 HydrophobicContact CG-CG 3.85Å; W164-Q179 HydrophobicContact CZ2-CG 3.98Å
165	F	98.3	Very high	95.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	142.4	-176.8	-61.6	-101	0	0	0	110.1	A128 V154 A156 R157 M177 Y178 L180 L181	A128-F165 HydrophobicContact CB-CE1 3.96Å; A128-F165 HydrophobicContact CB-CZ 3.67Å; V154-F165 HydrophobicContact CG1-CB 4.19Å; V154-F165 HydrophobicContact CG1-CD1 4.14Å; A156-F165 CarbonylContact O-C 3.59Å; A156-F165 WeakPolarHBondContact O-CA 3.22Å; R157-F165 HydrophobicContact CB-CD1 4.49Å; F165-M177 VanDerWaalsContact O-CA 3.25Å; F165-M177 WeakPolarHBondContact O-CA 3.41Å; F165-M177 WeakPolarHBondContact O-CG 3.04Å; F165-Y178 PolarHBondContact N-O 2.81Å; F165-Y178 PolarHBondContact O-N 2.81Å; F165-L180 HydrophobicContact CB-CB 4.42Å; F165-L180 HydrophobicContact CB-CD1 3.64Å; F165-L180 HydrophobicContact CB-CG 3.99Å; F165-L180 HydrophobicContact CD2-CB 3.83Å; F165-L180 HydrophobicContact CD2-CG 4.26Å; F165-L180 HydrophobicContact CE2-CB 4.42Å; F165-L180 HydrophobicContact CG-CB 4.23Å; F165-L180 HydrophobicContact CG-CD1 4.16Å; F165-L180 HydrophobicContact CG-CG 4.35Å; F165-L181 HydrophobicContact CE2-CD1 3.96Å; F165-L181 HydrophobicContact CE2-CG 3.73Å; F165-L181 HydrophobicContact CZ-CD1 3.91Å; F165-L181 HydrophobicContact CZ-CD2 4.46Å; F165-L181 HydrophobicContact CZ-CG 3.78Å
166	Y	98.6	Very high	95.7	Very high	13 Å²	13	38.2 Å²	38.2	5%	0.051	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	134.5	166.2	-69.7	-28.8	0	0	0	110.1	L76 V96 L155 A156 A158 L175 Y176 M177 F243	L76-Y166 HydrophobicContact CD1-CE1 3.96Å; V96-Y166 HydrophobicContact CG2-CD1 4.15Å; V96-Y166 HydrophobicContact CG2-CE1 3.84Å; L155-Y166 PolarHBondContact N-O 3.44Å; A156-Y166 HydrophobicContact CB-CD2 4.3Å; A156-Y166 PolarHBondContact O-N 2.84Å; A158-Y166 HydrophobicContact CB-CE1 4.24Å; Y166-L175 HydrophobicContact CD1-CD1 4.22Å; Y166-L175 HydrophobicContact CD1-CG 4.42Å; Y166-L175 HydrophobicContact CG-CD1 3.96Å; Y166-Y176 WeakPolarHBondContact CA-O 3.49Å; Y166-M177 HydrophobicContact CD1-CB 4.16Å; Y166-M177 HydrophobicContact CD1-CG 3.86Å; Y166-M177 HydrophobicContact CD1-SD 4.13Å; Y166-M177 HydrophobicContact CE1-CB 4.49Å; Y166-M177 HydrophobicContact CE1-CG 4.09Å; Y166-M177 HydrophobicContact CE1-SD 3.73Å; Y166-F243 HydrophobicContact CD2-CE2 4.33Å; Y166-F243 HydrophobicContact CD2-CZ 4.34Å
167	I	98.8	Very high	95.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	154.7	-178.4	177.6	165	0	0	0	109.4	V136 M153 V154 Y169 Y176 Y178 L180	V136-I167 HydrophobicContact CG2-CD1 3.67Å; M153-I167 WeakPolarHBondContact O-CA 3.29Å; M153-I167 WeakPolarHBondContact O-CG1 3.35Å; V154-I167 HydrophobicContact CG2-CD1 4.42Å; I167-Y169 HydrophobicContact CD1-CE1 3.68Å; I167-Y169 HydrophobicContact CG1-CE1 3.92Å; I167-Y176 PolarHBondContact N-O 3.31Å; I167-Y176 WeakPolarHBondContact O-CA 3.2Å; I167-Y176 WeakPolarHBondContact O-CB 3.48Å; I167-Y176 PolarHBondContact O-N 3.04Å; I167-Y178 HydrophobicContact CG2-CD2 3.74Å; I167-Y178 HydrophobicContact CG2-CE2 4.49Å; I167-L180 HydrophobicContact CB-CD1 4.26Å; I167-L180 HydrophobicContact CD1-CD1 4Å; I167-L180 HydrophobicContact CD1-CD2 4.14Å; I167-L180 HydrophobicContact CG2-CD1 4.44Å
168	T	98.8	Very high	95.8	Very high	15 Å²	15	33.8 Å²	33.8	9%	0.092	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	164.4	171	-163.8	0	0	0	0	110	G152 M153 L155 P173 V174 V254	G152-T168 CarbonylContact C-O 3.55Å; G152-T168 WeakPolarHBondContact CA-O 3.38Å; M153-T168 PolarHBondContact N-O 2.74Å; M153-T168 PolarHBondContact O-N 3.37Å; L155-T168 HydrophobicContact CD1-CG2 4.09Å; L155-T168 HydrophobicContact CD2-CG2 4.18Å; L155-T168 HydrophobicContact CG-CG2 4.49Å; T168-P173 WeakPolarHBondContact OG1-CA 3.31Å; T168-V174 VanDerWaalsContact CB-O 3.31Å; T168-V174 WeakPolarHBondContact CB-O 3.48Å; T168-V174 PolarHBondContact OG1-N 2.87Å; T168-V174 PolarHBondContact OG1-O 3.33Å; T168-V254 HydrophobicContact CG2-CB 3.92Å; T168-V254 HydrophobicContact CG2-CG1 3.8Å; T168-V254 HydrophobicContact CG2-CG2 4.41Å
169	Y	98.2	Very high	96	Very high	5 Å²	5	37 Å²	37	2%	0.02	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	149.6	-172.2	-55.5	-74.2	0	0	0	112.3	H138 F140 W150 R151 I167 K171 D172 Y176 Y178	H138-Y169 HydrophobicContact CB-CE1 3.98Å; H138-Y169 AromaticContact ND1-CZ 3.9Å; H138-Y169 PolarHBondContact ND1-OH 3.33Å; F140-Y169 HydrophobicContact CE2-CE1 4.36Å; F140-Y169 AromaticContact CZ-CZ 3.99Å; W150-Y169 HydrophobicContact CB-CD1 4.01Å; W150-Y169 HydrophobicContact CB-CE1 4.4Å; W150-Y169 HydrophobicContact CE3-CD1 4.38Å; W150-Y169 HydrophobicContact CE3-CD2 4.03Å; W150-Y169 AromaticContact CE3-CG 3.8Å; W150-Y169 HydrophobicContact CE3-CG 3.8Å; W150-Y169 HydrophobicContact CZ3-CD2 4.45Å; R151-Y169 WeakPolarHBondContact O-CA 3.25Å; I167-Y169 HydrophobicContact CD1-CE1 3.68Å; I167-Y169 HydrophobicContact CG1-CE1 3.92Å; Y169-K171 PolarHBondContact O-N 2.85Å; Y169-D172 PolarHBondContact N-O 2.8Å; Y169-D172 CarbonylContact O-C 3.51Å; Y169-D172 PolarHBondContact O-N 3.38Å; Y169-D172 VanDerWaalsContact O-O 3.06Å; Y169-Y176 AromaticContact CD2-CD2 3.72Å; Y169-Y176 HydrophobicContact CD2-CD2 3.72Å; Y169-Y176 AromaticContact CD2-CE2 3.94Å; Y169-Y176 HydrophobicContact CD2-CE2 3.94Å; Y169-Y176 HydrophobicContact CD2-CG 4.36Å; Y169-Y176 HydrophobicContact CE2-CD1 4.44Å; Y169-Y176 AromaticContact CE2-CD2 3.66Å; Y169-Y176 HydrophobicContact CE2-CD2 3.66Å; Y169-Y176 HydrophobicContact CE2-CE2 4.17Å; Y169-Y176 AromaticContact CE2-CG 3.82Å; Y169-Y176 HydrophobicContact CE2-CG 3.82Å; Y169-Y178 HydrophobicContact CE2-CE2 4.26Å; Y169-Y178 WeakPolarHBondContact OH-CE2 3.31Å
170	E	95.8	Very high	96.6	Very high	126 Å²	126	33.3 Å²	33.3	59%	0.589	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-27.7	-179.1	-61.5	-173.8	150.2	0	0	112.4	R151	R151-E170 VanDerWaalsContact CD-OE2 3.31Å; R151-E170 WeakPolarHBondContact CD-OE2 3.3Å; R151-E170 HydrophobicContact CG-CG 4.45Å; R151-E170 WeakPolarHBondContact CG-OE2 3.38Å; R151-E170 IonicContact CZ-OE1 2.84Å; R151-E170 IonicContact CZ-OE2 2.67Å; R151-E170 IonicContact NE-OE2 3.44Å; R151-E170 IonicContact NH1-OE1 3.22Å; R151-E170 PolarHBondContact NH1-OE1 3.28Å; R151-E170 IonicContact NH1-OE2 2.65Å; R151-E170 PolarHBondContact NH1-OE2 2.67Å; R151-E170 PolarHBondContact O-N 3.03Å
171	K	94.9	Very high	96.8	Very high	113 Å²	113	31.1 Å²	31.1	49%	0.491	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-26.2	175.4	-64.3	175.3	-173.8	164.5	0	113.5	E148 E149 W150 Y169	E148-K171 IonicContact OE1-NZ 3.89Å; E148-K171 PolarHBondContact OE1-NZ 3.43Å; E149-K171 PolarHBondContact O-NZ 3.21Å; W150-K171 HydrophobicContact CD2-CD 4.06Å; W150-K171 HydrophobicContact CE3-CB 4.31Å; W150-K171 HydrophobicContact CE3-CD 4.4Å; W150-K171 HydrophobicContact CG-CD 4.42Å; W150-K171 HydrophobicContact CH2-CB 4.47Å; W150-K171 HydrophobicContact CZ2-CD 4.37Å; W150-K171 HydrophobicContact CZ3-CB 4.15Å; Y169-K171 PolarHBondContact O-N 2.85Å
172	D	97.1	Very high	97	Very high	50 Å²	50	32.1 Å²	32.1	27%	0.267	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	96.7	-177.7	-167	-5.5	0	0	0	110.1	W150 Y169 V174 Y176	W150-D172 HydrophobicContact CZ3-CB 3.94Å; Y169-D172 PolarHBondContact N-O 2.8Å; Y169-D172 CarbonylContact O-C 3.51Å; Y169-D172 PolarHBondContact O-N 3.38Å; Y169-D172 VanDerWaalsContact O-O 3.06Å; D172-V174 PolarHBondContact O-N 2.97Å; D172-V174 WeakPolarHBondContact OD1-CG2 3.37Å; D172-Y176 PolarHBondContact OD2-OH 3.17Å
173	P	96.9	Very high	97.3	Very high	45 Å²	45	31.8 Å²	31.8	29%	0.292	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	44.8	-172.9	33.7	-36.6	0	0	0	112.7	T168 Y253 V254	T168-P173 WeakPolarHBondContact OG1-CA 3.31Å; P173-Y253 HydrophobicContact CG-CD1 4.49Å; P173-Y253 CarbonylContact O-C 3.54Å; P173-Y253 VanDerWaalsContact O-CA 3.3Å; P173-Y253 WeakPolarHBondContact O-CA 3.49Å; P173-V254 PolarHBondContact O-N 3.16Å
174	V	98.4	Very high	97.4	Very high	5 Å²	5	35.4 Å²	35.4	3%	0.03	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	152.5	173.7	168.5	0	0	0	0	109.9	C95 T168 D172 Y176 H251 I252 Y253	C95-V174 HydrophobicContact CB-CG1 4.29Å; T168-V174 VanDerWaalsContact CB-O 3.31Å; T168-V174 WeakPolarHBondContact CB-O 3.48Å; T168-V174 PolarHBondContact OG1-N 2.87Å; T168-V174 PolarHBondContact OG1-O 3.33Å; D172-V174 PolarHBondContact O-N 2.97Å; D172-V174 WeakPolarHBondContact OD1-CG2 3.37Å; V174-Y176 HydrophobicContact CB-CD2 4.49Å; V174-Y176 HydrophobicContact CB-CE2 4.01Å; V174-Y176 HydrophobicContact CG1-CE2 4.23Å; V174-Y176 WeakPolarHBondContact O-CD2 3.36Å; V174-Y176 PolarHBondContact O-N 3.26Å; V174-H251 HydrophobicContact CG1-CB 4.19Å; V174-H251 HydrophobicContact CG2-CB 4.2Å; V174-I252 CarbonylContact C-O 3.56Å; V174-I252 WeakPolarHBondContact CA-O 3.47Å; V174-Y253 HydrophobicContact CG2-CD1 4.04Å; V174-Y253 HydrophobicContact CG2-CE1 3.82Å
175	L	98.8	Very high	97.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	109.6	175.1	-174.4	62.9	0	0	0	110.3	V96 L155 Y166 F243 I252 V254	V96-L175 HydrophobicContact CB-CB 4.33Å; V96-L175 HydrophobicContact CB-CD2 3.87Å; V96-L175 HydrophobicContact CB-CG 3.95Å; V96-L175 HydrophobicContact CG1-CD2 4.01Å; V96-L175 HydrophobicContact CG2-CD2 4.18Å; V96-L175 HydrophobicContact CG2-CG 4Å; V96-L175 PolarHBondContact N-O 3.26Å; L155-L175 HydrophobicContact CD1-CD1 3.64Å; Y166-L175 HydrophobicContact CD1-CD1 4.22Å; Y166-L175 HydrophobicContact CD1-CG 4.42Å; Y166-L175 HydrophobicContact CG-CD1 3.96Å; L175-F243 HydrophobicContact CD1-CE1 4.02Å; L175-F243 HydrophobicContact CD1-CE2 4.12Å; L175-F243 HydrophobicContact CD1-CZ 3.71Å; L175-F243 HydrophobicContact CD2-CD2 4Å; L175-F243 HydrophobicContact CD2-CE2 3.8Å; L175-F243 HydrophobicContact CD2-CZ 4.26Å; L175-I252 HydrophobicContact CB-CB 3.88Å; L175-I252 HydrophobicContact CB-CG2 4.02Å; L175-I252 HydrophobicContact CD2-CB 4.05Å; L175-I252 HydrophobicContact CD2-CG1 4.47Å; L175-I252 HydrophobicContact CD2-CG2 3.84Å; L175-I252 PolarHBondContact N-O 3.4Å; L175-V254 HydrophobicContact CB-CG2 3.97Å; L175-V254 HydrophobicContact CD1-CG2 4.1Å
176	Y	98.7	Very high	97.2	Very high	32 Å²	32	46 Å²	46	13%	0.125	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	163.2	172.3	-75.1	-93	0	0	0	111.6	D94 C95 Y166 I167 Y169 D172 V174 Y178	D94-Y176 HydrophobicContact CB-CD1 4.18Å; D94-Y176 CarbonylContact O-C 3.57Å; D94-Y176 WeakPolarHBondContact O-CA 3.31Å; C95-Y176 WeakPolarHBondContact SG-CE1 3.26Å; Y166-Y176 WeakPolarHBondContact CA-O 3.49Å; I167-Y176 PolarHBondContact N-O 3.31Å; I167-Y176 WeakPolarHBondContact O-CA 3.2Å; I167-Y176 WeakPolarHBondContact O-CB 3.48Å; I167-Y176 PolarHBondContact O-N 3.04Å; Y169-Y176 AromaticContact CD2-CD2 3.72Å; Y169-Y176 HydrophobicContact CD2-CD2 3.72Å; Y169-Y176 AromaticContact CD2-CE2 3.94Å; Y169-Y176 HydrophobicContact CD2-CE2 3.94Å; Y169-Y176 HydrophobicContact CD2-CG 4.36Å; Y169-Y176 HydrophobicContact CE2-CD1 4.44Å; Y169-Y176 AromaticContact CE2-CD2 3.66Å; Y169-Y176 HydrophobicContact CE2-CD2 3.66Å; Y169-Y176 HydrophobicContact CE2-CE2 4.17Å; Y169-Y176 AromaticContact CE2-CG 3.82Å; Y169-Y176 HydrophobicContact CE2-CG 3.82Å; D172-Y176 PolarHBondContact OD2-OH 3.17Å; V174-Y176 HydrophobicContact CB-CD2 4.49Å; V174-Y176 HydrophobicContact CB-CE2 4.01Å; V174-Y176 HydrophobicContact CG1-CE2 4.23Å; V174-Y176 WeakPolarHBondContact O-CD2 3.36Å; V174-Y176 PolarHBondContact O-N 3.26Å; Y176-Y178 AromaticContact CD1-CE2 3.74Å; Y176-Y178 HydrophobicContact CD1-CE2 3.74Å; Y176-Y178 HydrophobicContact CG-CE2 4.01Å
177	M	97.8	Very high	97.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	120.1	174.3	-161	-176	82.8	0	0	111.7	L76 K89 D94 V96 A158 M161 W164 F165 Y166	L76-M177 HydrophobicContact CD1-SD 3.81Å; L76-M177 HydrophobicContact CD2-CE 4.36Å; L76-M177 HydrophobicContact CD2-SD 4.29Å; K89-M177 HydrophobicContact CB-CE 3.87Å; K89-M177 HydrophobicContact CD-CB 4.23Å; K89-M177 HydrophobicContact CD-CE 3.88Å; K89-M177 WeakPolarHBondContact CE-O 3.4Å; K89-M177 HydrophobicContact CG-CE 3.64Å; D94-M177 PolarHBondContact O-N 3.49Å; V96-M177 HydrophobicContact CG2-CB 3.86Å; A158-M177 HydrophobicContact CB-CG 4.2Å; A158-M177 HydrophobicContact CB-SD 3.52Å; A158-M177 VanDerWaalsContact CB-SD 3.52Å; M161-M177 HydrophobicContact CB-CE 4.03Å; M161-M177 HydrophobicContact CE-CE 3.81Å; M161-M177 HydrophobicContact CG-CE 4.41Å; M161-M177 HydrophobicContact SD-CE 3.69Å; W164-M177 HydrophobicContact CB-CE 3.87Å; W164-M177 HydrophobicContact CB-CG 3.87Å; W164-M177 HydrophobicContact CB-SD 4.15Å; W164-M177 HydrophobicContact CD2-CE 3.75Å; W164-M177 HydrophobicContact CE3-CB 4.49Å; W164-M177 HydrophobicContact CE3-CE 3.62Å; W164-M177 HydrophobicContact CE3-CG 4.15Å; W164-M177 VanDerWaalsContact CE3-O 3.25Å; W164-M177 HydrophobicContact CG-CE 3.89Å; W164-M177 HydrophobicContact CZ3-CE 4.48Å; W164-M177 VanDerWaalsContact CZ3-O 3.23Å; W164-M177 WeakPolarHBondContact CZ3-O 3.47Å; F165-M177 VanDerWaalsContact O-CA 3.25Å; F165-M177 WeakPolarHBondContact O-CA 3.41Å; F165-M177 WeakPolarHBondContact O-CG 3.04Å; Y166-M177 HydrophobicContact CD1-CB 4.16Å; Y166-M177 HydrophobicContact CD1-CG 3.86Å; Y166-M177 HydrophobicContact CD1-SD 4.13Å; Y166-M177 HydrophobicContact CE1-CB 4.49Å; Y166-M177 HydrophobicContact CE1-CG 4.09Å; Y166-M177 HydrophobicContact CE1-SD 3.73Å
178	Y	97.9	Very high	97	Very high	36 Å²	36	49.1 Å²	49.1	14%	0.141	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	166.8	-175.7	-71	-81.8	0	0	0	112.6	D94 F140 W164 F165 I167 Y169 Y176 L180	D94-Y178 HydrophobicContact CB-CD1 4.41Å; D94-Y178 HydrophobicContact CB-CE1 3.64Å; D94-Y178 HydrophobicContact CB-CE2 4.15Å; D94-Y178 VanDerWaalsContact CB-CZ 3.49Å; D94-Y178 WeakPolarHBondContact CB-OH 3.45Å; F140-Y178 HydrophobicContact CE1-CE1 4.19Å; F140-Y178 AromaticContact CE1-CZ 3.95Å; F140-Y178 HydrophobicContact CZ-CE2 4.34Å; W164-Y178 CarbonylContact C-O 3.51Å; W164-Y178 VanDerWaalsContact CA-O 3.26Å; W164-Y178 WeakPolarHBondContact CA-O 3.44Å; F165-Y178 PolarHBondContact N-O 2.81Å; F165-Y178 PolarHBondContact O-N 2.81Å; I167-Y178 HydrophobicContact CG2-CD2 3.74Å; I167-Y178 HydrophobicContact CG2-CE2 4.49Å; Y169-Y178 HydrophobicContact CE2-CE2 4.26Å; Y169-Y178 WeakPolarHBondContact OH-CE2 3.31Å; Y176-Y178 AromaticContact CD1-CE2 3.74Å; Y176-Y178 HydrophobicContact CD1-CE2 3.74Å; Y176-Y178 HydrophobicContact CG-CE2 4.01Å; Y178-L180 VanDerWaalsContact C-N 3.32Å; Y178-L180 PolarHBondContact O-N 2.82Å
179	Q	96.6	Very high	97	Very high	68 Å²	68	48.7 Å²	48.7	32%	0.318	24%	0.24	S	C	.	.			trans	-90.2	57.8	174.9	-75.2	-171.9	-150.6	0	0	112	W164 L181 D182 D183	W164-Q179 HydrophobicContact CD2-CG 3.73Å; W164-Q179 VanDerWaalsContact CE2-CG 3.48Å; W164-Q179 VanDerWaalsContact CE2-OE1 3.28Å; W164-Q179 HydrophobicContact CE3-CG 4.41Å; W164-Q179 HydrophobicContact CG-CG 3.85Å; W164-Q179 HydrophobicContact CZ2-CG 3.98Å; Q179-L181 PolarHBondContact O-N 2.84Å; Q179-D182 PolarHBondContact NE2-OD2 3.19Å; Q179-D182 WeakPolarHBondContact O-CB 3.43Å; Q179-D182 PolarHBondContact O-N 3.4Å; Q179-D183 VanDerWaalsContact C-OD2 3.27Å
180	L	97.7	Very high	96.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-51.1	-22.5	-168.7	-61.4	-175.8	0	0	0	116.9	M131 V154 F165 I167 Y178 D182 D183 Y184 L189	M131-L180 HydrophobicContact CE-CB 3.59Å; V154-L180 HydrophobicContact CB-CD1 4.41Å; V154-L180 HydrophobicContact CG1-CD1 4.02Å; V154-L180 HydrophobicContact CG2-CD1 3.59Å; F165-L180 HydrophobicContact CB-CB 4.42Å; F165-L180 HydrophobicContact CB-CD1 3.64Å; F165-L180 HydrophobicContact CB-CG 3.99Å; F165-L180 HydrophobicContact CD2-CB 3.83Å; F165-L180 HydrophobicContact CD2-CG 4.26Å; F165-L180 HydrophobicContact CE2-CB 4.42Å; F165-L180 HydrophobicContact CG-CB 4.23Å; F165-L180 HydrophobicContact CG-CD1 4.16Å; F165-L180 HydrophobicContact CG-CG 4.35Å; I167-L180 HydrophobicContact CB-CD1 4.26Å; I167-L180 HydrophobicContact CD1-CD1 4Å; I167-L180 HydrophobicContact CD1-CD2 4.14Å; I167-L180 HydrophobicContact CG2-CD1 4.44Å; Y178-L180 VanDerWaalsContact C-N 3.32Å; Y178-L180 PolarHBondContact O-N 2.82Å; L180-D182 VanDerWaalsContact C-N 3.31Å; L180-D183 WeakPolarHBondContact CA-OD2 3.3Å; L180-D183 PolarHBondContact N-OD2 2.82Å; L180-Y184 VanDerWaalsContact O-CB 3.28Å; L180-Y184 WeakPolarHBondContact O-CB 3.43Å; L180-Y184 PolarHBondContact O-N 2.95Å; L180-L189 HydrophobicContact CB-CD2 3.68Å; L180-L189 HydrophobicContact CD1-CD2 4.38Å; L180-L189 HydrophobicContact CD2-CD1 4.27Å; L180-L189 HydrophobicContact CD2-CD2 3.94Å; L180-L189 HydrophobicContact CG-CD2 4.2Å; L180-L189 WeakPolarHBondContact O-CD2 3.31Å
181	L	96.6	Very high	97	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-69.9	-26.5	173	-73.8	170.4	0	0	0	113.7	V122 L127 A128 M131 F165 Q179 K185	V122-L181 HydrophobicContact CG1-CD1 3.74Å; L127-L181 HydrophobicContact CB-CD2 4.03Å; L127-L181 HydrophobicContact CD2-CD2 3.69Å; L127-L181 HydrophobicContact CG-CD2 3.71Å; A128-L181 HydrophobicContact CB-CD1 4.18Å; A128-L181 HydrophobicContact CB-CD2 4.36Å; M131-L181 HydrophobicContact SD-CD2 3.89Å; F165-L181 HydrophobicContact CE2-CD1 3.96Å; F165-L181 HydrophobicContact CE2-CG 3.73Å; F165-L181 HydrophobicContact CZ-CD1 3.91Å; F165-L181 HydrophobicContact CZ-CD2 4.46Å; F165-L181 HydrophobicContact CZ-CG 3.78Å; Q179-L181 PolarHBondContact O-N 2.84Å; L181-K185 WeakPolarHBondContact O-CD 3.46Å; L181-K185 WeakPolarHBondContact O-CE 3.2Å; L181-K185 WeakPolarHBondContact O-CG 3.17Å; L181-K185 PolarHBondContact O-NZ 2.86Å
182	D	95.9	Very high	97	Very high	49 Å²	49	47.5 Å²	47.5	26%	0.262	23%	0.233	S	C	.	.	H	α-helix	trans	-86.5	-45.3	179.5	-57.2	-37.7	0	0	0	108.7	Q179 L180 Y184 K185 E186	Q179-D182 PolarHBondContact NE2-OD2 3.19Å; Q179-D182 WeakPolarHBondContact O-CB 3.43Å; Q179-D182 PolarHBondContact O-N 3.4Å; L180-D182 VanDerWaalsContact C-N 3.31Å; D182-Y184 PolarHBondContact O-N 2.82Å; D182-K185 WeakPolarHBondContact O-CB 3.4Å; D182-K185 PolarHBondContact O-N 2.85Å; D182-K185 IonicContact OD1-NZ 3.76Å; D182-K185 PolarHBondContact OD1-NZ 2.93Å; D182-E186 PolarHBondContact O-N 3.44Å
183	D	96.9	Very high	96.6	Very high	36 Å²	36	50.2 Å²	50.2	19%	0.193	25%	0.253	C	S	.	.	H	α-helix	trans	-52.2	-41	170.1	-47	-41.2	0	0	0	111.9	H138 Q179 L180 G187 D188 L189	H138-D183 IonicContact CE1-OD2 2.74Å; H138-D183 IonicContact NE2-OD2 2.72Å; Q179-D183 VanDerWaalsContact C-OD2 3.27Å; L180-D183 WeakPolarHBondContact CA-OD2 3.3Å; L180-D183 PolarHBondContact N-OD2 2.82Å; D183-G187 PolarHBondContact O-N 2.82Å; D183-D188 PolarHBondContact O-N 2.82Å; D183-L189 HydrophobicContact CB-CB 4.07Å; D183-L189 PolarHBondContact O-N 3.01Å
184	Y	96.5	Very high	95.6	Very high	100 Å²	100	52.3 Å²	52.3	39%	0.392	26%	0.262	S	S	.	.	H	α-helix	trans	-65.7	-36.1	174.4	-178.4	-90.6	0	0	0	113.9	L127 L180 D182 G187 L189 I191	L127-Y184 HydrophobicContact CD1-CE1 4.24Å; L127-Y184 HydrophobicContact CD2-CD1 3.57Å; L127-Y184 HydrophobicContact CD2-CE1 3.7Å; L127-Y184 HydrophobicContact CD2-CG 4.25Å; L180-Y184 VanDerWaalsContact O-CB 3.28Å; L180-Y184 WeakPolarHBondContact O-CB 3.43Å; L180-Y184 PolarHBondContact O-N 2.95Å; D182-Y184 PolarHBondContact O-N 2.82Å; Y184-G187 PolarHBondContact O-N 2.72Å; Y184-L189 WeakPolarHBondContact CD2-O 3.17Å; Y184-I191 HydrophobicContact CD2-CD1 4.2Å; Y184-I191 HydrophobicContact CD2-CG1 4.21Å; Y184-I191 HydrophobicContact CE2-CD1 3.81Å; Y184-I191 HydrophobicContact CE2-CG1 4.01Å
185	K	95.9	Very high	93.7	Very high	113 Å²	113	57.7 Å²	57.7	49%	0.491	30%	0.3	S	S	.	.	H	α-helix	trans	-74.1	-34	179	-67.6	158.9	-160.3	151.5	0	112	S123 L181 D182 G187	S123-K185 PolarHBondContact OG-NZ 3.27Å; L181-K185 WeakPolarHBondContact O-CD 3.46Å; L181-K185 WeakPolarHBondContact O-CE 3.2Å; L181-K185 WeakPolarHBondContact O-CG 3.17Å; L181-K185 PolarHBondContact O-NZ 2.86Å; D182-K185 WeakPolarHBondContact O-CB 3.4Å; D182-K185 PolarHBondContact O-N 2.85Å; D182-K185 IonicContact OD1-NZ 3.76Å; D182-K185 PolarHBondContact OD1-NZ 2.93Å; K185-G187 PolarHBondContact O-N 3.42Å
186	E	95.4	Very high	91.5	Very high	156 Å²	156	62.4 Å²	62.4	73%	0.729	33%	0.325	S	S	*	.	H	α-helix	trans	-77.3	-11.9	177.4	-64.9	-174.6	-167.6	0	0	111.9	D182	D182-E186 PolarHBondContact O-N 3.44Å
187	G	95.6	Very high	88.9	Confident	46 Å²	46	69.3 Å²	69.3	47%	0.474	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	9.1	176.5	0	0	0	0	0	114	M139 D183 Y184 K185	M139-G187 WeakPolarHBondContact CE-O 3.45Å; D183-G187 PolarHBondContact O-N 2.82Å; Y184-G187 PolarHBondContact O-N 2.72Å; K185-G187 PolarHBondContact O-N 3.42Å
188	D	96.8	Very high	86.3	Confident	32 Å²	32	76.5 Å²	76.5	17%	0.171	40%	0.397	C	S	.	.			trans	-90	-0.6	-178.2	-81.5	-10.3	0	0	0	113.6	H138 M139 K147 D183	H138-D188 PolarHBondContact CD2-O 2.86Å; M139-D188 HydrophobicContact CB-CB 4.44Å; M139-D188 PolarHBondContact N-O 2.82Å; K147-D188 WeakPolarHBondContact CD-OD1 3.37Å; K147-D188 IonicContact NZ-OD1 2.62Å; K147-D188 PolarHBondContact NZ-OD1 2.9Å; K147-D188 IonicContact NZ-OD2 2.66Å; K147-D188 PolarHBondContact NZ-OD2 2.99Å; D183-D188 PolarHBondContact O-N 2.82Å
189	L	97.9	Very high	83.8	Confident	6 Å²	6	78.5 Å²	78.5	3%	0.031	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	116.3	174.8	-171.6	76	0	0	0	111.9	M131 V136 E137 H138 L180 D183 Y184	M131-L189 HydrophobicContact CE-CD2 3.38Å; V136-L189 HydrophobicContact CB-CD1 3.98Å; V136-L189 HydrophobicContact CG1-CD1 4.45Å; V136-L189 HydrophobicContact CG2-CD1 4.11Å; E137-L189 WeakPolarHBondContact O-CA 3.26Å; H138-L189 HydrophobicContact CB-CD1 3.71Å; L180-L189 HydrophobicContact CB-CD2 3.68Å; L180-L189 HydrophobicContact CD1-CD2 4.38Å; L180-L189 HydrophobicContact CD2-CD1 4.27Å; L180-L189 HydrophobicContact CD2-CD2 3.94Å; L180-L189 HydrophobicContact CG-CD2 4.2Å; L180-L189 WeakPolarHBondContact O-CD2 3.31Å; D183-L189 HydrophobicContact CB-CB 4.07Å; D183-L189 PolarHBondContact O-N 3.01Å; Y184-L189 WeakPolarHBondContact CD2-O 3.17Å
190	R	97.3	Very high	81.2	Confident	125 Å²	125	80 Å²	80	47%	0.472	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	123.2	174	-179.1	162.4	68.5	-150.6	-2.6	110.6	V136 E137 E149 M192	V136-R190 CarbonylContact C-O 2.96Å; V136-R190 VanDerWaalsContact CA-O 3.23Å; V136-R190 WeakPolarHBondContact CA-O 3.42Å; V136-R190 WeakPolarHBondContact CB-O 3.47Å; E137-R190 HydrophobicContact CB-CB 4.45Å; E137-R190 PolarHBondContact N-O 2.82Å; E137-R190 PolarHBondContact O-N 2.59Å; E137-R190 IonicContact OE1-NH2 3.73Å; E137-R190 IonicContact OE2-CZ 3.98Å; E137-R190 IonicContact OE2-NE 3.45Å; E137-R190 PolarHBondContact OE2-NE 2.98Å; E137-R190 IonicContact OE2-NH2 2.71Å; E137-R190 PolarHBondContact OE2-NH2 2.83Å; E149-R190 IonicContact OE2-CZ 3.87Å; E149-R190 IonicContact OE2-NH2 2.61Å; E149-R190 PolarHBondContact OE2-NH2 3.4Å; R190-M192 HydrophobicContact CG-SD 4.41Å
191	I	97.1	Very high	78.5	Confident	44 Å²	44	84 Å²	84	23%	0.226	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	127.5	168.2	-54.5	172.6	0	0	0	108.2	L127 M131 K134 Y184	L127-I191 HydrophobicContact CD1-CD1 3.98Å; M131-I191 HydrophobicContact CG-CD1 3.59Å; M131-I191 HydrophobicContact CG-CG1 4.31Å; K134-I191 HydrophobicContact CB-CG2 3.93Å; K134-I191 HydrophobicContact CG-CG2 4Å; Y184-I191 HydrophobicContact CD2-CD1 4.2Å; Y184-I191 HydrophobicContact CD2-CG1 4.21Å; Y184-I191 HydrophobicContact CE2-CD1 3.81Å; Y184-I191 HydrophobicContact CE2-CG1 4.01Å
192	M	94.8	Very high	76.1	Confident	50 Å²	50	91.9 Å²	91.9	25%	0.246	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-83.9	144.4	178.8	-66.1	-61	-93.6	0	0	111.5	A135 E137 R190	A135-M192 HydrophobicContact CB-CB 4.14Å; A135-M192 WeakPolarHBondContact O-CB 3.42Å; A135-M192 PolarHBondContact O-N 2.72Å; E137-M192 HydrophobicContact CG-CG 4.44Å; E137-M192 HydrophobicContact CG-SD 4.34Å; E137-M192 WeakPolarHBondContact OE1-CE 3.1Å; R190-M192 HydrophobicContact CG-SD 4.41Å
193	P	88.6	Confident	74	Confident	108 Å²	108	98 Å²	98	70%	0.701	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-62.7	138.5	172.1	28	-34.4	0	0	0	110	S195	P193-S195 PolarHBondContact O-N 3.46Å
194	D	75.6	Confident	71.7	Confident	89 Å²	89	104 Å²	104	48%	0.476	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-62	119	177.8	-60	-88.5	0	0	0	110.2	K134 N196	K134-D194 WeakPolarHBondContact CD-OD1 3.32Å; K134-D194 IonicContact NZ-OD1 2.81Å; K134-D194 PolarHBondContact NZ-OD1 2.95Å; K134-D194 IonicContact NZ-OD2 3.63Å; K134-D194 PolarHBondContact NZ-OD2 3.24Å; D194-N196 PolarHBondContact O-N 2.81Å
195	S	60.2	Low	69	Low	118 Å²	118	105.7 Å²	105.7	83%	0.825	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	3	172.5	-43.7	0	0	0	0	113.4	P193	P193-S195 PolarHBondContact O-N 3.46Å
196	N	51.3	Low	67	Low	98 Å²	98	103.4 Å²	103.4	52%	0.524	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-140.9	22.2	-146.7	-122	33.2	0	0	0	115.4	D194 N198 V199	D194-N196 PolarHBondContact O-N 2.81Å; N196-N198 PolarHBondContact O-N 2.67Å; N196-V199 VanDerWaalsContact CG-CG2 3.48Å; N196-V199 WeakPolarHBondContact ND2-CG2 3.43Å; N196-V199 PolarHBondContact O-N 2.79Å; N196-V199 VanDerWaalsContact OD1-CG2 3.26Å; N196-V199 WeakPolarHBondContact OD1-CG2 3.43Å
197	E	45.2	Very low	65	Low	177 Å²	177	101.6 Å²	101.6	83%	0.827	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-54	-25.6	171.3	-71.6	-161.5	123.4	0	0	112.7
198	N	41.4	Very low	63.1	Low	151 Å²	151	105.3 Å²	105.3	81%	0.807	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-75.5	-16.5	176.3	-83.3	-14.1	0	0	0	115.6	N196 A200	N196-N198 PolarHBondContact O-N 2.67Å; N198-A200 VanDerWaalsContact C-N 3.33Å
199	V	46.3	Very low	61.5	Low	78 Å²	78	106.7 Å²	106.7	47%	0.473	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-90.1	0.5	-173.4	-178.1	0	0	0	0	112.8	N196 A201	N196-V199 VanDerWaalsContact CG-CG2 3.48Å; N196-V199 WeakPolarHBondContact ND2-CG2 3.43Å; N196-V199 PolarHBondContact O-N 2.79Å; N196-V199 VanDerWaalsContact OD1-CG2 3.26Å; N196-V199 WeakPolarHBondContact OD1-CG2 3.43Å; V199-A201 PolarHBondContact O-N 3.38Å; V199-A201 VanDerWaalsContact O-N 3.16Å
200	A	43.2	Very low	60.7	Low	100 Å²	100	112 Å²	112	83%	0.826	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-64.3	-9.9	165.2	0	0	0	0	0	113.7	N198	N198-A200 VanDerWaalsContact C-N 3.33Å
201	A	40.5	Very low	60.2	Low	83 Å²	83	108.4 Å²	108.4	69%	0.686	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-99.3	-16.9	-174.1	0	0	0	0	0	115.6	V199 R203	V199-A201 PolarHBondContact O-N 3.38Å; V199-A201 VanDerWaalsContact O-N 3.16Å; A201-R203 PolarHBondContact O-N 3.44Å
202	E	45.3	Very low	60	Low	170 Å²	170	108.8 Å²	108.8	79%	0.794	62%	0.623	S	S	*	*			trans	-104.3	54.1	-173.9	-66.3	-165.6	154.6	0	0	113.3
203	R	52.4	Low	60.1	Low	179 Å²	179	108.8 Å²	108.8	68%	0.675	63%	0.626	S	S	*	*			trans	-125.5	108.5	156.2	-84.6	-173.4	172.3	162	-0.6	110	A201	A201-R203 PolarHBondContact O-N 3.44Å
204	E	48.4	Very low	60.4	Low	160 Å²	160	105.3 Å²	105.3	75%	0.748	61%	0.61	S	S	*	*			trans	-48.3	125.5	160.6	-80.9	-72.4	122.9	0	0	108.8	G206 E207	E204-G206 PolarHBondContact O-N 3.08Å; E204-E207 PolarHBondContact O-N 3.3Å
205	P	39.6	Very low	61.4	Low	136 Å²	136	105.4 Å²	105.4	88%	0.883	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	73.2	-175.2	29.3	-35.1	0	0	0	111.3
206	G	54.2	Low	63.1	Low	65 Å²	65	105.7 Å²	105.7	67%	0.67	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	167.3	-15.1	-175.1	0	0	0	0	0	115.5	E204 V208	E204-G206 PolarHBondContact O-N 3.08Å; G206-V208 PolarHBondContact O-N 3.25Å
207	E	54.1	Low	65.1	Low	118 Å²	118	102.9 Å²	102.9	55%	0.551	58%	0.58	S	S	*	*			trans	-73.6	96	179.3	-163.1	-169.5	169.1	0	0	111.9	E204 V209 K259	E204-E207 PolarHBondContact O-N 3.3Å; E207-V209 HydrophobicContact CG-CG2 4.24Å; E207-V209 PolarHBondContact O-N 2.65Å; E207-K259 IonicContact OE1-NZ 3.26Å; E207-K259 PolarHBondContact OE1-NZ 3.38Å
208	V	55.6	Low	67.3	Low	124 Å²	124	100.7 Å²	100.7	75%	0.752	57%	0.57	S	S	*	*			trans	-77.4	98	165	-177.2	0	0	0	0	108.6	G206 D210	G206-V208 PolarHBondContact O-N 3.25Å; V208-D210 PolarHBondContact O-N 2.91Å; V208-D210 VanDerWaalsContact O-N 3.1Å
209	V	63.3	Low	69.3	Low	61 Å²	61	98.9 Å²	98.9	37%	0.37	55%	0.553	S	S	.	*			trans	-71.3	102.3	167.6	-179.3	0	0	0	0	108.5	E207 S211	E207-V209 HydrophobicContact CG-CG2 4.24Å; E207-V209 PolarHBondContact O-N 2.65Å; V209-S211 PolarHBondContact O-N 3.01Å; V209-S211 VanDerWaalsContact O-N 3.14Å
210	D	79.7	Confident	71.1	Confident	119 Å²	119	98.6 Å²	98.6	64%	0.636	56%	0.558	S	S	*	*			trans	-47.1	118.2	174.1	-87.7	-16.7	0	0	0	111.4	V208 L212	V208-D210 PolarHBondContact O-N 2.91Å; V208-D210 VanDerWaalsContact O-N 3.1Å; D210-L212 PolarHBondContact O-N 2.9Å
211	S	87.2	Confident	73	Confident	48 Å²	48	97.1 Å²	97.1	34%	0.336	53%	0.533	S	S	.	.			trans	-54.4	140.9	178	-170.5	0	0	0	0	111.1	V209 V213 K215 Q234	V209-S211 PolarHBondContact O-N 3.01Å; V209-S211 VanDerWaalsContact O-N 3.14Å; S211-V213 VanDerWaalsContact C-N 3.31Å; S211-V213 WeakPolarHBondContact OG-CG2 3.5Å; S211-V213 PolarHBondContact OG-N 2.95Å; S211-K215 PolarHBondContact O-NZ 3.43Å; S211-Q234 VanDerWaalsContact CB-OE1 3.26Å; S211-Q234 PolarHBondContact OG-OE1 3.47Å
212	L	93.7	Very high	74.8	Confident	52 Å²	52	102.8 Å²	102.8	27%	0.272	55%	0.546	S	S	.	.			trans	-84.2	-6.4	175.2	-56	-177.9	0	0	0	113	D210 G214 K215 V231 Y242 L257	D210-L212 PolarHBondContact O-N 2.9Å; L212-G214 PolarHBondContact O-N 2.92Å; L212-K215 HydrophobicContact CB-CD 4.46Å; L212-K215 HydrophobicContact CD2-CD 3.96Å; L212-K215 WeakPolarHBondContact O-CB 3.35Å; L212-K215 WeakPolarHBondContact O-CG 3.33Å; L212-K215 PolarHBondContact O-N 2.87Å; L212-V231 HydrophobicContact CB-CG1 4.26Å; L212-V231 HydrophobicContact CB-CG2 4.27Å; L212-V231 WeakPolarHBondContact O-CB 3.48Å; L212-Y242 HydrophobicContact CB-CD1 4.23Å; L212-Y242 HydrophobicContact CB-CE1 3.72Å; L212-Y242 HydrophobicContact CB-CE2 4.45Å; L212-Y242 HydrophobicContact CD1-CD2 4.48Å; L212-Y242 HydrophobicContact CD1-CE2 3.96Å; L212-Y242 HydrophobicContact CG-CE1 4.22Å; L212-Y242 HydrophobicContact CG-CE2 4.22Å; L212-Y242 PolarHBondContact N-OH 3.44Å; L212-L257 HydrophobicContact CD1-CB 3.95Å; L212-L257 HydrophobicContact CD1-CD1 3.71Å
213	V	96.3	Very high	76.6	Confident	51 Å²	51	101.1 Å²	101.1	31%	0.309	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	132	-178	174.6	0	0	0	0	111.8	V81 S211 K215 V231 Q234 Y242	V81-V213 HydrophobicContact CG1-CG1 3.69Å; V81-V213 HydrophobicContact CG2-CG1 4.47Å; S211-V213 VanDerWaalsContact C-N 3.31Å; S211-V213 WeakPolarHBondContact OG-CG2 3.5Å; S211-V213 PolarHBondContact OG-N 2.95Å; V213-K215 VanDerWaalsContact C-N 3.3Å; V213-V231 HydrophobicContact CG2-CG1 4.18Å; V213-Q234 HydrophobicContact CG2-CB 3.85Å; V213-Y242 HydrophobicContact CG2-CD1 4.34Å; V213-Y242 HydrophobicContact CG2-CE1 4.4Å
214	G	96.1	Very high	77.8	Confident	35 Å²	35	95.9 Å²	95.9	36%	0.361	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	84	-8.5	-174.4	0	0	0	0	0	114.9	L212 V231	L212-G214 PolarHBondContact O-N 2.92Å; G214-V231 PolarHBondContact N-O 2.74Å
215	K	95.9	Very high	79.5	Confident	91 Å²	91	89.6 Å²	89.6	40%	0.396	52%	0.522	S	S	.	.			trans	-78.8	142.5	175.2	-59.9	176.5	-174.6	151.6	0	110.5	S211 L212 V213 V231	S211-K215 PolarHBondContact O-NZ 3.43Å; L212-K215 HydrophobicContact CB-CD 4.46Å; L212-K215 HydrophobicContact CD2-CD 3.96Å; L212-K215 WeakPolarHBondContact O-CB 3.35Å; L212-K215 WeakPolarHBondContact O-CG 3.33Å; L212-K215 PolarHBondContact O-N 2.87Å; V213-K215 VanDerWaalsContact C-N 3.3Å; K215-V231 PolarHBondContact O-N 2.81Å
216	Q	95.5	Very high	81.9	Confident	124 Å²	124	89.8 Å²	89.8	58%	0.579	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	146.9	169.3	-68.2	-70.9	-49.2	0	0	109.9	G229	Q216-G229 CarbonylContact C-O 3.46Å; Q216-G229 WeakPolarHBondContact CA-O 3.36Å; Q216-G229 PolarHBondContact OE1-O 3.05Å
217	V	93.3	Very high	83.7	Confident	38 Å²	38	88 Å²	88	23%	0.23	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	144.3	178.4	-70.5	0	0	0	0	110.4	S228 G229 V231 I244 F246	V217-S228 WeakPolarHBondContact O-CA 3.32Å; V217-G229 WeakPolarHBondContact CG2-O 3.42Å; V217-G229 PolarHBondContact N-O 2.85Å; V217-G229 PolarHBondContact O-N 3.31Å; V217-V231 HydrophobicContact CG1-CG2 3.8Å; V217-I244 HydrophobicContact CG2-CD1 4.39Å; V217-I244 HydrophobicContact CG2-CG2 3.75Å; V217-F246 HydrophobicContact CG2-CE1 4.48Å
218	E	91.7	Very high	85.7	Confident	132 Å²	132	85.1 Å²	85.1	62%	0.617	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	128.5	167.8	-68.3	-172.2	141.9	0	0	109.2	K226 R227	E218-K226 IonicContact OE1-NZ 3.4Å; E218-K226 PolarHBondContact OE1-NZ 3.27Å; E218-K226 IonicContact OE2-NZ 2.83Å; E218-K226 PolarHBondContact OE2-NZ 2.97Å; E218-R227 CarbonylContact C-O 3.59Å; E218-R227 WeakPolarHBondContact CA-O 3.21Å
219	Y	83.4	Confident	87.6	Confident	112 Å²	112	79.2 Å²	79.2	44%	0.439	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130.4	169	179.8	-94.2	0	0	0	109.9	K221 K226 R227	Y219-K221 HydrophobicContact CD1-CG 4.35Å; Y219-K226 CarbonylContact O-C 3.55Å; Y219-K226 WeakPolarHBondContact O-CA 3.37Å; Y219-R227 PolarHBondContact N-O 2.72Å; Y219-R227 PolarHBondContact O-N 2.64Å
220	A	84.8	Confident	89.3	Confident	72 Å²	72	77.6 Å²	77.6	60%	0.595	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	116.8	173	0	0	0	0	0	109.5
221	K	81.6	Confident	90.1	Very high	69 Å²	69	72 Å²	72	30%	0.3	40%	0.398	S	S	.	.			trans	-75.2	151.9	173.2	-62.4	-176.9	-173.4	-175.2	0	109.2	Y219 D223 G224 G225 D248	Y219-K221 HydrophobicContact CD1-CG 4.35Å; K221-D223 WeakPolarHBondContact CB-OD1 3.32Å; K221-D223 PolarHBondContact O-N 2.87Å; K221-D223 VanDerWaalsContact O-N 3.16Å; K221-G224 PolarHBondContact O-N 2.99Å; K221-G225 PolarHBondContact N-O 2.92Å; K221-D248 IonicContact NZ-OD2 3.44Å; K221-D248 PolarHBondContact NZ-OD2 3.31Å
222	E	80.1	Confident	90.6	Very high	203 Å²	203	70 Å²	70	95%	0.949	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.4	-177.7	-60.6	-175	153.6	0	0	113.7	G224	E222-G224 PolarHBondContact O-N 3.03Å
223	D	82.1	Confident	90.8	Very high	134 Å²	134	71 Å²	71	72%	0.717	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	1.8	173.6	64.7	3.1	0	0	0	113.9	K221 G225	K221-D223 WeakPolarHBondContact CB-OD1 3.32Å; K221-D223 PolarHBondContact O-N 2.87Å; K221-D223 VanDerWaalsContact O-N 3.16Å; D223-G225 VanDerWaalsContact C-N 3.27Å; D223-G225 WeakPolarHBondContact OD1-CA 3.23Å; D223-G225 PolarHBondContact OD1-N 2.82Å
224	G	78.4	Confident	90.9	Very high	70 Å²	70	70.8 Å²	70.8	72%	0.722	38%	0.382	S	S	*	.	S	Bend	trans	82	-0.3	-174.6	0	0	0	0	0	114.1	K221 E222	K221-G224 PolarHBondContact O-N 2.99Å; E222-G224 PolarHBondContact O-N 3.03Å
225	G	83.9	Confident	90.8	Very high	28 Å²	28	69.3 Å²	69.3	29%	0.289	37%	0.366	S	S	.	.			trans	-69.9	162.3	172.1	0	0	0	0	0	112.7	K221 D223	K221-G225 PolarHBondContact N-O 2.92Å; D223-G225 VanDerWaalsContact C-N 3.27Å; D223-G225 WeakPolarHBondContact OD1-CA 3.23Å; D223-G225 PolarHBondContact OD1-N 2.82Å
226	K	89.5	Confident	90.7	Very high	139 Å²	139	73.5 Å²	73.5	60%	0.604	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.9	147.1	170.1	-72.9	-170.4	172.3	-166.6	0	110.9	E218 Y219	E218-K226 IonicContact OE1-NZ 3.4Å; E218-K226 PolarHBondContact OE1-NZ 3.27Å; E218-K226 IonicContact OE2-NZ 2.83Å; E218-K226 PolarHBondContact OE2-NZ 2.97Å; Y219-K226 CarbonylContact O-C 3.55Å; Y219-K226 WeakPolarHBondContact O-CA 3.37Å
227	R	92.6	Very high	90.6	Very high	29 Å²	29	70 Å²	70	11%	0.109	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	113.2	172.3	-156.1	-179	-167.3	-175.5	1.7	108.9	E218 Y219 F246 D248 D249 Y253	E218-R227 CarbonylContact C-O 3.59Å; E218-R227 WeakPolarHBondContact CA-O 3.21Å; Y219-R227 PolarHBondContact N-O 2.72Å; Y219-R227 PolarHBondContact O-N 2.64Å; R227-F246 HydrophobicContact CB-CD1 4.21Å; R227-F246 HydrophobicContact CB-CE1 4.37Å; R227-F246 VanDerWaalsContact CD-CG 3.44Å; R227-F246 HydrophobicContact CG-CB 3.99Å; R227-F246 HydrophobicContact CG-CD1 3.64Å; R227-F246 HydrophobicContact CG-CD2 4.48Å; R227-F246 HydrophobicContact CG-CE1 4.2Å; R227-F246 HydrophobicContact CG-CG 3.81Å; R227-F246 VanDerWaalsContact CZ-CD2 3.45Å; R227-D248 IonicContact CZ-OD1 3.35Å; R227-D248 VanDerWaalsContact CZ-OD1 3.22Å; R227-D248 IonicContact NE-OD1 3.62Å; R227-D248 PolarHBondContact NE-OD1 2.85Å; R227-D248 IonicContact NE-OD2 3.19Å; R227-D248 PolarHBondContact NE-OD2 2.89Å; R227-D248 IonicContact NH2-OD1 2.7Å; R227-D248 PolarHBondContact NH2-OD1 3.19Å; R227-D249 IonicContact CZ-OD2 3.7Å; R227-D249 IonicContact NH2-OD2 2.81Å; R227-D249 PolarHBondContact NH2-OD2 3.1Å; R227-Y253 VanDerWaalsContact NH1-CE2 3.29Å; R227-Y253 PolarHBondContact NH1-OH 2.72Å
228	S	95.2	Very high	90.6	Very high	56 Å²	56	71.3 Å²	71.3	39%	0.392	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	149.7	172.2	53.1	0	0	0	0	111.1	V217 F246 D247	V217-S228 WeakPolarHBondContact O-CA 3.32Å; S228-F246 WeakPolarHBondContact O-CA 3.35Å; S228-F246 WeakPolarHBondContact O-CD1 3.39Å; S228-D247 WeakPolarHBondContact CB-OD2 3.44Å; S228-D247 PolarHBondContact O-N 2.83Å; S228-D247 PolarHBondContact OG-OD2 2.84Å
229	G	96.2	Very high	90.6	Very high	0 Å²	0	67 Å²	67	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.8	-177.1	178.1	0	0	0	0	0	112.7	Q216 V217 K245	Q216-G229 CarbonylContact C-O 3.46Å; Q216-G229 WeakPolarHBondContact CA-O 3.36Å; Q216-G229 PolarHBondContact OE1-O 3.05Å; V217-G229 WeakPolarHBondContact CG2-O 3.42Å; V217-G229 PolarHBondContact N-O 2.85Å; V217-G229 PolarHBondContact O-N 3.31Å; G229-K245 CarbonylContact C-O 3.59Å; G229-K245 WeakPolarHBondContact CA-O 3.17Å
230	M	97.5	Very high	91	Very high	28 Å²	28	63.3 Å²	63.3	14%	0.138	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	139.4	-175.4	178.5	162.9	46.1	0	0	111.4	V81 N82 I232 I244 K245	V81-M230 HydrophobicContact CG2-SD 4.17Å; N82-M230 HydrophobicContact CB-CE 3.71Å; M230-I232 HydrophobicContact CG-CG2 4.33Å; M230-I232 PolarHBondContact O-N 2.66Å; M230-I244 WeakPolarHBondContact O-CA 3.37Å; M230-K245 PolarHBondContact N-O 2.89Å; M230-K245 PolarHBondContact O-N 3.16Å
231	V	97.9	Very high	91.5	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.006	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	116.6	168.7	-176	0	0	0	0	108.6	L212 V213 G214 K215 V217 Y242 I244 L257	L212-V231 HydrophobicContact CB-CG1 4.26Å; L212-V231 HydrophobicContact CB-CG2 4.27Å; L212-V231 WeakPolarHBondContact O-CB 3.48Å; V213-V231 HydrophobicContact CG2-CG1 4.18Å; G214-V231 PolarHBondContact N-O 2.74Å; K215-V231 PolarHBondContact O-N 2.81Å; V217-V231 HydrophobicContact CG1-CG2 3.8Å; V231-Y242 HydrophobicContact CG1-CD1 3.45Å; V231-Y242 VanDerWaalsContact CG1-CD1 3.45Å; V231-Y242 HydrophobicContact CG1-CE1 4.29Å; V231-Y242 HydrophobicContact CG1-CG 3.96Å; V231-I244 HydrophobicContact CG2-CG1 4.47Å; V231-L257 HydrophobicContact CG2-CD1 4.43Å
232	I	98.1	Very high	92.2	Very high	6 Å²	6	57.2 Å²	57.2	3%	0.031	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-22	-172.5	58.9	162.7	0	0	0	114.4	V79 V81 L85 L87 M230 F243 K245 I252	V79-I232 HydrophobicContact CG1-CB 3.71Å; V79-I232 HydrophobicContact CG1-CG2 3.86Å; V79-I232 HydrophobicContact CG2-CB 4.5Å; V79-I232 HydrophobicContact CG2-CD1 4.18Å; V81-I232 HydrophobicContact CG2-CG2 4.37Å; L85-I232 HydrophobicContact CD2-CG2 4.12Å; L87-I232 HydrophobicContact CD2-CD1 4.22Å; M230-I232 HydrophobicContact CG-CG2 4.33Å; M230-I232 PolarHBondContact O-N 2.66Å; I232-F243 HydrophobicContact CD1-CB 4.29Å; I232-F243 HydrophobicContact CG1-CB 3.81Å; I232-F243 WeakPolarHBondContact CG1-O 3.08Å; I232-F243 PolarHBondContact N-O 2.82Å; I232-K245 HydrophobicContact CD1-CB 4.33Å; I232-K245 HydrophobicContact CG2-CB 4Å; I232-I252 HydrophobicContact CD1-CD1 3.74Å; I232-I252 HydrophobicContact CD1-CG1 4.42Å; I232-I252 HydrophobicContact CD1-CG2 4.12Å
233	H	97.8	Very high	93.1	Very high	72 Å²	72	47.7 Å²	47.7	33%	0.333	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	157.5	-178.5	-170.9	80.3	0	0	0	110.6	Y242 F243	H233-Y242 WeakPolarHBondContact O-CA 3.4Å; H233-Y242 WeakPolarHBondContact O-CD1 3.5Å; H233-F243 HydrophobicContact CB-CB 3.96Å; H233-F243 HydrophobicContact CB-CD2 3.66Å; H233-F243 HydrophobicContact CB-CE2 4.39Å; H233-F243 HydrophobicContact CB-CG 3.99Å; H233-F243 AromaticContact CD2-CD2 3.78Å; H233-F243 AromaticContact CD2-CE2 3.65Å; H233-F243 AromaticContact CG-CD2 3.99Å; H233-F243 PolarHBondContact O-N 3.13Å
234	Q	96.8	Very high	93.9	Very high	47 Å²	47	41.6 Å²	41.6	22%	0.22	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	130.3	175.8	-178.5	176.3	12.7	0	0	108.1	S211 V213 E236 P239 Y242	S211-Q234 VanDerWaalsContact CB-OE1 3.26Å; S211-Q234 PolarHBondContact OG-OE1 3.47Å; V213-Q234 HydrophobicContact CG2-CB 3.85Å; Q234-E236 PolarHBondContact O-N 2.83Å; Q234-P239 PolarHBondContact NE2-O 2.9Å; Q234-Y242 HydrophobicContact CB-CD1 3.69Å; Q234-Y242 HydrophobicContact CB-CE1 3.58Å; Q234-Y242 HydrophobicContact CG-CD1 3.89Å; Q234-Y242 HydrophobicContact CG-CE1 3.45Å; Q234-Y242 VanDerWaalsContact CG-CE1 3.45Å; Q234-Y242 PolarHBondContact NE2-OH 3.14Å; Q234-Y242 VanDerWaalsContact NE2-OH 3.13Å
235	V	95.6	Very high	94.8	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.024	21%	0.212	C	C	.	.			trans	-77	114.7	-173.4	179.6	0	0	0	0	110	L155 A237 K238 P239 V241 F243	L155-V235 HydrophobicContact CB-CG1 4.3Å; L155-V235 HydrophobicContact CD2-CG2 4.33Å; L155-V235 VanDerWaalsContact O-CG1 3.31Å; L155-V235 WeakPolarHBondContact O-CG1 3.44Å; V235-A237 VanDerWaalsContact C-N 3.28Å; V235-A237 HydrophobicContact CG1-CB 4.46Å; V235-A237 PolarHBondContact O-N 2.58Å; V235-K238 CarbonylContact O-C 3.59Å; V235-K238 PolarHBondContact O-N 2.92Å; V235-K238 VanDerWaalsContact O-N 3.08Å; V235-P239 WeakPolarHBondContact O-CA 3.37Å; V235-V241 HydrophobicContact CB-CB 4.25Å; V235-V241 HydrophobicContact CB-CG1 4.41Å; V235-V241 HydrophobicContact CG2-CB 4.17Å; V235-V241 HydrophobicContact CG2-CG1 3.81Å; V235-V241 PolarHBondContact N-O 2.65Å; V235-F243 HydrophobicContact CG2-CD1 4.07Å; V235-F243 HydrophobicContact CG2-CE1 3.45Å; V235-F243 VanDerWaalsContact CG2-CE1 3.45Å; V235-F243 HydrophobicContact CG2-CZ 4.07Å
236	E	94	Very high	95.5	Very high	179 Å²	179	38.5 Å²	38.5	84%	0.836	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-42.6	-176.2	-61.5	-176.2	162.5	0	0	112.7	Q234 K238	Q234-E236 PolarHBondContact O-N 2.83Å; E236-K238 VanDerWaalsContact C-N 3.33Å; E236-K238 PolarHBondContact O-N 2.8Å
237	A	92.4	Very high	95.7	Very high	51 Å²	51	36.5 Å²	36.5	42%	0.421	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-21.1	-178.8	0	0	0	0	0	114.3	I132 V235	I132-A237 HydrophobicContact CG2-CB 3.53Å; V235-A237 VanDerWaalsContact C-N 3.28Å; V235-A237 HydrophobicContact CG1-CB 4.46Å; V235-A237 PolarHBondContact O-N 2.58Å
238	K	93.1	Very high	95.8	Very high	65 Å²	65	39.4 Å²	39.4	28%	0.283	21%	0.212	S	C	.	.	S	Bend	trans	-145.2	83.9	174.9	-169.4	176.9	170	-164.2	0	109.8	M153 V235 E236 S240 V241 D256	M153-K238 HydrophobicContact CE-CD 3.88Å; M153-K238 HydrophobicContact SD-CD 3.67Å; V235-K238 CarbonylContact O-C 3.59Å; V235-K238 PolarHBondContact O-N 2.92Å; V235-K238 VanDerWaalsContact O-N 3.08Å; E236-K238 VanDerWaalsContact C-N 3.33Å; E236-K238 PolarHBondContact O-N 2.8Å; K238-S240 PolarHBondContact O-N 2.62Å; K238-V241 HydrophobicContact CB-CG2 4.35Å; K238-V241 HydrophobicContact CD-CG2 3.68Å; K238-V241 HydrophobicContact CG-CG2 3.98Å; K238-V241 WeakPolarHBondContact O-CB 3.4Å; K238-V241 PolarHBondContact O-N 2.67Å; K238-D256 VanDerWaalsContact CE-OD2 3.25Å; K238-D256 WeakPolarHBondContact CE-OD2 3.41Å; K238-D256 IonicContact NZ-OD2 3.95Å; K238-D256 PolarHBondContact NZ-OD2 3.47Å
239	P	91.7	Very high	95.8	Very high	41 Å²	41	37.9 Å²	37.9	27%	0.266	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-4	-169.3	-27.5	36.9	0	0	0	117.2	Q234 V235	Q234-P239 PolarHBondContact NE2-O 2.9Å; V235-P239 WeakPolarHBondContact O-CA 3.37Å
240	S	91.6	Very high	95.8	Very high	36 Å²	36	40.7 Å²	40.7	25%	0.252	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-18.2	167.9	65.3	0	0	0	0	112.7	K238 Y242 D256 L257	K238-S240 PolarHBondContact O-N 2.62Å; S240-Y242 WeakPolarHBondContact O-CD2 3.13Å; S240-Y242 WeakPolarHBondContact O-CE2 3.25Å; S240-D256 WeakPolarHBondContact CB-OD1 3.14Å; S240-D256 PolarHBondContact OG-OD1 2.81Å; S240-L257 PolarHBondContact O-N 3.43Å
241	V	95.4	Very high	95.9	Very high	8 Å²	8	41.3 Å²	41.3	5%	0.048	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	134.8	178.9	178.4	0	0	0	0	110.9	L155 V235 K238 V254 Y255 D256	L155-V241 HydrophobicContact CD2-CG1 4.24Å; V235-V241 HydrophobicContact CB-CB 4.25Å; V235-V241 HydrophobicContact CB-CG1 4.41Å; V235-V241 HydrophobicContact CG2-CB 4.17Å; V235-V241 HydrophobicContact CG2-CG1 3.81Å; V235-V241 PolarHBondContact N-O 2.65Å; K238-V241 HydrophobicContact CB-CG2 4.35Å; K238-V241 HydrophobicContact CD-CG2 3.68Å; K238-V241 HydrophobicContact CG-CG2 3.98Å; K238-V241 WeakPolarHBondContact O-CB 3.4Å; K238-V241 PolarHBondContact O-N 2.67Å; V241-V254 HydrophobicContact CG1-CG1 3.38Å; V241-Y255 CarbonylContact C-O 3.59Å; V241-Y255 WeakPolarHBondContact CA-O 3.42Å; V241-D256 HydrophobicContact CG2-CB 4.05Å
242	Y	97.4	Very high	95.9	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.016	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	151.7	-175.9	-68.1	-92	0	0	0	111.7	L212 V213 V231 H233 Q234 S240 V254 Y255 L257	L212-Y242 HydrophobicContact CB-CD1 4.23Å; L212-Y242 HydrophobicContact CB-CE1 3.72Å; L212-Y242 HydrophobicContact CB-CE2 4.45Å; L212-Y242 HydrophobicContact CD1-CD2 4.48Å; L212-Y242 HydrophobicContact CD1-CE2 3.96Å; L212-Y242 HydrophobicContact CG-CE1 4.22Å; L212-Y242 HydrophobicContact CG-CE2 4.22Å; L212-Y242 PolarHBondContact N-OH 3.44Å; V213-Y242 HydrophobicContact CG2-CD1 4.34Å; V213-Y242 HydrophobicContact CG2-CE1 4.4Å; V231-Y242 HydrophobicContact CG1-CD1 3.45Å; V231-Y242 VanDerWaalsContact CG1-CD1 3.45Å; V231-Y242 HydrophobicContact CG1-CE1 4.29Å; V231-Y242 HydrophobicContact CG1-CG 3.96Å; H233-Y242 WeakPolarHBondContact O-CA 3.4Å; H233-Y242 WeakPolarHBondContact O-CD1 3.5Å; Q234-Y242 HydrophobicContact CB-CD1 3.69Å; Q234-Y242 HydrophobicContact CB-CE1 3.58Å; Q234-Y242 HydrophobicContact CG-CD1 3.89Å; Q234-Y242 HydrophobicContact CG-CE1 3.45Å; Q234-Y242 VanDerWaalsContact CG-CE1 3.45Å; Q234-Y242 PolarHBondContact NE2-OH 3.14Å; Q234-Y242 VanDerWaalsContact NE2-OH 3.13Å; S240-Y242 WeakPolarHBondContact O-CD2 3.13Å; S240-Y242 WeakPolarHBondContact O-CE2 3.25Å; Y242-V254 WeakPolarHBondContact O-CA 3.47Å; Y242-Y255 PolarHBondContact N-O 3.16Å; Y242-Y255 PolarHBondContact O-N 3.48Å; Y242-L257 HydrophobicContact CD2-CB 3.78Å; Y242-L257 HydrophobicContact CD2-CD1 3.72Å; Y242-L257 HydrophobicContact CD2-CG 3.87Å; Y242-L257 HydrophobicContact CE2-CB 4.04Å; Y242-L257 HydrophobicContact CE2-CD1 4.41Å; Y242-L257 HydrophobicContact CG-CD1 4.04Å
243	F	98.3	Very high	95.9	Very high	3 Å²	3	42.6 Å²	42.6	1%	0.013	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.2	168.2	-59.8	-8.1	0	0	0	109.7	L155 Y166 L175 I232 H233 V235 I252 Y253 V254	L155-F243 HydrophobicContact CB-CZ 4.49Å; L155-F243 HydrophobicContact CD1-CE1 3.94Å; L155-F243 HydrophobicContact CD1-CZ 4.3Å; Y166-F243 HydrophobicContact CD2-CE2 4.33Å; Y166-F243 HydrophobicContact CD2-CZ 4.34Å; L175-F243 HydrophobicContact CD1-CE1 4.02Å; L175-F243 HydrophobicContact CD1-CE2 4.12Å; L175-F243 HydrophobicContact CD1-CZ 3.71Å; L175-F243 HydrophobicContact CD2-CD2 4Å; L175-F243 HydrophobicContact CD2-CE2 3.8Å; L175-F243 HydrophobicContact CD2-CZ 4.26Å; I232-F243 HydrophobicContact CD1-CB 4.29Å; I232-F243 HydrophobicContact CG1-CB 3.81Å; I232-F243 WeakPolarHBondContact CG1-O 3.08Å; I232-F243 PolarHBondContact N-O 2.82Å; H233-F243 HydrophobicContact CB-CB 3.96Å; H233-F243 HydrophobicContact CB-CD2 3.66Å; H233-F243 HydrophobicContact CB-CE2 4.39Å; H233-F243 HydrophobicContact CB-CG 3.99Å; H233-F243 AromaticContact CD2-CD2 3.78Å; H233-F243 AromaticContact CD2-CE2 3.65Å; H233-F243 AromaticContact CG-CD2 3.99Å; H233-F243 PolarHBondContact O-N 3.13Å; V235-F243 HydrophobicContact CG2-CD1 4.07Å; V235-F243 HydrophobicContact CG2-CE1 3.45Å; V235-F243 VanDerWaalsContact CG2-CE1 3.45Å; V235-F243 HydrophobicContact CG2-CZ 4.07Å; F243-I252 HydrophobicContact CB-CG2 3.77Å; F243-I252 HydrophobicContact CD2-CG2 4.38Å; F243-I252 HydrophobicContact CG-CG2 4.15Å; F243-Y253 CarbonylContact C-O 3.6Å; F243-Y253 VanDerWaalsContact CA-O 3.26Å; F243-Y253 WeakPolarHBondContact CA-O 3.26Å; F243-V254 HydrophobicContact CD1-CB 4.48Å; F243-V254 HydrophobicContact CD1-CG1 4.15Å; F243-V254 HydrophobicContact CD1-CG2 3.87Å; F243-V254 HydrophobicContact CE1-CG1 4.2Å; F243-V254 HydrophobicContact CE1-CG2 4.05Å
244	I	98.2	Very high	95.9	Very high	6 Å²	6	39.6 Å²	39.6	3%	0.031	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	129.7	-178.8	-53.2	-173.9	0	0	0	109.3	V217 M230 V231 F246 Y253 Y255 L257	V217-I244 HydrophobicContact CG2-CD1 4.39Å; V217-I244 HydrophobicContact CG2-CG2 3.75Å; M230-I244 WeakPolarHBondContact O-CA 3.37Å; V231-I244 HydrophobicContact CG2-CG1 4.47Å; I244-F246 HydrophobicContact CG2-CD1 4.23Å; I244-F246 HydrophobicContact CG2-CE1 3.97Å; I244-F246 HydrophobicContact CG2-CE2 4.29Å; I244-F246 HydrophobicContact CG2-CZ 4.01Å; I244-Y253 PolarHBondContact N-O 2.95Å; I244-Y253 PolarHBondContact O-N 3.28Å; I244-Y255 HydrophobicContact CB-CD2 4.48Å; I244-Y255 HydrophobicContact CD1-CD2 3.68Å; I244-Y255 HydrophobicContact CD1-CE2 4.5Å; I244-Y255 HydrophobicContact CD1-CG 4.22Å; I244-Y255 HydrophobicContact CG1-CD2 4.22Å; I244-L257 HydrophobicContact CD1-CD1 4.24Å
245	K	98.4	Very high	95.8	Very high	30 Å²	30	40.2 Å²	40.2	13%	0.13	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	113.4	167.9	174	62.4	173.4	65.1	0	108.1	L85 G98 G229 M230 I232 D249 I252	L85-K245 HydrophobicContact CD1-CG 4.45Å; L85-K245 HydrophobicContact CD2-CB 4.14Å; L85-K245 HydrophobicContact CD2-CG 3.88Å; G98-K245 WeakPolarHBondContact O-CE 3.45Å; G229-K245 CarbonylContact C-O 3.59Å; G229-K245 WeakPolarHBondContact CA-O 3.17Å; M230-K245 PolarHBondContact N-O 2.89Å; M230-K245 PolarHBondContact O-N 3.16Å; I232-K245 HydrophobicContact CD1-CB 4.33Å; I232-K245 HydrophobicContact CG2-CB 4Å; K245-D249 WeakPolarHBondContact CE-O 3.31Å; K245-D249 PolarHBondContact NZ-O 2.96Å; K245-I252 HydrophobicContact CB-CD1 4.23Å; K245-I252 HydrophobicContact CD-CD1 4.01Å
246	F	97.3	Very high	95.7	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.018	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	154.4	170	-64.4	-69.1	0	0	0	111.3	V217 R227 S228 I244 Y253 Y255	V217-F246 HydrophobicContact CG2-CE1 4.48Å; R227-F246 HydrophobicContact CB-CD1 4.21Å; R227-F246 HydrophobicContact CB-CE1 4.37Å; R227-F246 VanDerWaalsContact CD-CG 3.44Å; R227-F246 HydrophobicContact CG-CB 3.99Å; R227-F246 HydrophobicContact CG-CD1 3.64Å; R227-F246 HydrophobicContact CG-CD2 4.48Å; R227-F246 HydrophobicContact CG-CE1 4.2Å; R227-F246 HydrophobicContact CG-CG 3.81Å; R227-F246 VanDerWaalsContact CZ-CD2 3.45Å; S228-F246 WeakPolarHBondContact O-CA 3.35Å; S228-F246 WeakPolarHBondContact O-CD1 3.39Å; I244-F246 HydrophobicContact CG2-CD1 4.23Å; I244-F246 HydrophobicContact CG2-CE1 3.97Å; I244-F246 HydrophobicContact CG2-CE2 4.29Å; I244-F246 HydrophobicContact CG2-CZ 4.01Å; F246-Y253 AromaticContact CD2-CD2 3.49Å; F246-Y253 HydrophobicContact CD2-CD2 3.49Å; F246-Y253 VanDerWaalsContact CD2-CD2 3.49Å; F246-Y253 AromaticContact CD2-CE2 3.79Å; F246-Y253 HydrophobicContact CD2-CE2 3.79Å; F246-Y253 HydrophobicContact CD2-CG 4.08Å; F246-Y253 AromaticContact CE2-CD2 3.82Å; F246-Y253 HydrophobicContact CE2-CD2 3.82Å; F246-Y253 HydrophobicContact CE2-CE2 4.3Å; F246-Y253 AromaticContact CE2-CG 3.91Å; F246-Y253 HydrophobicContact CE2-CG 3.91Å; F246-Y255 AromaticContact CE2-CE2 3.9Å; F246-Y255 HydrophobicContact CE2-CE2 3.9Å; F246-Y255 HydrophobicContact CZ-CE2 4.05Å
247	D	95.3	Very high	95.4	Very high	96 Å²	96	37.6 Å²	37.6	51%	0.513	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-28.8	-172.4	-56.2	-37.6	0	0	0	113.1	S228 D249	S228-D247 WeakPolarHBondContact CB-OD2 3.44Å; S228-D247 PolarHBondContact O-N 2.83Å; S228-D247 PolarHBondContact OG-OD2 2.84Å; D247-D249 VanDerWaalsContact C-N 3.3Å; D247-D249 PolarHBondContact O-N 3.21Å
248	D	93.5	Very high	94.7	Very high	90 Å²	90	40 Å²	40	48%	0.481	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	2.4	-174.4	65.7	-4.8	0	0	0	114.9	K221 R227	K221-D248 IonicContact NZ-OD2 3.44Å; K221-D248 PolarHBondContact NZ-OD2 3.31Å; R227-D248 IonicContact CZ-OD1 3.35Å; R227-D248 VanDerWaalsContact CZ-OD1 3.22Å; R227-D248 IonicContact NE-OD1 3.62Å; R227-D248 PolarHBondContact NE-OD1 2.85Å; R227-D248 IonicContact NE-OD2 3.19Å; R227-D248 PolarHBondContact NE-OD2 2.89Å; R227-D248 IonicContact NH2-OD1 2.7Å; R227-D248 PolarHBondContact NH2-OD1 3.19Å
249	D	95.5	Very high	93.3	Very high	24 Å²	24	43.4 Å²	43.4	13%	0.128	22%	0.222	C	C	.	.			trans	-149.7	166	-164.9	-166.6	-10.4	0	0	0	112	R227 K245 D247 H251 Y253	R227-D249 IonicContact CZ-OD2 3.7Å; R227-D249 IonicContact NH2-OD2 2.81Å; R227-D249 PolarHBondContact NH2-OD2 3.1Å; K245-D249 WeakPolarHBondContact CE-O 3.31Å; K245-D249 PolarHBondContact NZ-O 2.96Å; D247-D249 VanDerWaalsContact C-N 3.3Å; D247-D249 PolarHBondContact O-N 3.21Å; D249-H251 IonicContact OD1-CE1 3.76Å; D249-H251 IonicContact OD1-CG 2.83Å; D249-H251 PolarHBondContact OD1-N 3.06Å; D249-H251 VanDerWaalsContact OD1-N 3.09Å; D249-H251 IonicContact OD1-ND1 2.65Å; D249-H251 PolarHBondContact OD1-ND1 3.18Å; D249-H251 IonicContact OD2-ND1 2.89Å; D249-H251 PolarHBondContact OD2-ND1 2.97Å; D249-Y253 WeakPolarHBondContact OD2-CE2 3.41Å; D249-Y253 PolarHBondContact OD2-OH 3Å
250	F	96.6	Very high	91.6	Very high	60 Å²	60	48.1 Å²	48.1	26%	0.263	25%	0.25	S	C	.	.	S	Bend	trans	-108.5	-9.6	176.8	42.8	-112.5	0	0	0	113.6	W62 Y97 G98 L99	W62-F250 HydrophobicContact CH2-CD1 4.24Å; W62-F250 HydrophobicContact CZ2-CD1 4.03Å; W62-F250 HydrophobicContact CZ2-CE1 4.21Å; Y97-F250 CarbonylContact C-O 3.03Å; Y97-F250 WeakPolarHBondContact CA-O 3.42Å; Y97-F250 HydrophobicContact CD1-CB 4.44Å; Y97-F250 AromaticContact CD1-CD2 3.55Å; Y97-F250 HydrophobicContact CD1-CD2 3.55Å; Y97-F250 HydrophobicContact CD1-CE2 4.18Å; Y97-F250 HydrophobicContact CD1-CG 4.27Å; Y97-F250 AromaticContact CE1-CD2 3.64Å; Y97-F250 HydrophobicContact CE1-CD2 3.64Å; Y97-F250 AromaticContact CE1-CE2 3.79Å; Y97-F250 HydrophobicContact CE1-CE2 3.79Å; G98-F250 PolarHBondContact N-O 2.89Å; L99-F250 HydrophobicContact CD2-CB 3.65Å
251	H	98.4	Very high	89.3	Confident	41 Å²	41	55.3 Å²	55.3	19%	0.19	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-70.3	150	172.7	-60	100.9	0	0	0	112.2	V174 D249 Y253	V174-H251 HydrophobicContact CG1-CB 4.19Å; V174-H251 HydrophobicContact CG2-CB 4.2Å; D249-H251 IonicContact OD1-CE1 3.76Å; D249-H251 IonicContact OD1-CG 2.83Å; D249-H251 PolarHBondContact OD1-N 3.06Å; D249-H251 VanDerWaalsContact OD1-N 3.09Å; D249-H251 IonicContact OD1-ND1 2.65Å; D249-H251 PolarHBondContact OD1-ND1 3.18Å; D249-H251 IonicContact OD2-ND1 2.89Å; D249-H251 PolarHBondContact OD2-ND1 2.97Å; H251-Y253 HydrophobicContact CB-CD2 4.44Å; H251-Y253 HydrophobicContact CB-CE2 4.01Å
252	I	98.6	Very high	89	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-93.3	126.6	161.9	-55.9	-49.6	0	0	0	108.1	L87 V174 L175 I232 F243 K245	L87-I252 HydrophobicContact CD2-CD1 3.73Å; L87-I252 HydrophobicContact CD2-CG1 3.75Å; V174-I252 CarbonylContact C-O 3.56Å; V174-I252 WeakPolarHBondContact CA-O 3.47Å; L175-I252 HydrophobicContact CB-CB 3.88Å; L175-I252 HydrophobicContact CB-CG2 4.02Å; L175-I252 HydrophobicContact CD2-CB 4.05Å; L175-I252 HydrophobicContact CD2-CG1 4.47Å; L175-I252 HydrophobicContact CD2-CG2 3.84Å; L175-I252 PolarHBondContact N-O 3.4Å; I232-I252 HydrophobicContact CD1-CD1 3.74Å; I232-I252 HydrophobicContact CD1-CG1 4.42Å; I232-I252 HydrophobicContact CD1-CG2 4.12Å; F243-I252 HydrophobicContact CB-CG2 3.77Å; F243-I252 HydrophobicContact CD2-CG2 4.38Å; F243-I252 HydrophobicContact CG-CG2 4.15Å; K245-I252 HydrophobicContact CB-CD1 4.23Å; K245-I252 HydrophobicContact CD-CD1 4.01Å
253	Y	98.1	Very high	88.5	Confident	33 Å²	33	60.5 Å²	60.5	13%	0.129	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	155.1	175.9	-72.9	-93.5	0	0	0	111.5	P173 V174 R227 F243 I244 F246 D249 H251 Y255	P173-Y253 HydrophobicContact CG-CD1 4.49Å; P173-Y253 CarbonylContact O-C 3.54Å; P173-Y253 VanDerWaalsContact O-CA 3.3Å; P173-Y253 WeakPolarHBondContact O-CA 3.49Å; V174-Y253 HydrophobicContact CG2-CD1 4.04Å; V174-Y253 HydrophobicContact CG2-CE1 3.82Å; R227-Y253 VanDerWaalsContact NH1-CE2 3.29Å; R227-Y253 PolarHBondContact NH1-OH 2.72Å; F243-Y253 CarbonylContact C-O 3.6Å; F243-Y253 VanDerWaalsContact CA-O 3.26Å; F243-Y253 WeakPolarHBondContact CA-O 3.26Å; I244-Y253 PolarHBondContact N-O 2.95Å; I244-Y253 PolarHBondContact O-N 3.28Å; F246-Y253 AromaticContact CD2-CD2 3.49Å; F246-Y253 HydrophobicContact CD2-CD2 3.49Å; F246-Y253 VanDerWaalsContact CD2-CD2 3.49Å; F246-Y253 AromaticContact CD2-CE2 3.79Å; F246-Y253 HydrophobicContact CD2-CE2 3.79Å; F246-Y253 HydrophobicContact CD2-CG 4.08Å; F246-Y253 AromaticContact CE2-CD2 3.82Å; F246-Y253 HydrophobicContact CE2-CD2 3.82Å; F246-Y253 HydrophobicContact CE2-CE2 4.3Å; F246-Y253 AromaticContact CE2-CG 3.91Å; F246-Y253 HydrophobicContact CE2-CG 3.91Å; D249-Y253 WeakPolarHBondContact OD2-CE2 3.41Å; D249-Y253 PolarHBondContact OD2-OH 3Å; H251-Y253 HydrophobicContact CB-CD2 4.44Å; H251-Y253 HydrophobicContact CB-CE2 4.01Å; Y253-Y255 HydrophobicContact CD1-CE2 4.18Å; Y253-Y255 HydrophobicContact CG-CE2 4.14Å
254	V	98	Very high	88	Confident	9 Å²	9	63.7 Å²	63.7	6%	0.055	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	116	-178.5	-172.4	0	0	0	0	109	L155 T168 P173 L175 V241 Y242 F243	L155-V254 HydrophobicContact CD1-CG1 4.02Å; L155-V254 HydrophobicContact CD1-CG2 4.01Å; L155-V254 HydrophobicContact CD2-CG1 3.96Å; T168-V254 HydrophobicContact CG2-CB 3.92Å; T168-V254 HydrophobicContact CG2-CG1 3.8Å; T168-V254 HydrophobicContact CG2-CG2 4.41Å; P173-V254 PolarHBondContact O-N 3.16Å; L175-V254 HydrophobicContact CB-CG2 3.97Å; L175-V254 HydrophobicContact CD1-CG2 4.1Å; V241-V254 HydrophobicContact CG1-CG1 3.38Å; Y242-V254 WeakPolarHBondContact O-CA 3.47Å; F243-V254 HydrophobicContact CD1-CB 4.48Å; F243-V254 HydrophobicContact CD1-CG1 4.15Å; F243-V254 HydrophobicContact CD1-CG2 3.87Å; F243-V254 HydrophobicContact CE1-CG1 4.2Å; F243-V254 HydrophobicContact CE1-CG2 4.05Å
255	Y	94.8	Very high	87.4	Confident	60 Å²	60	67.1 Å²	67.1	24%	0.235	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	141.8	-175.8	-76.2	-82.8	0	0	0	112	V241 Y242 I244 F246 Y253	V241-Y255 CarbonylContact C-O 3.59Å; V241-Y255 WeakPolarHBondContact CA-O 3.42Å; Y242-Y255 PolarHBondContact N-O 3.16Å; Y242-Y255 PolarHBondContact O-N 3.48Å; I244-Y255 HydrophobicContact CB-CD2 4.48Å; I244-Y255 HydrophobicContact CD1-CD2 3.68Å; I244-Y255 HydrophobicContact CD1-CE2 4.5Å; I244-Y255 HydrophobicContact CD1-CG 4.22Å; I244-Y255 HydrophobicContact CG1-CD2 4.22Å; F246-Y255 AromaticContact CE2-CE2 3.9Å; F246-Y255 HydrophobicContact CE2-CE2 3.9Å; F246-Y255 HydrophobicContact CZ-CE2 4.05Å; Y253-Y255 HydrophobicContact CD1-CE2 4.18Å; Y253-Y255 HydrophobicContact CG-CE2 4.14Å
256	D	92.5	Very high	86.7	Confident	73 Å²	73	69.4 Å²	69.4	39%	0.39	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	106.3	170.3	-153.8	-17.4	0	0	0	109.4	K238 S240 V241 V258	K238-D256 VanDerWaalsContact CE-OD2 3.25Å; K238-D256 WeakPolarHBondContact CE-OD2 3.41Å; K238-D256 IonicContact NZ-OD2 3.95Å; K238-D256 PolarHBondContact NZ-OD2 3.47Å; S240-D256 WeakPolarHBondContact CB-OD1 3.14Å; S240-D256 PolarHBondContact OG-OD1 2.81Å; V241-D256 HydrophobicContact CG2-CB 4.05Å; D256-V258 PolarHBondContact O-N 3.24Å
257	L	87.3	Confident	86	Confident	55 Å²	55	73.8 Å²	73.8	29%	0.288	40%	0.404	S	S	.	.			trans	-100.9	66.2	-174.3	-57.6	-176.7	0	0	0	110.5	L212 V231 S240 Y242 I244	L212-L257 HydrophobicContact CD1-CB 3.95Å; L212-L257 HydrophobicContact CD1-CD1 3.71Å; V231-L257 HydrophobicContact CG2-CD1 4.43Å; S240-L257 PolarHBondContact O-N 3.43Å; Y242-L257 HydrophobicContact CD2-CB 3.78Å; Y242-L257 HydrophobicContact CD2-CD1 3.72Å; Y242-L257 HydrophobicContact CD2-CG 3.87Å; Y242-L257 HydrophobicContact CE2-CB 4.04Å; Y242-L257 HydrophobicContact CE2-CD1 4.41Å; Y242-L257 HydrophobicContact CG-CD1 4.04Å; I244-L257 HydrophobicContact CD1-CD1 4.24Å
258	V	79.2	Confident	85.3	Confident	102 Å²	102	72.2 Å²	72.2	62%	0.618	40%	0.396	S	S	*	.			trans	-70.1	133.9	173.5	-175.1	0	0	0	0	109.9	D256 T260	D256-V258 PolarHBondContact O-N 3.24Å; V258-T260 PolarHBondContact O-N 3.26Å
259	K	64.3	Low	84.7	Confident	137 Å²	137	70.8 Å²	70.8	60%	0.596	39%	0.389	S	S	*	.			trans	-67.8	116.6	169.3	-65.6	175.9	-172.5	164.9	0	109.1	E207 S261	E207-K259 IonicContact OE1-NZ 3.26Å; E207-K259 PolarHBondContact OE1-NZ 3.38Å; K259-S261 PolarHBondContact O-N 3.48Å
260	T	55.5	Low	83.8	Confident	139 Å²	139	74.8 Å²	74.8	85%	0.853	41%	0.411	S	S	*	.			trans	-78.7	113.2	159.7	51.7	0	0	0	0	108.8	V258	V258-T260 PolarHBondContact O-N 3.26Å
261	S	42.3	Very low	82.6	Confident	188 Å²	188	76.1 Å²	76.1	100%	1.315	42%	0.424	S	S	*	.			trans	-82.1	0	171.4	-62.1	0	0	0	0	112.6	K259	K259-S261 PolarHBondContact O-N 3.48Å

Retrieved 261 of 261 residues in 553.5 ms (Link to these results)

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