A0A2K5XJD9_MANLE Loading...

DNA oxidative demethylase ALKBH2

AlphaFold DB , UniProt , Accession A0A2K5XJD9, Species MANLE (Mandrillus leucophaeus, Drill), Gene ALKBH2, 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	36.6	Very low	28.3	Very low	224 Å²	224	163.6 Å²	163.6	100%	1.103	88%	0.878	S	S	*	*				0	126.7	0	-76.8	73.2	172.7	0	0	107.5
2	D	28.1	Very low	28.1	Very low	159 Å²	159	157 Å²	157	85%	0.85	88%	0.877	S	S	*	*			trans	176.3	124	131.3	-87.6	-22.5	0	0	0	110.5
3	R	25.5	Very low	28	Very low	224 Å²	224	157.8 Å²	157.8	85%	0.845	88%	0.876	S	S	*	*			trans	-89	141.9	-178.7	-69.4	176.4	176.2	-178.9	-1.1	109.1
4	F	28.1	Very low	28	Very low	208 Å²	208	158.1 Å²	158.1	91%	0.912	88%	0.875	S	S	*	*			trans	-140.5	128.5	149.6	-83.6	-75.9	0	0	0	113.3
5	L	26	Very low	27.8	Very low	146 Å²	146	162.5 Å²	162.5	76%	0.764	87%	0.873	S	S	*	*			trans	-82.6	150	-180	-127.2	90.3	0	0	0	110.6
6	V	29.2	Very low	27.8	Very low	145 Å²	145	162.4 Å²	162.4	88%	0.879	86%	0.862	S	S	*	*			trans	-129.4	125.8	162.1	179.4	0	0	0	0	109.6
7	K	29.3	Very low	27.8	Very low	188 Å²	188	167.8 Å²	167.8	82%	0.817	87%	0.867	S	S	*	*			trans	-83.9	145.1	176.3	-79.9	-179.2	173.5	179.6	0	111.3
8	G	26.7	Very low	27.6	Very low	81 Å²	81	166.8 Å²	166.8	84%	0.835	86%	0.858	S	S	*	*			trans	-85.2	162.9	177.1	0	0	0	0	0	114.6
9	V	27.9	Very low	27.6	Very low	147 Å²	147	167.6 Å²	167.6	89%	0.891	86%	0.855	S	S	*	*			trans	-107.2	138.7	178.7	176.2	0	0	0	0	108.9
10	Q	28.5	Very low	27.5	Very low	197 Å²	197	167.6 Å²	167.6	92%	0.921	85%	0.851	S	S	*	*			trans	-114.9	153.2	173.2	-120.1	176	8.8	0	0	110.3
11	G	25.7	Very low	27.5	Very low	81 Å²	81	168 Å²	168	84%	0.835	85%	0.85	S	S	*	*			trans	-88.5	-173.9	-160.9	0	0	0	0	0	116.9
12	G	25.8	Very low	27.3	Very low	84 Å²	84	163.4 Å²	163.4	87%	0.866	84%	0.837	S	S	*	*			trans	-162.3	118.6	175.6	0	0	0	0	0	111
13	L	26.5	Very low	27.2	Very low	167 Å²	167	162.4 Å²	162.4	87%	0.874	84%	0.836	S	S	*	*			trans	-85.7	161.1	-177.4	-144.5	87.9	0	0	0	111.2
14	L	27.9	Very low	27.2	Very low	163 Å²	163	154.9 Å²	154.9	85%	0.853	83%	0.829	S	S	*	*			trans	147.1	148.5	145.9	-87.3	138.2	0	0	0	110
15	R	26	Very low	27.3	Very low	223 Å²	223	154.6 Å²	154.6	84%	0.842	83%	0.83	S	S	*	*			cis	-173.1	142.3	-35.8	-162.5	-179.5	-169.8	-160.7	4.6	105.1
16	K	27.6	Very low	27.5	Very low	161 Å²	161	156.2 Å²	156.2	70%	0.7	83%	0.834	S	S	*	*			trans	6.5	145.3	161.8	-88	-172.1	166.3	-153.9	0	121.3	E18	K16-E18 IonicContact NZ-OE1 3.95Å; K16-E18 PolarHBondContact NZ-OE1 3.24Å
17	R	26.7	Very low	27.9	Very low	254 Å²	254	155.5 Å²	155.5	96%	0.958	83%	0.833	S	S	*	*				-161.6	146	120.6	-106.1	171.5	-169.1	-153.5	2.5	113.4
18	E	25.6	Very low	27.9	Very low	150 Å²	150	150.6 Å²	150.6	70%	0.701	83%	0.827	S	S	*	*			trans	-91.4	174.8	-176.2	-70	153	-175.9	0	0	113.1	K16	K16-E18 IonicContact NZ-OE1 3.95Å; K16-E18 PolarHBondContact NZ-OE1 3.24Å
19	K	26.5	Very low	28	Very low	183 Å²	183	153.9 Å²	153.9	80%	0.796	83%	0.83	S	S	*	*			trans	123.7	144.7	154.9	-73.4	-175.1	176.5	-163.1	0	112.5
20	Q	26.2	Very low	28	Very low	166 Å²	166	155.2 Å²	155.2	78%	0.776	83%	0.832	S	S	*	*			cis	-173.3	151.7	-13.7	-116.4	167.8	-26.2	0	0	105
21	E	27.1	Very low	27.9	Very low	177 Å²	177	149.7 Å²	149.7	83%	0.827	83%	0.828	S	S	*	*			trans	-68.5	170	171.4	-66	178.7	145.2	0	0	112.9
22	P	32.8	Very low	28	Very low	128 Å²	128	149.6 Å²	149.6	83%	0.831	83%	0.826	S	S	*	*				-145.4	171.3	102.1	34.9	-16.3	0	0	0	117.5
23	T	25.4	Very low	28.2	Very low	137 Å²	137	153.4 Å²	153.4	84%	0.84	83%	0.827	S	S	*	*			trans	-69.7	168	-175.7	45.4	0	0	0	0	119
24	G	26.6	Very low	28.3	Very low	67 Å²	67	155.5 Å²	155.5	69%	0.691	83%	0.829	S	S	*	*			trans	138.2	97.6	149.6	0	0	0	0	0	113.5
25	E	28.6	Very low	28.5	Very low	201 Å²	201	156.7 Å²	156.7	94%	0.939	83%	0.83	S	S	*	*				91.6	124.8	87.7	-86.7	-175.1	171.4	0	0	115.1
26	E	31.2	Very low	28.7	Very low	180 Å²	180	151 Å²	151	84%	0.841	83%	0.825	S	S	*	*			trans	-80.3	173.3	169.1	-55.5	-173	141.4	0	0	111.6
27	P	37.5	Very low	29.3	Very low	131 Å²	131	149.1 Å²	149.1	85%	0.851	83%	0.827	S	S	*	*				-149.5	167.8	86.3	34.5	-13.5	0	0	0	116.8
28	A	28.8	Very low	29.7	Very low	85 Å²	85	148.3 Å²	148.3	70%	0.702	82%	0.824	S	S	*	*			trans	-81.1	157.1	177	0	0	0	0	0	115
29	V	29.2	Very low	30.5	Very low	149 Å²	149	151.5 Å²	151.5	90%	0.903	84%	0.835	S	S	*	*			trans	-151.2	146.4	147.3	-174.4	0	0	0	0	111.7
30	L	27.9	Very low	30.9	Very low	176 Å²	176	154 Å²	154	92%	0.921	84%	0.84	S	S	*	*			trans	-87.8	167	-171	-67.3	152.4	0	0	0	116.5
31	G	25.9	Very low	31.3	Very low	81 Å²	81	151.8 Å²	151.8	84%	0.835	84%	0.839	S	S	*	*			trans	120.5	136.6	151.5	0	0	0	0	0	113.9
32	G	27.4	Very low	31.8	Very low	78 Å²	78	155.3 Å²	155.3	80%	0.804	85%	0.845	S	S	*	*			cis	-176.9	165.3	2.6	0	0	0	0	0	108.5
33	D	30.1	Very low	31.8	Very low	164 Å²	164	160.6 Å²	160.6	88%	0.877	85%	0.848	S	S	*	*			trans	-63	150	-174.1	-71.2	-47.7	0	0	0	115.5
34	K	30.4	Very low	32.5	Very low	212 Å²	212	162.9 Å²	162.9	92%	0.922	85%	0.85	S	S	*	*			trans	-165.6	129.3	134.2	-106.1	168.5	-170	-176.1	0	113.1
35	E	30.8	Very low	33.1	Very low	188 Å²	188	164 Å²	164	88%	0.879	85%	0.853	S	S	*	*			trans	-68.7	138.9	176.8	-173.4	172.9	-174.8	0	0	112.5
36	S	30.4	Very low	33.6	Very low	103 Å²	103	160.4 Å²	160.4	72%	0.72	85%	0.847	S	S	*	*			trans	-151.7	113.5	163.5	171.6	0	0	0	0	110.6
37	T	39.5	Very low	33.9	Very low	122 Å²	122	155.4 Å²	155.4	75%	0.748	84%	0.844	S	S	*	*			trans	-46.2	132.9	166.9	28	0	0	0	0	113.8
38	R	34.9	Very low	34.1	Very low	237 Å²	237	156.9 Å²	156.9	89%	0.894	85%	0.845	S	S	*	*			trans	-166.2	119.5	152.3	-103.2	159.3	-162.2	-154	5.4	111
39	K	42.8	Very low	34.6	Very low	217 Å²	217	155.7 Å²	155.7	94%	0.943	84%	0.84	S	S	*	*			trans	-52	133.7	173.8	-74.6	174	173.1	175.4	0	111.2
40	R	35.2	Very low	35	Very low	236 Å²	236	151.5 Å²	151.5	89%	0.891	83%	0.828	S	S	*	*			trans	-121	147.2	167.6	-94.6	-176.8	170	-176.1	-2.2	110.6
41	P	34.6	Very low	35.8	Very low	118 Å²	118	151.8 Å²	151.8	77%	0.766	82%	0.824	S	S	*	*			trans	-75.8	155.8	-170.4	31.9	-33.6	0	0	0	112.1	R43	P41-R43 PolarHBondContact O-N 3.07Å
42	R	36.6	Very low	37.2	Very low	252 Å²	252	153.5 Å²	153.5	95%	0.951	82%	0.823	S	S	*	*			trans	-43.6	117.6	176	-127.5	174.4	-179.5	175.7	-1	110.8
43	R	34.8	Very low	39.1	Very low	238 Å²	238	154.3 Å²	154.3	90%	0.898	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-77.6	117.3	165.3	-89.6	-179.5	170.3	-179.1	-4.2	108.1	P41	P41-R43 PolarHBondContact O-N 3.07Å
44	E	38.7	Very low	41.2	Very low	185 Å²	185	149.2 Å²	149.2	86%	0.864	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-58.4	135.4	158.8	-69.4	178.4	159.6	0	0	108.7
45	A	40	Very low	43.7	Very low	92 Å²	92	141.2 Å²	141.2	76%	0.76	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-64.6	131.8	175.5	0	0	0	0	0	109	G47	A45-G47 PolarHBondContact O-N 3.09Å; A45-G47 VanDerWaalsContact O-N 3.07Å
46	P	38.8	Very low	46.8	Very low	124 Å²	124	137.4 Å²	137.4	81%	0.805	77%	0.772	S	S	*	*			trans	-69.6	112.3	168.7	28.2	-27.8	0	0	0	106.8	N48	P46-N48 PolarHBondContact O-N 2.77Å; P46-N48 VanDerWaalsContact O-N 3.09Å
47	G	37.3	Very low	50	Low	76 Å²	76	136.4 Å²	136.4	78%	0.784	75%	0.753	S	S	*	*			trans	-52.3	118.2	166.1	0	0	0	0	0	107.9	A45 G49	A45-G47 PolarHBondContact O-N 3.09Å; A45-G47 VanDerWaalsContact O-N 3.07Å; G47-G49 PolarHBondContact O-N 3Å
48	N	42.2	Very low	52.8	Low	162 Å²	162	137.4 Å²	137.4	87%	0.866	74%	0.743	S	S	*	*			trans	-72.4	69.2	173	-166.3	27.7	0	0	0	108.3	P46 G50	P46-N48 PolarHBondContact O-N 2.77Å; P46-N48 VanDerWaalsContact O-N 3.09Å; N48-G50 PolarHBondContact O-N 2.98Å
49	G	40.1	Very low	55.8	Low	59 Å²	59	131.6 Å²	131.6	61%	0.608	73%	0.725	S	S	*	*			trans	-75.5	67.3	166.3	0	0	0	0	0	108.6	G47 H51	G47-G49 PolarHBondContact O-N 3Å; G49-H51 PolarHBondContact O-N 2.85Å
50	G	36.3	Very low	58.4	Low	62 Å²	62	121.8 Å²	121.8	64%	0.639	68%	0.683	S	S	*	*			trans	-67	83.5	163.9	0	0	0	0	0	107.8	N48 S52	N48-G50 PolarHBondContact O-N 2.98Å; G50-S52 VanDerWaalsContact C-N 3.28Å; G50-S52 PolarHBondContact O-N 2.88Å
51	H	44.4	Very low	61.4	Low	181 Å²	181	119.4 Å²	119.4	84%	0.838	67%	0.674	S	S	*	*			trans	-58.4	100.3	161.9	-75.7	-65	0	0	0	106.3	G49 A53	G49-H51 PolarHBondContact O-N 2.85Å; H51-A53 VanDerWaalsContact C-N 3.28Å; H51-A53 PolarHBondContact O-N 2.87Å
52	S	55	Low	64.4	Low	117 Å²	117	115.8 Å²	115.8	82%	0.818	65%	0.654	S	S	*	*			trans	-64.5	102.4	165.8	72.4	0	0	0	0	105.4	G50 G54	G50-S52 VanDerWaalsContact C-N 3.28Å; G50-S52 PolarHBondContact O-N 2.88Å; S52-G54 PolarHBondContact O-N 3.14Å; S52-G54 VanDerWaalsContact O-N 3.14Å
53	A	67.8	Low	67.3	Low	95 Å²	95	108.7 Å²	108.7	79%	0.785	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-55.2	124.8	169.7	0	0	0	0	0	106.1	H51	H51-A53 VanDerWaalsContact C-N 3.28Å; H51-A53 PolarHBondContact O-N 2.87Å
54	G	74.4	Confident	70.2	Confident	57 Å²	57	98.4 Å²	98.4	59%	0.588	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-54.5	165.8	178	0	0	0	0	0	111.6	S52 S56	S52-G54 PolarHBondContact O-N 3.14Å; S52-G54 VanDerWaalsContact O-N 3.14Å; G54-S56 PolarHBondContact O-N 3.35Å
55	P	83.7	Confident	73.1	Confident	45 Å²	45	89.9 Å²	89.9	29%	0.292	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-54.8	135.7	-179.2	19.7	-29.2	0	0	0	111.3	W57 T70 V148	P55-W57 HydrophobicContact CG-CZ2 4.35Å; P55-W57 PolarHBondContact O-N 3.21Å; P55-W57 PolarHBondContact O-NE1 2.85Å; P55-T70 HydrophobicContact CB-CG2 4.27Å; P55-T70 WeakPolarHBondContact CB-OG1 3.5Å; P55-V148 HydrophobicContact CG-CG1 3.87Å
56	S	94.8	Very high	75.9	Confident	108 Å²	108	87.6 Å²	87.6	76%	0.755	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-75.8	120.9	175.1	175.7	0	0	0	0	110.2	G54 T70	G54-S56 PolarHBondContact O-N 3.35Å; S56-T70 WeakPolarHBondContact O-CB 3.36Å; S56-T70 PolarHBondContact O-OG1 3.17Å; S56-T70 VanDerWaalsContact O-OG1 3.04Å
57	W	97.9	Very high	78.7	Confident	82 Å²	82	81.7 Å²	81.7	31%	0.311	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-97.5	131.7	-177.6	-64.2	89.1	0	0	0	112.4	P55 T70 V148 T149 L223 M225	P55-W57 HydrophobicContact CG-CZ2 4.35Å; P55-W57 PolarHBondContact O-N 3.21Å; P55-W57 PolarHBondContact O-NE1 2.85Å; W57-T70 HydrophobicContact CD2-CG2 4.16Å; W57-T70 HydrophobicContact CE3-CG2 3.81Å; W57-T70 HydrophobicContact CH2-CG2 3.81Å; W57-T70 HydrophobicContact CZ2-CG2 4.12Å; W57-T70 HydrophobicContact CZ3-CG2 3.63Å; W57-V148 HydrophobicContact CH2-CG1 4.34Å; W57-V148 HydrophobicContact CZ2-CG1 3.67Å; W57-T149 HydrophobicContact CH2-CG2 3.99Å; W57-L223 HydrophobicContact CH2-CD2 3.8Å; W57-L223 HydrophobicContact CZ3-CD2 4.19Å; W57-M225 HydrophobicContact CH2-CG 4.49Å; W57-M225 HydrophobicContact CZ3-CG 4.18Å
58	R	98.3	Very high	81.7	Confident	142 Å²	142	78.7 Å²	78.7	54%	0.536	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	115.6	164.3	179	-177.2	178.6	-178.6	1.3	109.1	I60 S68 Y69	R58-I60 HydrophobicContact CG-CG1 4.35Å; R58-S68 WeakPolarHBondContact O-CA 3.49Å; R58-Y69 HydrophobicContact CB-CD1 4.44Å; R58-Y69 PolarHBondContact N-O 2.87Å; R58-Y69 PolarHBondContact O-N 2.98Å
59	H	98.2	Very high	84.4	Confident	115 Å²	115	72.4 Å²	72.4	53%	0.532	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	133.5	169	-60.1	-62.5	0	0	0	110.5	S68	H59-S68 PolarHBondContact ND1-OG 2.81Å
60	I	98.3	Very high	87.2	Confident	11 Å²	11	69.9 Å²	69.9	6%	0.056	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	107.4	-179.7	-57.1	165	0	0	0	106.2	R58 L65 C67 V214 L216 L224	R58-I60 HydrophobicContact CG-CG1 4.35Å; I60-L65 HydrophobicContact CG2-CD2 4.05Å; I60-C67 HydrophobicContact CB-CB 4.07Å; I60-C67 HydrophobicContact CD1-CB 4.46Å; I60-C67 PolarHBondContact N-O 2.64Å; I60-C67 PolarHBondContact O-N 2.88Å; I60-V214 HydrophobicContact CG2-CG1 3.73Å; I60-L216 HydrophobicContact CD1-CD1 3.83Å; I60-L216 HydrophobicContact CD1-CD2 4.3Å; I60-L224 HydrophobicContact CD1-CD1 4.06Å
61	R	98.1	Very high	90.1	Very high	187 Å²	187	70.8 Å²	70.8	71%	0.706	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	141	-174.8	-66.1	-169.5	175	-170.1	1.7	112	L65 D66	R61-L65 WeakPolarHBondContact CA-O 3.48Å; R61-D66 IonicContact NE-OD1 3.32Å
62	A	97.4	Very high	92.7	Very high	41 Å²	41	62.7 Å²	62.7	34%	0.339	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	-179.6	166.2	0	0	0	0	0	107.7	G64 L65 V214 W234	A62-G64 PolarHBondContact O-N 3.29Å; A62-L65 HydrophobicContact CB-CB 3.89Å; A62-L65 HydrophobicContact CB-CD2 4.02Å; A62-L65 PolarHBondContact N-O 3.47Å; A62-L65 PolarHBondContact O-N 3.4Å; A62-V214 HydrophobicContact CB-CG2 4.44Å; A62-W234 HydrophobicContact CB-CH2 4.05Å; A62-W234 HydrophobicContact CB-CZ2 3.71Å
63	E	96.3	Very high	94.8	Very high	103 Å²	103	57.2 Å²	57.2	48%	0.481	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	116.1	175	-176	-171	147.8	0	0	111.2	L65 R209 W234	E63-L65 PolarHBondContact O-N 3.25Å; E63-R209 VanDerWaalsContact CD-NH2 3.29Å; E63-R209 IonicContact OE1-CZ 3.43Å; E63-R209 IonicContact OE1-NH1 2.7Å; E63-R209 PolarHBondContact OE1-NH1 3.11Å; E63-R209 IonicContact OE1-NH2 3.68Å; E63-R209 PolarHBondContact OE1-NH2 3.49Å; E63-R209 VanDerWaalsContact OE1-NH2 3.12Å; E63-R209 IonicContact OE2-CZ 3.72Å; E63-R209 IonicContact OE2-NH1 3.08Å; E63-R209 IonicContact OE2-NH2 3.95Å; E63-R209 PolarHBondContact OE2-NH2 3.3Å; E63-W234 WeakPolarHBondContact O-CZ2 3.46Å; E63-W234 PolarHBondContact O-NE1 2.85Å
64	G	97.4	Very high	96.2	Very high	23 Å²	23	55.9 Å²	55.9	24%	0.237	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.8	12.8	-177.6	0	0	0	0	0	115.1	A62 T230 W234	A62-G64 PolarHBondContact O-N 3.29Å; G64-T230 WeakPolarHBondContact O-CA 3.22Å; G64-W234 PolarHBondContact O-NE1 3.29Å
65	L	98.6	Very high	97.3	Very high	6 Å²	6	60.1 Å²	60.1	3%	0.031	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	117.6	174.6	-177.5	65.5	0	0	0	109.2	I60 R61 A62 E63 F197 V214 T230 W234	I60-L65 HydrophobicContact CG2-CD2 4.05Å; R61-L65 WeakPolarHBondContact CA-O 3.48Å; A62-L65 HydrophobicContact CB-CB 3.89Å; A62-L65 HydrophobicContact CB-CD2 4.02Å; A62-L65 PolarHBondContact N-O 3.47Å; A62-L65 PolarHBondContact O-N 3.4Å; E63-L65 PolarHBondContact O-N 3.25Å; L65-F197 HydrophobicContact CD1-CD1 3.96Å; L65-F197 HydrophobicContact CD1-CE1 4.08Å; L65-F197 HydrophobicContact CD1-CG 4.17Å; L65-F197 HydrophobicContact CD1-CZ 4.38Å; L65-V214 HydrophobicContact CD2-CB 4.03Å; L65-V214 HydrophobicContact CD2-CG1 4.14Å; L65-V214 HydrophobicContact CD2-CG2 3.74Å; L65-T230 HydrophobicContact CD1-CG2 3.44Å; L65-T230 VanDerWaalsContact CD1-CG2 3.44Å; L65-W234 HydrophobicContact CB-CD2 4.25Å; L65-W234 HydrophobicContact CB-CG 4.37Å; L65-W234 HydrophobicContact CB-CZ2 4.09Å; L65-W234 HydrophobicContact CD1-CD2 4.34Å; L65-W234 HydrophobicContact CD1-CG 4.11Å
66	D	98.6	Very high	98	Very high	43 Å²	43	61.2 Å²	61.2	23%	0.23	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	107	171.4	-178.6	38.3	0	0	0	109.6	R61 N227 T230	R61-D66 IonicContact NE-OD1 3.32Å; D66-N227 HydrophobicContact CB-CB 4.34Å; D66-N227 WeakPolarHBondContact O-CB 3.49Å; D66-N227 PolarHBondContact O-N 2.98Å; D66-N227 WeakPolarHBondContact OD2-CB 3.48Å; D66-N227 PolarHBondContact OD2-ND2 3.04Å; D66-T230 PolarHBondContact N-OG1 2.8Å; D66-T230 PolarHBondContact O-OG1 3.1Å
67	C	98.8	Very high	98.2	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	153.6	177.6	-65.6	0	0	0	0	110.7	I60 L224 M225	I60-C67 HydrophobicContact CB-CB 4.07Å; I60-C67 HydrophobicContact CD1-CB 4.46Å; I60-C67 PolarHBondContact N-O 2.64Å; I60-C67 PolarHBondContact O-N 2.88Å; C67-L224 HydrophobicContact CB-CD1 4Å; C67-M225 CarbonylContact C-O 3.6Å; C67-M225 WeakPolarHBondContact CA-O 3.28Å; C67-M225 VanDerWaalsContact CB-O 3.31Å; C67-M225 WeakPolarHBondContact CB-O 3.35Å
68	S	98.6	Very high	98.3	Very high	14 Å²	14	54.7 Å²	54.7	10%	0.098	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	136	171.9	-62.8	0	0	0	0	110.2	R58 H59 L224 M225	R58-S68 WeakPolarHBondContact O-CA 3.49Å; H59-S68 PolarHBondContact ND1-OG 2.81Å; S68-L224 WeakPolarHBondContact O-CA 3.42Å; S68-M225 PolarHBondContact N-O 3.27Å; S68-M225 PolarHBondContact O-N 3.45Å
69	Y	98.8	Very high	98.3	Very high	30 Å²	30	50.4 Å²	50.4	12%	0.118	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	137	-175.3	174.5	-97.9	0	0	0	111.2	R58 L216 L218 A219 S222 L223 L224	R58-Y69 HydrophobicContact CB-CD1 4.44Å; R58-Y69 PolarHBondContact N-O 2.87Å; R58-Y69 PolarHBondContact O-N 2.98Å; Y69-L216 HydrophobicContact CD1-CD1 4.06Å; Y69-L216 HydrophobicContact CD2-CD1 3.37Å; Y69-L216 HydrophobicContact CE1-CD1 4.38Å; Y69-L216 HydrophobicContact CE2-CD1 3.73Å; Y69-L216 HydrophobicContact CG-CD1 3.53Å; Y69-L218 HydrophobicContact CD2-CD2 4Å; Y69-L218 HydrophobicContact CE2-CD2 3.73Å; Y69-A219 WeakPolarHBondContact OH-CB 3.4Å; Y69-A219 PolarHBondContact OH-N 2.98Å; Y69-S222 VanDerWaalsContact CE2-CB 3.43Å; Y69-S222 VanDerWaalsContact OH-CB 3.24Å; Y69-S222 WeakPolarHBondContact OH-CB 3.37Å; Y69-L223 WeakPolarHBondContact CA-O 3.19Å; Y69-L223 WeakPolarHBondContact CD2-O 3.48Å; Y69-L224 HydrophobicContact CD2-CB 4.38Å
70	T	98.7	Very high	98.3	Very high	6 Å²	6	49.5 Å²	49.5	4%	0.037	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	160.3	172.7	-173.6	0	0	0	0	111.1	P55 S56 W57 L72 S222 L223	P55-T70 HydrophobicContact CB-CG2 4.27Å; P55-T70 WeakPolarHBondContact CB-OG1 3.5Å; S56-T70 WeakPolarHBondContact O-CB 3.36Å; S56-T70 PolarHBondContact O-OG1 3.17Å; S56-T70 VanDerWaalsContact O-OG1 3.04Å; W57-T70 HydrophobicContact CD2-CG2 4.16Å; W57-T70 HydrophobicContact CE3-CG2 3.81Å; W57-T70 HydrophobicContact CH2-CG2 3.81Å; W57-T70 HydrophobicContact CZ2-CG2 4.12Å; W57-T70 HydrophobicContact CZ3-CG2 3.63Å; T70-L72 HydrophobicContact CG2-CB 4.31Å; T70-S222 CarbonylContact O-C 3.55Å; T70-S222 VanDerWaalsContact O-CA 3.29Å; T70-S222 WeakPolarHBondContact O-CA 3.29Å; T70-S222 WeakPolarHBondContact O-CB 3.49Å; T70-L223 HydrophobicContact CG2-CB 4.19Å; T70-L223 PolarHBondContact N-O 3.07Å; T70-L223 PolarHBondContact O-N 3.12Å
71	V	98.5	Very high	98.3	Very high	81 Å²	81	49 Å²	49	49%	0.491	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	102.5	162.6	-178.8	0	0	0	0	107	F73	V71-F73 WeakPolarHBondContact CG1-O 3.45Å
72	L	98.6	Very high	98.4	Very high	10 Å²	10	41.9 Å²	41.9	5%	0.052	24%	0.239	C	C	.	.			trans	-84.3	-36.7	-171.4	179.4	60.7	0	0	0	112.5	T70 R144 V145 V148 G221 L223	T70-L72 HydrophobicContact CG2-CB 4.31Å; L72-R144 HydrophobicContact CD2-CG 4.27Å; L72-R144 HydrophobicContact CG-CG 4.31Å; L72-V145 HydrophobicContact CD2-CG2 3.73Å; L72-V148 HydrophobicContact CD1-CB 4.21Å; L72-V148 HydrophobicContact CD1-CG1 4.03Å; L72-V148 HydrophobicContact CD1-CG2 3.96Å; L72-G221 PolarHBondContact N-O 2.8Å; L72-L223 HydrophobicContact CB-CB 3.95Å; L72-L223 HydrophobicContact CD2-CB 4.11Å; L72-L223 HydrophobicContact CD2-CD2 3.92Å
73	F	98.5	Very high	98.5	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.009	25%	0.248	C	C	.	.	S	Bend	trans	-107.2	127.1	-178.9	-58.9	-87.9	0	0	0	109	V71 E77 A78 I81 I141 R144 V187 F189 G221	V71-F73 WeakPolarHBondContact CG1-O 3.45Å; F73-E77 HydrophobicContact CB-CG 4.41Å; F73-E77 HydrophobicContact CD1-CG 3.95Å; F73-A78 HydrophobicContact CB-CB 3.91Å; F73-I81 HydrophobicContact CD1-CD1 3.57Å; F73-I81 HydrophobicContact CE1-CD1 3.74Å; F73-I81 HydrophobicContact CG-CD1 4.25Å; F73-I141 HydrophobicContact CE2-CG2 4.28Å; F73-I141 HydrophobicContact CZ-CB 4.36Å; F73-I141 HydrophobicContact CZ-CG1 4.38Å; F73-I141 HydrophobicContact CZ-CG2 3.94Å; F73-R144 HydrophobicContact CD1-CG 4.47Å; F73-R144 HydrophobicContact CE1-CB 3.98Å; F73-R144 HydrophobicContact CE1-CG 3.63Å; F73-R144 HydrophobicContact CZ-CB 4Å; F73-R144 HydrophobicContact CZ-CG 3.8Å; F73-V187 HydrophobicContact CD2-CG1 4.16Å; F73-V187 HydrophobicContact CE2-CG1 3.68Å; F73-F189 HydrophobicContact CB-CE1 4.34Å; F73-F189 AromaticContact CD2-CE1 3.97Å; F73-F189 HydrophobicContact CD2-CE1 3.97Å; F73-F189 AromaticContact CD2-CZ 3.78Å; F73-F189 HydrophobicContact CD2-CZ 3.78Å; F73-F189 AromaticContact CE2-CZ 3.87Å; F73-F189 HydrophobicContact CE2-CZ 3.87Å; F73-F189 HydrophobicContact CG-CE1 4.11Å; F73-F189 HydrophobicContact CG-CZ 4.23Å; F73-F189 HydrophobicContact CZ-CZ 4.39Å; F73-G221 PolarHBondContact N-O 3.31Å
74	A	97.7	Very high	98.6	Very high	67 Å²	67	43.5 Å²	43.5	55%	0.554	24%	0.239	S	C	*	.			trans	-64.8	157.1	174.3	0	0	0	0	0	110.2	A76 E77 A78	A74-A76 VanDerWaalsContact C-N 3.35Å; A74-A76 PolarHBondContact O-N 2.9Å; A74-E77 PolarHBondContact O-N 3.28Å; A74-E77 VanDerWaalsContact O-N 3.17Å; A74-A78 WeakPolarHBondContact O-CB 3.13Å; A74-A78 PolarHBondContact O-N 3.35Å
75	K	98.3	Very high	98.6	Very high	147 Å²	147	42.4 Å²	42.4	64%	0.639	23%	0.228	S	C	*	.	H	α-helix	trans	-50.6	-49.8	-172.3	-173.3	-171.4	177.8	-60.8	0	113.4	A78 D79	K75-A78 PolarHBondContact O-N 3.25Å; K75-D79 IonicContact NZ-OD1 2.81Å; K75-D79 IonicContact NZ-OD2 3.35Å; K75-D79 PolarHBondContact NZ-OD2 3.33Å; K75-D79 WeakPolarHBondContact O-CB 3.4Å; K75-D79 VanDerWaalsContact O-CG 3.22Å; K75-D79 PolarHBondContact O-N 3.45Å
76	A	98.6	Very high	98.6	Very high	67 Å²	67	45.1 Å²	45.1	55%	0.554	24%	0.241	S	C	*	.	H	α-helix	trans	-61.4	-47.5	-177.7	0	0	0	0	0	112.1	A74 A78 D79 E80	A74-A76 VanDerWaalsContact C-N 3.35Å; A74-A76 PolarHBondContact O-N 2.9Å; A76-A78 VanDerWaalsContact C-N 3.35Å; A76-A78 PolarHBondContact O-N 3.03Å; A76-D79 PolarHBondContact O-N 2.93Å; A76-E80 WeakPolarHBondContact O-CG 3.19Å; A76-E80 PolarHBondContact O-N 3.39Å; A76-E80 VanDerWaalsContact O-N 3.11Å
77	E	98.6	Very high	98.6	Very high	53 Å²	53	51 Å²	51	25%	0.248	26%	0.264	C	S	.	.	H	α-helix	trans	-63.3	-41	176.4	171.1	169.9	-135	0	0	111.9	F73 A74 D79 E80 I81 R140	F73-E77 HydrophobicContact CB-CG 4.41Å; F73-E77 HydrophobicContact CD1-CG 3.95Å; A74-E77 PolarHBondContact O-N 3.28Å; A74-E77 VanDerWaalsContact O-N 3.17Å; E77-D79 VanDerWaalsContact C-N 3.33Å; E77-D79 PolarHBondContact O-N 3.34Å; E77-E80 PolarHBondContact O-N 3.14Å; E77-I81 HydrophobicContact CG-CD1 3.75Å; E77-I81 HydrophobicContact CG-CG1 4.48Å; E77-I81 WeakPolarHBondContact O-CB 3.46Å; E77-I81 VanDerWaalsContact O-CG1 3.28Å; E77-I81 WeakPolarHBondContact O-CG1 3.29Å; E77-I81 PolarHBondContact O-N 3.11Å; E77-R140 IonicContact OE1-CZ 3Å; E77-R140 IonicContact OE1-NE 2.93Å; E77-R140 IonicContact OE1-NH2 3.59Å; E77-R140 PolarHBondContact OE1-NH2 2.72Å
78	A	98.8	Very high	98.6	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-67.5	-34.5	178.9	0	0	0	0	0	111.9	F73 A74 K75 A76 F82 F189 H220	F73-A78 HydrophobicContact CB-CB 3.91Å; A74-A78 WeakPolarHBondContact O-CB 3.13Å; A74-A78 PolarHBondContact O-N 3.35Å; K75-A78 PolarHBondContact O-N 3.25Å; A76-A78 VanDerWaalsContact C-N 3.35Å; A76-A78 PolarHBondContact O-N 3.03Å; A78-F82 VanDerWaalsContact O-CB 3.29Å; A78-F82 WeakPolarHBondContact O-CB 3.25Å; A78-F82 PolarHBondContact O-N 3.09Å; A78-F189 HydrophobicContact CB-CD1 4.02Å; A78-F189 HydrophobicContact CB-CE1 4.06Å; A78-H220 VanDerWaalsContact CB-CE1 3.46Å; A78-H220 WeakPolarHBondContact CB-CE1 3.23Å; A78-H220 WeakPolarHBondContact CB-NE2 3.33Å; A78-H220 PolarHBondContact O-CE1 2.86Å; A78-H220 PolarHBondContact O-NE2 2.89Å
79	D	98.8	Very high	98.6	Very high	52 Å²	52	54.8 Å²	54.8	28%	0.278	28%	0.281	S	S	.	.	H	α-helix	trans	-65.5	-45.3	174.8	-72.8	-33.5	0	0	0	110.8	K75 A76 E77 F82 Q83 H220	K75-D79 IonicContact NZ-OD1 2.81Å; K75-D79 IonicContact NZ-OD2 3.35Å; K75-D79 PolarHBondContact NZ-OD2 3.33Å; K75-D79 WeakPolarHBondContact O-CB 3.4Å; K75-D79 VanDerWaalsContact O-CG 3.22Å; K75-D79 PolarHBondContact O-N 3.45Å; A76-D79 PolarHBondContact O-N 2.93Å; E77-D79 VanDerWaalsContact C-N 3.33Å; E77-D79 PolarHBondContact O-N 3.34Å; D79-F82 PolarHBondContact O-N 2.88Å; D79-Q83 WeakPolarHBondContact O-CG 3.34Å; D79-Q83 PolarHBondContact O-N 2.9Å; D79-Q83 VanDerWaalsContact O-N 3.1Å; D79-H220 PolarHBondContact N-NE2 3.31Å; D79-H220 IonicContact OD1-CD2 2.64Å; D79-H220 IonicContact OD1-NE2 3.59Å; D79-H220 PolarHBondContact OD1-NE2 2.86Å
80	E	98.8	Very high	98.6	Very high	97 Å²	97	58.7 Å²	58.7	45%	0.453	30%	0.3	S	S	.	.	H	α-helix	trans	-58.9	-52.3	175.2	-72.2	170.6	-173.5	0	0	111.2	A76 E77 F82 Q83 E84	A76-E80 WeakPolarHBondContact O-CG 3.19Å; A76-E80 PolarHBondContact O-N 3.39Å; A76-E80 VanDerWaalsContact O-N 3.11Å; E77-E80 PolarHBondContact O-N 3.14Å; E80-F82 VanDerWaalsContact C-N 3.27Å; E80-F82 PolarHBondContact O-N 3.01Å; E80-Q83 WeakPolarHBondContact O-CB 3.49Å; E80-Q83 PolarHBondContact O-N 3.27Å; E80-Q83 VanDerWaalsContact O-N 3.1Å; E80-E84 PolarHBondContact O-N 2.99Å
81	I	98.9	Very high	98.5	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57.9	-42.6	178.1	-71.1	167.6	0	0	0	110.7	F73 E77 Q83 E84 L85 V137 I141 F189	F73-I81 HydrophobicContact CD1-CD1 3.57Å; F73-I81 HydrophobicContact CE1-CD1 3.74Å; F73-I81 HydrophobicContact CG-CD1 4.25Å; E77-I81 HydrophobicContact CG-CD1 3.75Å; E77-I81 HydrophobicContact CG-CG1 4.48Å; E77-I81 WeakPolarHBondContact O-CB 3.46Å; E77-I81 VanDerWaalsContact O-CG1 3.28Å; E77-I81 WeakPolarHBondContact O-CG1 3.29Å; E77-I81 PolarHBondContact O-N 3.11Å; I81-Q83 VanDerWaalsContact C-N 3.3Å; I81-Q83 PolarHBondContact O-N 3.1Å; I81-E84 PolarHBondContact O-N 3.08Å; I81-L85 HydrophobicContact CG2-CD1 3.66Å; I81-L85 HydrophobicContact CG2-CG 4.1Å; I81-L85 WeakPolarHBondContact O-CB 3.41Å; I81-L85 WeakPolarHBondContact O-CG 3.49Å; I81-L85 PolarHBondContact O-N 3.38Å; I81-V137 HydrophobicContact CG2-CG2 4.02Å; I81-I141 HydrophobicContact CD1-CG1 4.34Å; I81-I141 HydrophobicContact CG2-CD1 3.63Å; I81-I141 HydrophobicContact CG2-CG1 4.05Å; I81-F189 HydrophobicContact CB-CD1 4.28Å; I81-F189 HydrophobicContact CB-CE1 3.92Å; I81-F189 HydrophobicContact CB-CZ 4.25Å; I81-F189 HydrophobicContact CD1-CE1 4.06Å; I81-F189 HydrophobicContact CD1-CZ 4.13Å; I81-F189 HydrophobicContact CG2-CD1 3.93Å; I81-F189 HydrophobicContact CG2-CD2 4.09Å; I81-F189 HydrophobicContact CG2-CE1 3.57Å; I81-F189 HydrophobicContact CG2-CE2 3.73Å; I81-F189 HydrophobicContact CG2-CG 4.19Å; I81-F189 HydrophobicContact CG2-CZ 3.47Å; I81-F189 VanDerWaalsContact CG2-CZ 3.47Å
82	F	98.9	Very high	98.2	Very high	38 Å²	38	57.8 Å²	57.8	17%	0.167	29%	0.289	C	S	.	.	H	α-helix	trans	-61.6	-39.7	179	-175.3	-116	0	0	0	112.4	A78 D79 E80 E86 F189 P247 V249	A78-F82 VanDerWaalsContact O-CB 3.29Å; A78-F82 WeakPolarHBondContact O-CB 3.25Å; A78-F82 PolarHBondContact O-N 3.09Å; D79-F82 PolarHBondContact O-N 2.88Å; E80-F82 VanDerWaalsContact C-N 3.27Å; E80-F82 PolarHBondContact O-N 3.01Å; F82-E86 HydrophobicContact CE1-CG 4.26Å; F82-E86 HydrophobicContact CE2-CG 4.15Å; F82-E86 HydrophobicContact CZ-CG 3.97Å; F82-E86 WeakPolarHBondContact O-CG 3.41Å; F82-E86 PolarHBondContact O-N 3.46Å; F82-E86 VanDerWaalsContact O-N 3.08Å; F82-F189 HydrophobicContact CB-CB 4.09Å; F82-F189 HydrophobicContact CD2-CB 3.64Å; F82-F189 HydrophobicContact CG-CB 4.27Å; F82-P247 HydrophobicContact CZ-CB 4.33Å; F82-P247 HydrophobicContact CZ-CG 3.95Å; F82-V249 HydrophobicContact CD2-CB 4.48Å; F82-V249 HydrophobicContact CD2-CG2 4.4Å; F82-V249 HydrophobicContact CE2-CB 4.22Å; F82-V249 HydrophobicContact CE2-CG2 3.84Å
83	Q	98.8	Very high	97.8	Very high	113 Å²	113	62.8 Å²	62.8	53%	0.528	32%	0.319	S	S	.	.	H	α-helix	trans	-67.8	-42.1	176.9	-68.4	173.8	19.8	0	0	112.4	D79 E80 I81 E86 K87	D79-Q83 WeakPolarHBondContact O-CG 3.34Å; D79-Q83 PolarHBondContact O-N 2.9Å; D79-Q83 VanDerWaalsContact O-N 3.1Å; E80-Q83 WeakPolarHBondContact O-CB 3.49Å; E80-Q83 PolarHBondContact O-N 3.27Å; E80-Q83 VanDerWaalsContact O-N 3.1Å; I81-Q83 VanDerWaalsContact C-N 3.3Å; I81-Q83 PolarHBondContact O-N 3.1Å; Q83-E86 PolarHBondContact O-N 2.83Å; Q83-K87 WeakPolarHBondContact O-CG 3.32Å; Q83-K87 PolarHBondContact O-N 2.8Å
84	E	98.8	Very high	97.3	Very high	64 Å²	64	65.3 Å²	65.3	30%	0.299	35%	0.346	S	S	.	.	H	α-helix	trans	-61.4	-46.2	174.6	-73.2	174.7	-172	0	0	111	E80 I81 E86 K87 E88 V137	E80-E84 PolarHBondContact O-N 2.99Å; I81-E84 PolarHBondContact O-N 3.08Å; E84-E86 PolarHBondContact O-N 3.41Å; E84-K87 PolarHBondContact O-N 2.69Å; E84-K87 VanDerWaalsContact O-N 3.09Å; E84-E88 WeakPolarHBondContact O-CB 3.37Å; E84-E88 PolarHBondContact O-N 3.38Å; E84-V137 HydrophobicContact CB-CB 4.11Å; E84-V137 HydrophobicContact CB-CG1 4.48Å; E84-V137 HydrophobicContact CB-CG2 3.82Å; E84-V137 WeakPolarHBondContact OE2-CB 3.14Å; E84-V137 VanDerWaalsContact OE2-CG2 3.25Å; E84-V137 WeakPolarHBondContact OE2-CG2 3.32Å
85	L	98.8	Very high	96.4	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-60.5	-41.1	178	-71.2	169.8	0	0	0	113	I81 K87 V89 V137 L138 I141 F189 V249 L251	I81-L85 HydrophobicContact CG2-CD1 3.66Å; I81-L85 HydrophobicContact CG2-CG 4.1Å; I81-L85 WeakPolarHBondContact O-CB 3.41Å; I81-L85 WeakPolarHBondContact O-CG 3.49Å; I81-L85 PolarHBondContact O-N 3.38Å; L85-K87 PolarHBondContact O-N 3.35Å; L85-V89 HydrophobicContact CB-CG2 4.3Å; L85-V89 HydrophobicContact CD2-CG2 3.8Å; L85-V89 VanDerWaalsContact O-CB 3.29Å; L85-V89 WeakPolarHBondContact O-CB 3.36Å; L85-V89 VanDerWaalsContact O-CG2 3.25Å; L85-V89 WeakPolarHBondContact O-CG2 3.15Å; L85-V89 PolarHBondContact O-N 2.86Å; L85-V137 HydrophobicContact CD2-CG1 4.09Å; L85-V137 HydrophobicContact CD2-CG2 4.18Å; L85-V137 HydrophobicContact CG-CG2 4.16Å; L85-L138 HydrophobicContact CD2-CD2 3.59Å; L85-I141 HydrophobicContact CD1-CD1 4.28Å; L85-I141 HydrophobicContact CD2-CD1 4.28Å; L85-F189 HydrophobicContact CD1-CB 4.41Å; L85-F189 HydrophobicContact CD1-CD2 3.59Å; L85-F189 HydrophobicContact CD1-CE2 4.1Å; L85-F189 HydrophobicContact CD1-CG 4.13Å; L85-V249 HydrophobicContact CD1-CG1 4.09Å; L85-L251 HydrophobicContact CD1-CD1 3.89Å; L85-L251 HydrophobicContact CD2-CD2 4.36Å
86	E	98.6	Very high	95.6	Very high	64 Å²	64	61.4 Å²	61.4	30%	0.299	33%	0.334	S	S	.	.	H	α-helix	trans	-68.4	-23.6	177.9	-74.6	-70.9	105.6	0	0	112.9	F82 Q83 E84 R160 V249	F82-E86 HydrophobicContact CE1-CG 4.26Å; F82-E86 HydrophobicContact CE2-CG 4.15Å; F82-E86 HydrophobicContact CZ-CG 3.97Å; F82-E86 WeakPolarHBondContact O-CG 3.41Å; F82-E86 PolarHBondContact O-N 3.46Å; F82-E86 VanDerWaalsContact O-N 3.08Å; Q83-E86 PolarHBondContact O-N 2.83Å; E84-E86 PolarHBondContact O-N 3.41Å; E86-R160 VanDerWaalsContact CD-NE 3.33Å; E86-R160 VanDerWaalsContact OE1-CD 3.32Å; E86-R160 WeakPolarHBondContact OE1-CD 3.48Å; E86-R160 IonicContact OE1-CZ 2.67Å; E86-R160 IonicContact OE1-NE 3.64Å; E86-R160 PolarHBondContact OE1-NE 3.24Å; E86-R160 IonicContact OE1-NH2 3.89Å; E86-R160 IonicContact OE2-CZ 3.3Å; E86-R160 VanDerWaalsContact OE2-CZ 3.31Å; E86-R160 IonicContact OE2-NE 3.59Å; E86-R160 PolarHBondContact OE2-NE 2.81Å; E86-R160 IonicContact OE2-NH2 3.25Å; E86-R160 PolarHBondContact OE2-NH2 2.93Å; E86-V249 VanDerWaalsContact OE1-CG2 3.25Å; E86-V249 WeakPolarHBondContact OE1-CG2 3.5Å
87	K	98.6	Very high	94.9	Very high	165 Å²	165	60.9 Å²	60.9	72%	0.717	32%	0.324	S	S	*	.	H	α-helix	trans	-87.4	-44.2	177.9	-70.8	171	-175.5	172.7	0	112.7	Q83 E84 L85	Q83-K87 WeakPolarHBondContact O-CG 3.32Å; Q83-K87 PolarHBondContact O-N 2.8Å; E84-K87 PolarHBondContact O-N 2.69Å; E84-K87 VanDerWaalsContact O-N 3.09Å; L85-K87 PolarHBondContact O-N 3.35Å
88	E	98.5	Very high	94.2	Very high	83 Å²	83	64.1 Å²	64.1	39%	0.388	33%	0.334	S	S	.	.	H	α-helix	trans	-100.3	-23.3	-164.7	-63	-175.1	-162.3	0	0	114.4	E84 E90 I135	E84-E88 WeakPolarHBondContact O-CB 3.37Å; E84-E88 PolarHBondContact O-N 3.38Å; E88-E90 PolarHBondContact O-N 3.31Å; E88-I135 HydrophobicContact CB-CD1 3.63Å
89	V	98.6	Very high	93.3	Very high	11 Å²	11	65.6 Å²	65.6	7%	0.067	34%	0.342	C	S	.	.			trans	-71.8	119.6	-177.1	176	0	0	0	0	110.9	L85 Y91 A113 Y115 I158	L85-V89 HydrophobicContact CB-CG2 4.3Å; L85-V89 HydrophobicContact CD2-CG2 3.8Å; L85-V89 VanDerWaalsContact O-CB 3.29Å; L85-V89 WeakPolarHBondContact O-CB 3.36Å; L85-V89 VanDerWaalsContact O-CG2 3.25Å; L85-V89 WeakPolarHBondContact O-CG2 3.15Å; L85-V89 PolarHBondContact O-N 2.86Å; V89-Y91 HydrophobicContact CB-CE2 3.95Å; V89-Y91 HydrophobicContact CG1-CD1 4.11Å; V89-Y91 HydrophobicContact CG1-CD2 4.16Å; V89-Y91 HydrophobicContact CG1-CE1 3.67Å; V89-Y91 HydrophobicContact CG1-CE2 3.72Å; V89-Y91 HydrophobicContact CG1-CG 4.34Å; V89-Y91 VanDerWaalsContact CG1-CZ 3.43Å; V89-Y91 WeakPolarHBondContact O-CD2 3.34Å; V89-Y91 PolarHBondContact O-N 3.36Å; V89-A113 HydrophobicContact CG1-CB 3.81Å; V89-Y115 HydrophobicContact CG1-CE2 4.37Å; V89-I158 HydrophobicContact CG1-CD1 3.86Å; V89-I158 HydrophobicContact CG1-CG2 4.31Å; V89-I158 HydrophobicContact CG2-CD1 3.91Å
90	E	98.1	Very high	92.3	Very high	112 Å²	112	67.9 Å²	67.9	52%	0.523	35%	0.352	S	S	.	.			trans	-89.7	98.6	176.2	-62.8	-178.9	89.9	0	0	110.9	E88 A113 Y115 K132	E88-E90 PolarHBondContact O-N 3.31Å; E90-A113 WeakPolarHBondContact O-CB 3.22Å; E90-Y115 PolarHBondContact N-OH 2.92Å; E90-Y115 VanDerWaalsContact N-OH 3.12Å; E90-K132 HydrophobicContact CB-CD 4.1Å; E90-K132 IonicContact OE1-NZ 3.99Å; E90-K132 PolarHBondContact OE1-NZ 2.97Å; E90-K132 WeakPolarHBondContact OE2-CE 3.36Å; E90-K132 IonicContact OE2-NZ 3.72Å; E90-K132 PolarHBondContact OE2-NZ 2.82Å
91	Y	96.7	Very high	91.2	Very high	36 Å²	36	66.2 Å²	66.2	14%	0.141	35%	0.348	C	S	.	.			trans	-74.3	149	177.4	-62.2	-79.6	0	0	0	113	V89 K111 Q112 A113 I158 R160	V89-Y91 HydrophobicContact CB-CE2 3.95Å; V89-Y91 HydrophobicContact CG1-CD1 4.11Å; V89-Y91 HydrophobicContact CG1-CD2 4.16Å; V89-Y91 HydrophobicContact CG1-CE1 3.67Å; V89-Y91 HydrophobicContact CG1-CE2 3.72Å; V89-Y91 HydrophobicContact CG1-CG 4.34Å; V89-Y91 VanDerWaalsContact CG1-CZ 3.43Å; V89-Y91 WeakPolarHBondContact O-CD2 3.34Å; V89-Y91 PolarHBondContact O-N 3.36Å; Y91-K111 HydrophobicContact CD1-CB 3.5Å; Y91-K111 HydrophobicContact CD2-CB 4.48Å; Y91-K111 HydrophobicContact CD2-CD 4.03Å; Y91-K111 HydrophobicContact CE1-CB 4.14Å; Y91-K111 HydrophobicContact CG-CB 3.71Å; Y91-K111 HydrophobicContact CG-CD 3.91Å; Y91-K111 HydrophobicContact CG-CG 4.41Å; Y91-Q112 WeakPolarHBondContact CA-O 3.24Å; Y91-A113 HydrophobicContact CD1-CB 4.13Å; Y91-I158 HydrophobicContact CE1-CG2 4.13Å; Y91-R160 HydrophobicContact CD1-CB 4.34Å; Y91-R160 HydrophobicContact CE1-CB 3.44Å; Y91-R160 VanDerWaalsContact CE1-CB 3.44Å; Y91-R160 HydrophobicContact CE1-CG 4.48Å; Y91-R160 HydrophobicContact CE2-CB 4.38Å; Y91-R160 VanDerWaalsContact CZ-CB 3.49Å; Y91-R160 WeakPolarHBondContact OH-CB 3.45Å; Y91-R160 WeakPolarHBondContact OH-CD 3.43Å
92	F	93.3	Very high	90.2	Very high	33 Å²	33	76 Å²	76	15%	0.145	39%	0.39	C	S	.	.			trans	-55.2	146.2	173.5	-63.4	-33.3	0	0	0	112.6	L96 T97 Q112 T114 L129	F92-L96 HydrophobicContact CB-CB 3.77Å; F92-L96 HydrophobicContact CD1-CB 4.47Å; F92-L96 HydrophobicContact CD1-CD1 3.92Å; F92-L96 HydrophobicContact CD2-CB 4.32Å; F92-L96 HydrophobicContact CE1-CD1 4.34Å; F92-L96 HydrophobicContact CG-CB 3.97Å; F92-L96 HydrophobicContact CG-CD1 4.26Å; F92-T97 VanDerWaalsContact O-CG2 3.24Å; F92-T97 WeakPolarHBondContact O-CG2 3.29Å; F92-Q112 HydrophobicContact CD2-CB 3.91Å; F92-Q112 WeakPolarHBondContact CD2-O 3.29Å; F92-Q112 HydrophobicContact CE2-CB 4.2Å; F92-Q112 WeakPolarHBondContact CG-O 3.42Å; F92-Q112 PolarHBondContact N-O 3.32Å; F92-T114 HydrophobicContact CE2-CG2 4.35Å; F92-T114 HydrophobicContact CZ-CG2 3.92Å; F92-T114 WeakPolarHBondContact CZ-OG1 3.31Å; F92-L129 HydrophobicContact CE2-CD1 4.39Å; F92-L129 HydrophobicContact CZ-CD1 4.05Å
93	T	89.8	Confident	89.2	Confident	114 Å²	114	76.7 Å²	76.7	70%	0.699	41%	0.409	S	S	*	.			trans	-130.5	169.6	176.1	61.6	0	0	0	0	110.1	A95 L96	T93-A95 PolarHBondContact O-N 2.97Å; T93-L96 PolarHBondContact O-N 3.36Å
94	G	86.6	Confident	88.4	Confident	56 Å²	56	78.3 Å²	78.3	58%	0.577	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	61	-135.9	175.6	0	0	0	0	0	113.9	L96 T97	G94-L96 PolarHBondContact O-N 3.43Å; G94-T97 PolarHBondContact O-N 2.8Å; G94-T97 VanDerWaalsContact O-N 3.08Å; G94-T97 PolarHBondContact O-OG1 2.63Å
95	A	80.4	Confident	87.7	Confident	77 Å²	77	81.5 Å²	81.5	64%	0.636	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-58	-31.1	-175.3	0	0	0	0	0	113.5	T93 T97 R98	T93-A95 PolarHBondContact O-N 2.97Å; A95-T97 PolarHBondContact O-N 2.87Å; A95-R98 PolarHBondContact O-N 3.25Å; A95-R98 VanDerWaalsContact O-N 3.16Å
96	L	81.7	Confident	87	Confident	55 Å²	55	85.9 Å²	85.9	29%	0.288	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-71	-7.3	-179.8	-60.6	-179.5	0	0	0	113.9	F92 T93 G94 R98 L127 L129	F92-L96 HydrophobicContact CB-CB 3.77Å; F92-L96 HydrophobicContact CD1-CB 4.47Å; F92-L96 HydrophobicContact CD1-CD1 3.92Å; F92-L96 HydrophobicContact CD2-CB 4.32Å; F92-L96 HydrophobicContact CE1-CD1 4.34Å; F92-L96 HydrophobicContact CG-CB 3.97Å; F92-L96 HydrophobicContact CG-CD1 4.26Å; T93-L96 PolarHBondContact O-N 3.36Å; G94-L96 PolarHBondContact O-N 3.43Å; L96-R98 VanDerWaalsContact C-N 3.31Å; L96-L127 HydrophobicContact CD2-CD1 3.8Å; L96-L129 HydrophobicContact CD1-CD2 4.43Å; L96-L129 HydrophobicContact CD2-CD1 4.11Å; L96-L129 HydrophobicContact CD2-CD2 3.78Å
97	T	83.4	Confident	86.5	Confident	56 Å²	56	87 Å²	87	34%	0.344	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-90.9	6.2	173.8	66	0	0	0	0	113.2	F92 G94 A95 V108	F92-T97 VanDerWaalsContact O-CG2 3.24Å; F92-T97 WeakPolarHBondContact O-CG2 3.29Å; G94-T97 PolarHBondContact O-N 2.8Å; G94-T97 VanDerWaalsContact O-N 3.08Å; G94-T97 PolarHBondContact O-OG1 2.63Å; A95-T97 PolarHBondContact O-N 2.87Å; T97-V108 PolarHBondContact O-N 3.44Å
98	R	83.4	Confident	86.1	Confident	121 Å²	121	79.9 Å²	79.9	46%	0.457	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	145.2	179.9	-50.9	-175.1	86.6	172.1	4.1	110.3	A95 L96 W105 H106	A95-R98 PolarHBondContact O-N 3.25Å; A95-R98 VanDerWaalsContact O-N 3.16Å; L96-R98 VanDerWaalsContact C-N 3.31Å; R98-W105 HydrophobicContact CB-CE3 3.76Å; R98-W105 HydrophobicContact CB-CZ3 4.22Å; R98-H106 CarbonylContact C-O 3.57Å; R98-H106 VanDerWaalsContact CA-O 3.22Å; R98-H106 WeakPolarHBondContact CA-O 3.31Å
99	V	80.4	Confident	85.8	Confident	30 Å²	30	78.1 Å²	78.1	18%	0.182	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	145.1	175.7	61.1	0	0	0	0	109.1	V101 H106 V108	V99-V101 HydrophobicContact CG1-CG2 4.04Å; V99-V101 HydrophobicContact CG2-CG2 4.44Å; V99-H106 PolarHBondContact N-O 3.18Å; V99-H106 PolarHBondContact O-N 3.29Å; V99-V108 HydrophobicContact CB-CG2 3.96Å; V99-V108 HydrophobicContact CG1-CG2 3.84Å
100	Q	78.2	Confident	85.7	Confident	101 Å²	101	79.2 Å²	79.2	47%	0.472	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	121.7	174.1	-162.3	-179.8	36.6	0	0	109.9	G103 K104 W105	Q100-G103 PolarHBondContact NE2-O 3.45Å; Q100-G103 VanDerWaalsContact NE2-O 3.12Å; Q100-K104 CarbonylContact C-O 3.54Å; Q100-K104 WeakPolarHBondContact CA-O 3.42Å; Q100-W105 HydrophobicContact CB-CD2 4.45Å; Q100-W105 HydrophobicContact CB-CE3 4.39Å; Q100-W105 HydrophobicContact CB-CZ3 4.44Å
101	V	74.8	Confident	85.7	Confident	61 Å²	61	79.3 Å²	79.3	37%	0.37	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	120.7	177.3	-176.3	0	0	0	0	107.9	V99 G103 K104	V99-V101 HydrophobicContact CG1-CG2 4.04Å; V99-V101 HydrophobicContact CG2-CG2 4.44Å; V101-G103 VanDerWaalsContact C-N 3.26Å; V101-G103 PolarHBondContact O-N 3.39Å; V101-K104 PolarHBondContact N-O 2.93Å; V101-K104 PolarHBondContact O-N 2.94Å
102	F	77.4	Confident	85.6	Confident	205 Å²	205	78 Å²	78	90%	0.899	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	45.1	-174.6	-56.7	-64.9	0	0	0	113.3	K104	F102-K104 PolarHBondContact O-N 3.14Å
103	G	78.7	Confident	85.7	Confident	54 Å²	54	76.4 Å²	76.4	56%	0.557	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	-8.5	179.9	0	0	0	0	0	115.3	Q100 V101	Q100-G103 PolarHBondContact NE2-O 3.45Å; Q100-G103 VanDerWaalsContact NE2-O 3.12Å; V101-G103 VanDerWaalsContact C-N 3.26Å; V101-G103 PolarHBondContact O-N 3.39Å
104	K	81.4	Confident	86	Confident	146 Å²	146	71.2 Å²	71.2	64%	0.635	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	141.7	-177.6	-64.5	-177.3	-179.1	-178.2	0	111.8	Q100 V101 F102 H106	Q100-K104 CarbonylContact C-O 3.54Å; Q100-K104 WeakPolarHBondContact CA-O 3.42Å; V101-K104 PolarHBondContact N-O 2.93Å; V101-K104 PolarHBondContact O-N 2.94Å; F102-K104 PolarHBondContact O-N 3.14Å; K104-H106 WeakPolarHBondContact CB-NE2 3.33Å; K104-H106 PolarHBondContact O-CD2 3.28Å; K104-H106 VanDerWaalsContact O-CD2 3.24Å
105	W	83.8	Confident	86.6	Confident	131 Å²	131	68.6 Å²	68.6	50%	0.496	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	123.1	177.5	-73.2	101	0	0	0	111.5	R98 Q100	R98-W105 HydrophobicContact CB-CE3 3.76Å; R98-W105 HydrophobicContact CB-CZ3 4.22Å; Q100-W105 HydrophobicContact CB-CD2 4.45Å; Q100-W105 HydrophobicContact CB-CE3 4.39Å; Q100-W105 HydrophobicContact CB-CZ3 4.44Å
106	H	84.3	Confident	87.4	Confident	93 Å²	93	65 Å²	65	43%	0.431	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	145.8	177.4	-64.4	-84.2	0	0	0	110.3	R98 V99 K104	R98-H106 CarbonylContact C-O 3.57Å; R98-H106 VanDerWaalsContact CA-O 3.22Å; R98-H106 WeakPolarHBondContact CA-O 3.31Å; V99-H106 PolarHBondContact N-O 3.18Å; V99-H106 PolarHBondContact O-N 3.29Å; K104-H106 WeakPolarHBondContact CB-NE2 3.33Å; K104-H106 PolarHBondContact O-CD2 3.28Å; K104-H106 VanDerWaalsContact O-CD2 3.24Å
107	S	88.1	Confident	88.1	Confident	86 Å²	86	65.5 Å²	65.5	60%	0.601	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	134.7	168.1	-56.2	0	0	0	0	109.4	P109	S107-P109 WeakPolarHBondContact O-CD 3.48Å
108	V	89.8	Confident	88.6	Confident	17 Å²	17	67.8 Å²	67.8	10%	0.103	35%	0.354	C	S	.	.			trans	-65.8	125.1	175	-179.8	0	0	0	0	108.1	T97 V99 R110 Q112	T97-V108 PolarHBondContact O-N 3.44Å; V99-V108 HydrophobicContact CB-CG2 3.96Å; V99-V108 HydrophobicContact CG1-CG2 3.84Å; V108-R110 HydrophobicContact CG1-CG 3.64Å; V108-R110 WeakPolarHBondContact CG1-O 3.33Å; V108-R110 PolarHBondContact O-N 3.16Å; V108-Q112 HydrophobicContact CG1-CG 4.32Å
109	P	93.8	Very high	88.8	Confident	45 Å²	45	65.5 Å²	65.5	29%	0.292	37%	0.367	S	S	.	.	S	Bend	trans	-81	47.2	-175.9	33.9	-36.5	0	0	0	111.8	S107 D166 H167	S107-P109 WeakPolarHBondContact O-CD 3.48Å; P109-D166 CarbonylContact O-C 3.5Å; P109-D166 WeakPolarHBondContact O-CA 3.42Å; P109-D166 WeakPolarHBondContact O-CB 3.46Å; P109-H167 PolarHBondContact O-N 3.24Å
110	R	96.3	Very high	89.3	Confident	35 Å²	35	64.2 Å²	64.2	13%	0.132	36%	0.36	C	S	.	.	S	Bend	trans	179.4	155.1	178.6	53.3	-171.2	-173.9	-70	-13.5	108.7	V108 Q112 N159 R160 Y161 D166 H167 I168	V108-R110 HydrophobicContact CG1-CG 3.64Å; V108-R110 WeakPolarHBondContact CG1-O 3.33Å; V108-R110 PolarHBondContact O-N 3.16Å; R110-Q112 HydrophobicContact CG-CG 4.42Å; R110-N159 WeakPolarHBondContact CD-OD1 3.3Å; R110-N159 PolarHBondContact NE-OD1 2.72Å; R110-R160 WeakPolarHBondContact CB-O 3.37Å; R110-Y161 HydrophobicContact CB-CD1 4.09Å; R110-Y161 HydrophobicContact CB-CE1 4.17Å; R110-Y161 VanDerWaalsContact CD-CE1 3.47Å; R110-Y161 HydrophobicContact CG-CE1 4.43Å; R110-D166 HydrophobicContact CB-CB 4.47Å; R110-H167 PolarHBondContact NH1-O 3.18Å; R110-I168 VanDerWaalsContact CZ-CD1 3.47Å; R110-I168 VanDerWaalsContact NH2-CD1 3.27Å
111	K	97	Very high	89.7	Confident	113 Å²	113	61.5 Å²	61.5	49%	0.491	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	148.2	169.7	-67.8	-175	176	-175.2	0	110.2	Y91 N159 R160	Y91-K111 HydrophobicContact CD1-CB 3.5Å; Y91-K111 HydrophobicContact CD2-CB 4.48Å; Y91-K111 HydrophobicContact CD2-CD 4.03Å; Y91-K111 HydrophobicContact CE1-CB 4.14Å; Y91-K111 HydrophobicContact CG-CB 3.71Å; Y91-K111 HydrophobicContact CG-CD 3.91Å; Y91-K111 HydrophobicContact CG-CG 4.41Å; K111-N159 WeakPolarHBondContact O-CA 3.46Å; K111-R160 HydrophobicContact CB-CB 4.24Å; K111-R160 PolarHBondContact N-O 3.03Å; K111-R160 PolarHBondContact O-N 2.96Å
112	Q	95.4	Very high	90.1	Very high	8 Å²	8	59.2 Å²	59.2	4%	0.037	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	150.2	179.1	-58.7	-171.9	-84.2	0	0	111.4	Y91 F92 V108 R110 I158 N159	Y91-Q112 WeakPolarHBondContact CA-O 3.24Å; F92-Q112 HydrophobicContact CD2-CB 3.91Å; F92-Q112 WeakPolarHBondContact CD2-O 3.29Å; F92-Q112 HydrophobicContact CE2-CB 4.2Å; F92-Q112 WeakPolarHBondContact CG-O 3.42Å; F92-Q112 PolarHBondContact N-O 3.32Å; V108-Q112 HydrophobicContact CG1-CG 4.32Å; R110-Q112 HydrophobicContact CG-CG 4.42Å; Q112-I158 VanDerWaalsContact CA-O 3.23Å; Q112-I158 WeakPolarHBondContact CA-O 3.12Å; Q112-N159 PolarHBondContact NE2-OD1 3.3Å; Q112-N159 VanDerWaalsContact NE2-OD1 3.08Å
113	A	95.8	Very high	90.2	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	157.6	171.6	0	0	0	0	0	109.3	V89 E90 Y91 Y115 I158	V89-A113 HydrophobicContact CG1-CB 3.81Å; E90-A113 WeakPolarHBondContact O-CB 3.22Å; Y91-A113 HydrophobicContact CD1-CB 4.13Å; A113-Y115 HydrophobicContact CB-CD2 4.46Å; A113-Y115 HydrophobicContact CB-CE2 4.06Å; A113-I158 HydrophobicContact CB-CB 4.24Å; A113-I158 PolarHBondContact N-O 3.37Å; A113-I158 PolarHBondContact O-N 2.85Å
114	T	96.1	Very high	89.8	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.031	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	133.8	176.3	54.3	0	0	0	0	110.9	F92 K132 F155 V156 L157	F92-T114 HydrophobicContact CE2-CG2 4.35Å; F92-T114 HydrophobicContact CZ-CG2 3.92Å; F92-T114 WeakPolarHBondContact CZ-OG1 3.31Å; T114-K132 PolarHBondContact O-N 3.34Å; T114-F155 HydrophobicContact CG2-CE2 4.01Å; T114-F155 HydrophobicContact CG2-CZ 3.56Å; T114-V156 WeakPolarHBondContact CA-O 3.31Å; T114-L157 HydrophobicContact CG2-CD1 3.77Å
115	Y	98	Very high	89.2	Confident	1 Å²	1	46.7 Å²	46.7	0%	0.004	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	151.6	176.9	-71.9	-106.6	0	0	0	109.5	V89 E90 A113 K132 P133 I135 L138 F155 V156 I158	V89-Y115 HydrophobicContact CG1-CE2 4.37Å; E90-Y115 PolarHBondContact N-OH 2.92Å; E90-Y115 VanDerWaalsContact N-OH 3.12Å; A113-Y115 HydrophobicContact CB-CD2 4.46Å; A113-Y115 HydrophobicContact CB-CE2 4.06Å; Y115-K132 CarbonylContact C-O 3.58Å; Y115-K132 WeakPolarHBondContact CA-O 3.38Å; Y115-K132 HydrophobicContact CD1-CB 3.65Å; Y115-K132 HydrophobicContact CD2-CB 4.45Å; Y115-K132 HydrophobicContact CE1-CB 3.59Å; Y115-K132 HydrophobicContact CE1-CD 4.18Å; Y115-K132 HydrophobicContact CE2-CB 4.39Å; Y115-K132 HydrophobicContact CE2-CD 4.17Å; Y115-K132 HydrophobicContact CG-CB 4.08Å; Y115-P133 WeakPolarHBondContact CD1-O 3.41Å; Y115-P133 WeakPolarHBondContact CE1-O 3.23Å; Y115-I135 HydrophobicContact CE1-CD1 4.49Å; Y115-I135 HydrophobicContact CE1-CG1 4.27Å; Y115-I135 HydrophobicContact CE1-CG2 3.99Å; Y115-L138 HydrophobicContact CD1-CD1 3.6Å; Y115-L138 HydrophobicContact CD2-CD1 3.63Å; Y115-L138 HydrophobicContact CE1-CD1 4.16Å; Y115-L138 HydrophobicContact CE2-CD1 4.17Å; Y115-L138 HydrophobicContact CG-CD1 3.33Å; Y115-F155 CarbonylContact O-C 3.51Å; Y115-F155 WeakPolarHBondContact O-CA 3.39Å; Y115-V156 PolarHBondContact N-O 3.38Å; Y115-V156 VanDerWaalsContact N-O 3.12Å; Y115-V156 PolarHBondContact O-N 3.46Å; Y115-I158 HydrophobicContact CD2-CD1 3.82Å; Y115-I158 HydrophobicContact CE2-CD1 4.11Å
116	G	97.4	Very high	88.4	Confident	2 Å²	2	43.7 Å²	43.7	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.9	174.3	-171.8	0	0	0	0	0	114.3	K132 W134 N154	G116-K132 PolarHBondContact N-O 2.86Å; G116-W134 VanDerWaalsContact C-NE1 3.26Å; G116-N154 CarbonylContact C-O 3.58Å; G116-N154 WeakPolarHBondContact CA-O 3.23Å
117	D	96.9	Very high	87.8	Confident	65 Å²	65	42.7 Å²	42.7	35%	0.348	28%	0.282	S	S	.	.			trans	-62.8	150.8	178.2	-64.9	0.6	0	0	0	111.6	G119 L120 W134 N154	D117-G119 PolarHBondContact O-N 2.91Å; D117-L120 HydrophobicContact CB-CD1 3.91Å; D117-L120 HydrophobicContact CB-CG 4.32Å; D117-L120 WeakPolarHBondContact O-CB 3.48Å; D117-L120 PolarHBondContact O-N 2.83Å; D117-W134 PolarHBondContact OD1-NE1 2.87Å; D117-N154 HydrophobicContact CB-CB 4.32Å; D117-N154 PolarHBondContact N-O 3.2Å; D117-N154 WeakPolarHBondContact OD2-CB 3.36Å
118	A	92.7	Very high	87.5	Confident	105 Å²	105	42.9 Å²	42.9	87%	0.868	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	137	178	0	0	0	0	0	111.4	L120	A118-L120 VanDerWaalsContact C-N 3.33Å
119	G	88.3	Confident	87.1	Confident	72 Å²	72	43.5 Å²	43.5	74%	0.742	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	-0.9	178.5	0	0	0	0	0	115.2	D117	D117-G119 PolarHBondContact O-N 2.91Å
120	L	90.8	Very high	86.9	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.021	30%	0.299	C	S	.	.			trans	-73.4	149	171.1	-72	176	0	0	0	112.3	D117 A118 P131 N154 F155 I256 L258	D117-L120 HydrophobicContact CB-CD1 3.91Å; D117-L120 HydrophobicContact CB-CG 4.32Å; D117-L120 WeakPolarHBondContact O-CB 3.48Å; D117-L120 PolarHBondContact O-N 2.83Å; A118-L120 VanDerWaalsContact C-N 3.33Å; L120-P131 HydrophobicContact CB-CG 3.92Å; L120-P131 WeakPolarHBondContact O-CD 3.33Å; L120-N154 HydrophobicContact CD1-CB 3.99Å; L120-N154 WeakPolarHBondContact CD1-O 3.42Å; L120-F155 HydrophobicContact CD1-CB 4.43Å; L120-I256 HydrophobicContact CD2-CB 4.35Å; L120-I256 HydrophobicContact CD2-CG2 4.21Å; L120-L258 HydrophobicContact CD2-CD2 3.68Å
121	T	86.6	Confident	86.8	Confident	43 Å²	43	44.8 Å²	44.8	26%	0.264	30%	0.298	S	S	.	.			trans	-131.6	148.4	165.3	59.2	0	0	0	0	108.6	T128 L129 T259	T121-T128 HydrophobicContact CG2-CG2 4.37Å; T121-L129 WeakPolarHBondContact CA-O 3.38Å; T121-T259 PolarHBondContact OG1-OG1 3.22Å
122	Y	82.7	Confident	86.8	Confident	14 Å²	14	42.7 Å²	42.7	6%	0.055	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	133.9	-178.8	172.5	-110.5	0	0	0	109.7	F124 T128 L129 F155 E177 R254 I256	Y122-F124 HydrophobicContact CD1-CB 4.19Å; Y122-F124 HydrophobicContact CE1-CB 3.72Å; Y122-F124 HydrophobicContact CE1-CD2 4.19Å; Y122-F124 HydrophobicContact CE1-CG 4.36Å; Y122-T128 WeakPolarHBondContact O-CA 3.29Å; Y122-L129 PolarHBondContact N-O 2.74Å; Y122-L129 PolarHBondContact O-N 3.07Å; Y122-F155 HydrophobicContact CD1-CE2 4.22Å; Y122-F155 AromaticContact CD1-CZ 3.67Å; Y122-F155 HydrophobicContact CD1-CZ 3.67Å; Y122-F155 HydrophobicContact CD2-CZ 4.26Å; Y122-F155 HydrophobicContact CE1-CZ 4.15Å; Y122-F155 HydrophobicContact CG-CE1 4.48Å; Y122-F155 AromaticContact CG-CE2 4Å; Y122-F155 HydrophobicContact CG-CE2 4Å; Y122-F155 AromaticContact CG-CZ 3.73Å; Y122-F155 HydrophobicContact CG-CZ 3.73Å; Y122-E177 WeakPolarHBondContact CD2-OE2 3.35Å; Y122-E177 WeakPolarHBondContact CE2-OE2 3.21Å; Y122-R254 PolarHBondContact OH-NH1 3.32Å; Y122-I256 HydrophobicContact CD2-CD1 3.95Å; Y122-I256 HydrophobicContact CE2-CD1 4.4Å
123	T	80.9	Confident	86.9	Confident	44 Å²	44	47.4 Å²	47.4	27%	0.27	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	118	178.6	-47.8	0	0	0	0	110.9	L127 T128 E177	T123-L127 WeakPolarHBondContact CA-O 3.25Å; T123-T128 PolarHBondContact OG1-OG1 2.7Å; T123-E177 WeakPolarHBondContact CB-OE1 3.5Å; T123-E177 PolarHBondContact N-OE1 3.47Å; T123-E177 PolarHBondContact N-OE2 2.81Å; T123-E177 PolarHBondContact OG1-OE1 3.03Å
124	F	70.8	Confident	87	Confident	45 Å²	45	49.1 Å²	49.1	20%	0.197	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	119.9	174.4	-174.6	-108.3	0	0	0	110.9	Y122 G126 L127	Y122-F124 HydrophobicContact CD1-CB 4.19Å; Y122-F124 HydrophobicContact CE1-CB 3.72Å; Y122-F124 HydrophobicContact CE1-CD2 4.19Å; Y122-F124 HydrophobicContact CE1-CG 4.36Å; F124-G126 PolarHBondContact O-N 3.4Å; F124-G126 VanDerWaalsContact O-N 3.17Å; F124-L127 PolarHBondContact N-O 3.2Å; F124-L127 WeakPolarHBondContact O-CB 3.25Å; F124-L127 PolarHBondContact O-N 3.23Å
125	S	67.1	Low	87.1	Confident	52 Å²	52	50.4 Å²	50.4	36%	0.364	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	35.2	179.1	-170.2	0	0	0	0	113.7	L127	S125-L127 VanDerWaalsContact C-N 3.31Å
126	G	68.1	Low	87.2	Confident	69 Å²	69	54.8 Å²	54.8	71%	0.711	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	0.5	-178.2	0	0	0	0	0	114.9	F124	F124-G126 PolarHBondContact O-N 3.4Å; F124-G126 VanDerWaalsContact O-N 3.17Å
127	L	71.4	Confident	87.3	Confident	72 Å²	72	54.8 Å²	54.8	38%	0.377	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	116.8	174	-60.9	174.1	0	0	0	109.4	L96 T123 F124 S125 L129	L96-L127 HydrophobicContact CD2-CD1 3.8Å; T123-L127 WeakPolarHBondContact CA-O 3.25Å; F124-L127 PolarHBondContact N-O 3.2Å; F124-L127 WeakPolarHBondContact O-CB 3.25Å; F124-L127 PolarHBondContact O-N 3.23Å; S125-L127 VanDerWaalsContact C-N 3.31Å; L127-L129 HydrophobicContact CB-CD2 4.35Å; L127-L129 HydrophobicContact CB-CG 4.45Å
128	T	80.9	Confident	87.3	Confident	89 Å²	89	51.7 Å²	51.7	55%	0.546	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	120.4	170.8	-55.7	0	0	0	0	109	T121 Y122 T123	T121-T128 HydrophobicContact CG2-CG2 4.37Å; Y122-T128 WeakPolarHBondContact O-CA 3.29Å; T123-T128 PolarHBondContact OG1-OG1 2.7Å
129	L	82.6	Confident	87.6	Confident	31 Å²	31	50.1 Å²	50.1	16%	0.162	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	141	-176.2	-57.1	175.7	0	0	0	109.7	F92 L96 T121 Y122 L127	F92-L129 HydrophobicContact CE2-CD1 4.39Å; F92-L129 HydrophobicContact CZ-CD1 4.05Å; L96-L129 HydrophobicContact CD1-CD2 4.43Å; L96-L129 HydrophobicContact CD2-CD1 4.11Å; L96-L129 HydrophobicContact CD2-CD2 3.78Å; T121-L129 WeakPolarHBondContact CA-O 3.38Å; Y122-L129 PolarHBondContact N-O 2.74Å; Y122-L129 PolarHBondContact O-N 3.07Å; L127-L129 HydrophobicContact CB-CD2 4.35Å; L127-L129 HydrophobicContact CB-CG 4.45Å
130	S	89.1	Confident	88.1	Confident	91 Å²	91	51.2 Å²	51.2	64%	0.636	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-84.7	129.7	165	-57	0	0	0	0	108.8
131	P	94.1	Very high	88.5	Confident	16 Å²	16	51 Å²	51	10%	0.104	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-66.3	153.2	174.4	30	-32.5	0	0	0	110.4	L120 F155	L120-P131 HydrophobicContact CB-CG 3.92Å; L120-P131 WeakPolarHBondContact O-CD 3.33Å; P131-F155 HydrophobicContact CB-CD2 4.12Å; P131-F155 HydrophobicContact CB-CE2 4.07Å; P131-F155 HydrophobicContact CG-CD2 4.27Å
132	K	96.7	Very high	89.1	Confident	69 Å²	69	50.4 Å²	50.4	30%	0.3	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-66.6	151.3	171.5	-74.2	173.9	170.3	-81.8	0	110.3	E90 T114 Y115 G116	E90-K132 HydrophobicContact CB-CD 4.1Å; E90-K132 IonicContact OE1-NZ 3.99Å; E90-K132 PolarHBondContact OE1-NZ 2.97Å; E90-K132 WeakPolarHBondContact OE2-CE 3.36Å; E90-K132 IonicContact OE2-NZ 3.72Å; E90-K132 PolarHBondContact OE2-NZ 2.82Å; T114-K132 PolarHBondContact O-N 3.34Å; Y115-K132 CarbonylContact C-O 3.58Å; Y115-K132 WeakPolarHBondContact CA-O 3.38Å; Y115-K132 HydrophobicContact CD1-CB 3.65Å; Y115-K132 HydrophobicContact CD2-CB 4.45Å; Y115-K132 HydrophobicContact CE1-CB 3.59Å; Y115-K132 HydrophobicContact CE1-CD 4.18Å; Y115-K132 HydrophobicContact CE2-CB 4.39Å; Y115-K132 HydrophobicContact CE2-CD 4.17Å; Y115-K132 HydrophobicContact CG-CB 4.08Å; G116-K132 PolarHBondContact N-O 2.86Å
133	P	98	Very high	89.9	Confident	107 Å²	107	53.8 Å²	53.8	70%	0.695	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-59.7	141.8	172	-19.6	31.5	0	0	0	110.8	Y115	Y115-P133 WeakPolarHBondContact CD1-O 3.41Å; Y115-P133 WeakPolarHBondContact CE1-O 3.23Å
134	W	98.6	Very high	90.7	Very high	36 Å²	36	57.2 Å²	57.2	14%	0.136	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-50.3	143.8	176.4	-65	111.9	0	0	0	113.1	G116 D117 L138 E139 V156 F253	G116-W134 VanDerWaalsContact C-NE1 3.26Å; D117-W134 PolarHBondContact OD1-NE1 2.87Å; W134-L138 HydrophobicContact CE3-CB 3.68Å; W134-L138 HydrophobicContact CE3-CD1 4.26Å; W134-L138 HydrophobicContact CZ3-CB 3.96Å; W134-L138 HydrophobicContact CZ3-CD1 4.5Å; W134-E139 HydrophobicContact CB-CG 3.61Å; W134-E139 HydrophobicContact CG-CG 4.16Å; W134-V156 HydrophobicContact CE3-CG1 4.37Å; W134-V156 HydrophobicContact CH2-CB 3.87Å; W134-V156 HydrophobicContact CH2-CG1 3.69Å; W134-V156 HydrophobicContact CZ3-CB 3.97Å; W134-V156 HydrophobicContact CZ3-CG1 3.35Å; W134-F253 HydrophobicContact CH2-CD1 4.14Å; W134-F253 AromaticContact CH2-CE1 3.95Å; W134-F253 HydrophobicContact CH2-CE1 3.95Å; W134-F253 AromaticContact CZ3-CE1 3.95Å; W134-F253 HydrophobicContact CZ3-CE1 3.95Å
135	I	98.7	Very high	92	Very high	32 Å²	32	55 Å²	55	16%	0.164	31%	0.31	C	S	.	.			trans	-111.2	154.1	169.3	57.1	171.7	0	0	0	109.3	E88 Y115 V137 L138 E139	E88-I135 HydrophobicContact CB-CD1 3.63Å; Y115-I135 HydrophobicContact CE1-CD1 4.49Å; Y115-I135 HydrophobicContact CE1-CG1 4.27Å; Y115-I135 HydrophobicContact CE1-CG2 3.99Å; I135-V137 VanDerWaalsContact C-N 3.31Å; I135-V137 HydrophobicContact CD1-CG1 3.68Å; I135-V137 HydrophobicContact CG1-CG1 3.95Å; I135-V137 PolarHBondContact O-N 2.84Å; I135-V137 VanDerWaalsContact O-N 3.14Å; I135-L138 HydrophobicContact CD1-CD1 4.14Å; I135-L138 HydrophobicContact CD1-CG 4.06Å; I135-L138 HydrophobicContact CG1-CB 4.17Å; I135-L138 HydrophobicContact CG1-CD1 3.65Å; I135-L138 HydrophobicContact CG1-CG 3.56Å; I135-L138 WeakPolarHBondContact O-CB 3.49Å; I135-L138 PolarHBondContact O-N 2.8Å; I135-E139 PolarHBondContact O-N 2.98Å; I135-E139 VanDerWaalsContact O-N 3.16Å
136	P	98.8	Very high	93.5	Very high	93 Å²	93	53.7 Å²	53.7	60%	0.604	30%	0.3	S	S	*	.	H	α-helix	trans	-53.5	-41.1	-169.2	-29.9	36.7	0	0	0	114.8	L138 E139 R140	P136-L138 VanDerWaalsContact C-N 3.3Å; P136-L138 PolarHBondContact O-N 3.04Å; P136-E139 PolarHBondContact O-N 3.23Å; P136-R140 WeakPolarHBondContact O-CB 3.48Å; P136-R140 PolarHBondContact O-N 2.82Å
137	V	98.8	Very high	95	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.012	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-36.8	177.9	63.8	0	0	0	0	112.5	I81 E84 L85 I135 I141	I81-V137 HydrophobicContact CG2-CG2 4.02Å; E84-V137 HydrophobicContact CB-CB 4.11Å; E84-V137 HydrophobicContact CB-CG1 4.48Å; E84-V137 HydrophobicContact CB-CG2 3.82Å; E84-V137 WeakPolarHBondContact OE2-CB 3.14Å; E84-V137 VanDerWaalsContact OE2-CG2 3.25Å; E84-V137 WeakPolarHBondContact OE2-CG2 3.32Å; L85-V137 HydrophobicContact CD2-CG1 4.09Å; L85-V137 HydrophobicContact CD2-CG2 4.18Å; L85-V137 HydrophobicContact CG-CG2 4.16Å; I135-V137 VanDerWaalsContact C-N 3.31Å; I135-V137 HydrophobicContact CD1-CG1 3.68Å; I135-V137 HydrophobicContact CG1-CG1 3.95Å; I135-V137 PolarHBondContact O-N 2.84Å; I135-V137 VanDerWaalsContact O-N 3.14Å; V137-I141 HydrophobicContact CG2-CD1 4.22Å; V137-I141 VanDerWaalsContact O-CD1 3.31Å; V137-I141 WeakPolarHBondContact O-CD1 3.32Å; V137-I141 WeakPolarHBondContact O-CG1 3.48Å; V137-I141 PolarHBondContact O-N 2.83Å
138	L	98.9	Very high	96.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-73.9	-36.9	179	-61.2	-178.1	0	0	0	111.7	L85 Y115 W134 I135 P136 I141 R142 V156 I158 L251	L85-L138 HydrophobicContact CD2-CD2 3.59Å; Y115-L138 HydrophobicContact CD1-CD1 3.6Å; Y115-L138 HydrophobicContact CD2-CD1 3.63Å; Y115-L138 HydrophobicContact CE1-CD1 4.16Å; Y115-L138 HydrophobicContact CE2-CD1 4.17Å; Y115-L138 HydrophobicContact CG-CD1 3.33Å; W134-L138 HydrophobicContact CE3-CB 3.68Å; W134-L138 HydrophobicContact CE3-CD1 4.26Å; W134-L138 HydrophobicContact CZ3-CB 3.96Å; W134-L138 HydrophobicContact CZ3-CD1 4.5Å; I135-L138 HydrophobicContact CD1-CD1 4.14Å; I135-L138 HydrophobicContact CD1-CG 4.06Å; I135-L138 HydrophobicContact CG1-CB 4.17Å; I135-L138 HydrophobicContact CG1-CD1 3.65Å; I135-L138 HydrophobicContact CG1-CG 3.56Å; I135-L138 WeakPolarHBondContact O-CB 3.49Å; I135-L138 PolarHBondContact O-N 2.8Å; P136-L138 VanDerWaalsContact C-N 3.3Å; P136-L138 PolarHBondContact O-N 3.04Å; L138-I141 PolarHBondContact O-N 2.81Å; L138-R142 WeakPolarHBondContact O-CB 3.46Å; L138-R142 PolarHBondContact O-N 2.94Å; L138-V156 HydrophobicContact CD1-CG1 4.36Å; L138-I158 HydrophobicContact CD1-CD1 3.92Å; L138-I158 HydrophobicContact CD2-CD1 3.81Å; L138-L251 HydrophobicContact CD2-CD2 3.41Å; L138-L251 VanDerWaalsContact CD2-CD2 3.41Å
139	E	98.8	Very high	97.1	Very high	72 Å²	72	49.7 Å²	49.7	34%	0.336	28%	0.279	S	S	.	.	H	α-helix	trans	-64.7	-45.6	173.5	-61.1	-158.8	99	0	0	111.2	W134 I135 P136 I141 R142 D143	W134-E139 HydrophobicContact CB-CG 3.61Å; W134-E139 HydrophobicContact CG-CG 4.16Å; I135-E139 PolarHBondContact O-N 2.98Å; I135-E139 VanDerWaalsContact O-N 3.16Å; P136-E139 PolarHBondContact O-N 3.23Å; E139-I141 VanDerWaalsContact C-N 3.28Å; E139-I141 PolarHBondContact O-N 2.79Å; E139-R142 WeakPolarHBondContact O-CB 3.48Å; E139-R142 PolarHBondContact O-N 2.88Å; E139-R142 VanDerWaalsContact O-N 3.14Å; E139-R142 IonicContact OE1-CZ 2.87Å; E139-R142 IonicContact OE1-NH1 2.77Å; E139-R142 PolarHBondContact OE1-NH1 3.23Å; E139-R142 IonicContact OE1-NH2 3.83Å; E139-R142 PolarHBondContact OE1-NH2 2.97Å; E139-D143 WeakPolarHBondContact O-CB 3.4Å; E139-D143 PolarHBondContact O-N 2.82Å
140	R	98.8	Very high	97.8	Very high	94 Å²	94	51.3 Å²	51.3	36%	0.355	30%	0.304	S	S	.	.	H	α-helix	trans	-52.5	-47	174.5	179.4	-177.1	176	179.1	2.6	111.7	E77 P136 R144	E77-R140 IonicContact OE1-CZ 3Å; E77-R140 IonicContact OE1-NE 2.93Å; E77-R140 IonicContact OE1-NH2 3.59Å; E77-R140 PolarHBondContact OE1-NH2 2.72Å; P136-R140 WeakPolarHBondContact O-CB 3.48Å; P136-R140 PolarHBondContact O-N 2.82Å; R140-R144 VanDerWaalsContact O-CB 3.29Å; R140-R144 WeakPolarHBondContact O-CB 3.36Å; R140-R144 PolarHBondContact O-N 3.13Å
141	I	98.9	Very high	98.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67	-47.8	178.6	-61.1	158.6	0	0	0	110.6	F73 I81 L85 V137 L138 E139 D143 R144 V145 V187 F189 L251 F253	F73-I141 HydrophobicContact CE2-CG2 4.28Å; F73-I141 HydrophobicContact CZ-CB 4.36Å; F73-I141 HydrophobicContact CZ-CG1 4.38Å; F73-I141 HydrophobicContact CZ-CG2 3.94Å; I81-I141 HydrophobicContact CD1-CG1 4.34Å; I81-I141 HydrophobicContact CG2-CD1 3.63Å; I81-I141 HydrophobicContact CG2-CG1 4.05Å; L85-I141 HydrophobicContact CD1-CD1 4.28Å; L85-I141 HydrophobicContact CD2-CD1 4.28Å; V137-I141 HydrophobicContact CG2-CD1 4.22Å; V137-I141 VanDerWaalsContact O-CD1 3.31Å; V137-I141 WeakPolarHBondContact O-CD1 3.32Å; V137-I141 WeakPolarHBondContact O-CG1 3.48Å; V137-I141 PolarHBondContact O-N 2.83Å; L138-I141 PolarHBondContact O-N 2.81Å; E139-I141 VanDerWaalsContact C-N 3.28Å; E139-I141 PolarHBondContact O-N 2.79Å; I141-D143 VanDerWaalsContact C-N 3.34Å; I141-D143 PolarHBondContact O-N 2.86Å; I141-R144 PolarHBondContact O-N 2.8Å; I141-V145 HydrophobicContact CG2-CG2 4.45Å; I141-V145 VanDerWaalsContact O-CG2 3.31Å; I141-V145 WeakPolarHBondContact O-CG2 3.43Å; I141-V145 PolarHBondContact O-N 2.79Å; I141-V187 HydrophobicContact CG2-CB 4.34Å; I141-V187 HydrophobicContact CG2-CG1 4.14Å; I141-V187 HydrophobicContact CG2-CG2 4.13Å; I141-F189 HydrophobicContact CD1-CE2 3.83Å; I141-F189 HydrophobicContact CD1-CZ 4.19Å; I141-F189 HydrophobicContact CG1-CE2 4.3Å; I141-F189 HydrophobicContact CG1-CZ 4.22Å; I141-L251 HydrophobicContact CD1-CD2 3.62Å; I141-L251 HydrophobicContact CG2-CD2 4.41Å; I141-F253 HydrophobicContact CB-CE2 4.46Å; I141-F253 HydrophobicContact CB-CZ 4.09Å; I141-F253 HydrophobicContact CG2-CE2 3.58Å; I141-F253 HydrophobicContact CG2-CZ 3.71Å
142	R	98.8	Very high	98.4	Very high	31 Å²	31	53.7 Å²	53.7	12%	0.117	31%	0.309	C	S	.	.	H	α-helix	trans	-55.8	-48.7	179.1	179.9	-165.6	65.1	-153.4	-8.2	111.1	L138 E139 V145 S146 F153 F253	L138-R142 WeakPolarHBondContact O-CB 3.46Å; L138-R142 PolarHBondContact O-N 2.94Å; E139-R142 WeakPolarHBondContact O-CB 3.48Å; E139-R142 PolarHBondContact O-N 2.88Å; E139-R142 VanDerWaalsContact O-N 3.14Å; E139-R142 IonicContact OE1-CZ 2.87Å; E139-R142 IonicContact OE1-NH1 2.77Å; E139-R142 PolarHBondContact OE1-NH1 3.23Å; E139-R142 IonicContact OE1-NH2 3.83Å; E139-R142 PolarHBondContact OE1-NH2 2.97Å; R142-V145 PolarHBondContact O-N 2.7Å; R142-S146 WeakPolarHBondContact O-CB 3.08Å; R142-S146 PolarHBondContact O-N 2.85Å; R142-S146 PolarHBondContact O-OG 2.83Å; R142-F153 WeakPolarHBondContact CD-O 3.31Å; R142-F253 HydrophobicContact CB-CD1 4.31Å; R142-F253 HydrophobicContact CB-CE1 3.72Å; R142-F253 HydrophobicContact CB-CZ 4.28Å; R142-F253 HydrophobicContact CG-CD1 4.4Å; R142-F253 HydrophobicContact CG-CE1 4.27Å
143	D	98.8	Very high	98.5	Very high	85 Å²	85	51 Å²	51	46%	0.455	30%	0.297	S	S	.	.	H	α-helix	trans	-70.8	-37.4	-174.7	-63.5	-6	0	0	0	110.3	E139 I141 S146 G147	E139-D143 WeakPolarHBondContact O-CB 3.4Å; E139-D143 PolarHBondContact O-N 2.82Å; I141-D143 VanDerWaalsContact C-N 3.34Å; I141-D143 PolarHBondContact O-N 2.86Å; D143-S146 PolarHBondContact O-N 2.8Å; D143-G147 PolarHBondContact O-N 2.86Å
144	R	98.6	Very high	98.5	Very high	115 Å²	115	46.8 Å²	46.8	43%	0.434	27%	0.268	S	S	.	.	H	α-helix	trans	-62.6	-45.3	173	-177.4	58.2	171.4	164.8	-0.9	112.3	L72 F73 R140 I141 S146 V148	L72-R144 HydrophobicContact CD2-CG 4.27Å; L72-R144 HydrophobicContact CG-CG 4.31Å; F73-R144 HydrophobicContact CD1-CG 4.47Å; F73-R144 HydrophobicContact CE1-CB 3.98Å; F73-R144 HydrophobicContact CE1-CG 3.63Å; F73-R144 HydrophobicContact CZ-CB 4Å; F73-R144 HydrophobicContact CZ-CG 3.8Å; R140-R144 VanDerWaalsContact O-CB 3.29Å; R140-R144 WeakPolarHBondContact O-CB 3.36Å; R140-R144 PolarHBondContact O-N 3.13Å; I141-R144 PolarHBondContact O-N 2.8Å; R144-S146 VanDerWaalsContact C-N 3.34Å; R144-V148 WeakPolarHBondContact O-CG2 3.41Å; R144-V148 PolarHBondContact O-N 3.14Å
145	V	98.7	Very high	98.4	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-44.4	175.1	174.1	0	0	0	0	110.1	L72 I141 R142 V148 T149 F153 A185 V187 L223	L72-V145 HydrophobicContact CD2-CG2 3.73Å; I141-V145 HydrophobicContact CG2-CG2 4.45Å; I141-V145 VanDerWaalsContact O-CG2 3.31Å; I141-V145 WeakPolarHBondContact O-CG2 3.43Å; I141-V145 PolarHBondContact O-N 2.79Å; R142-V145 PolarHBondContact O-N 2.7Å; V145-V148 PolarHBondContact O-N 3.37Å; V145-T149 HydrophobicContact CG1-CG2 4.32Å; V145-T149 WeakPolarHBondContact O-CB 3.47Å; V145-T149 WeakPolarHBondContact O-CG2 3.4Å; V145-T149 PolarHBondContact O-N 2.84Å; V145-T149 PolarHBondContact O-OG1 3.48Å; V145-F153 HydrophobicContact CG1-CD2 4.46Å; V145-F153 HydrophobicContact CG1-CE2 3.74Å; V145-F153 HydrophobicContact CG1-CZ 4.44Å; V145-A185 HydrophobicContact CG1-CB 3.91Å; V145-V187 HydrophobicContact CG2-CG2 3.71Å; V145-L223 HydrophobicContact CG1-CD1 4.32Å; V145-L223 HydrophobicContact CG1-CD2 4.29Å; V145-L223 HydrophobicContact CG2-CD1 4.41Å
146	S	98.6	Very high	98.4	Very high	23 Å²	23	43.5 Å²	43.5	16%	0.161	25%	0.254	C	S	.	.	H	α-helix	trans	-64.6	-45	-178.2	-54.8	0	0	0	0	111.9	R142 D143 R144 V148 T149 G150 Q151	R142-S146 WeakPolarHBondContact O-CB 3.08Å; R142-S146 PolarHBondContact O-N 2.85Å; R142-S146 PolarHBondContact O-OG 2.83Å; D143-S146 PolarHBondContact O-N 2.8Å; R144-S146 VanDerWaalsContact C-N 3.34Å; S146-V148 VanDerWaalsContact C-N 3.3Å; S146-V148 PolarHBondContact O-N 2.92Å; S146-T149 PolarHBondContact O-N 2.87Å; S146-G150 WeakPolarHBondContact O-CA 3.45Å; S146-G150 PolarHBondContact O-N 2.79Å; S146-Q151 WeakPolarHBondContact CA-O 3.31Å; S146-Q151 WeakPolarHBondContact CB-O 3.41Å; S146-Q151 PolarHBondContact OG-O 2.87Å; S146-Q151 VanDerWaalsContact OG-O 3.13Å
147	G	98.4	Very high	98.3	Very high	70 Å²	70	39.6 Å²	39.6	72%	0.722	23%	0.228	S	C	*	.	H	α-helix	trans	-64	-32.4	178.8	0	0	0	0	0	113.7	D143	D143-G147 PolarHBondContact O-N 2.86Å
148	V	98.1	Very high	98.3	Very high	43 Å²	43	39.5 Å²	39.5	26%	0.261	23%	0.227	S	C	.	.	H	α-helix	trans	-85.6	-29.4	-179.9	167.5	0	0	0	0	112.8	P55 W57 L72 R144 V145 S146	P55-V148 HydrophobicContact CG-CG1 3.87Å; W57-V148 HydrophobicContact CH2-CG1 4.34Å; W57-V148 HydrophobicContact CZ2-CG1 3.67Å; L72-V148 HydrophobicContact CD1-CB 4.21Å; L72-V148 HydrophobicContact CD1-CG1 4.03Å; L72-V148 HydrophobicContact CD1-CG2 3.96Å; R144-V148 WeakPolarHBondContact O-CG2 3.41Å; R144-V148 PolarHBondContact O-N 3.14Å; V145-V148 PolarHBondContact O-N 3.37Å; S146-V148 VanDerWaalsContact C-N 3.3Å; S146-V148 PolarHBondContact O-N 2.92Å
149	T	97.9	Very high	98.2	Very high	33 Å²	33	39.8 Å²	39.8	20%	0.202	23%	0.229	C	C	.	.	H	α-helix	trans	-105.5	-16.2	-173.7	63.4	0	0	0	0	114.3	W57 V145 S146 Q151 L223 M225	W57-T149 HydrophobicContact CH2-CG2 3.99Å; V145-T149 HydrophobicContact CG1-CG2 4.32Å; V145-T149 WeakPolarHBondContact O-CB 3.47Å; V145-T149 WeakPolarHBondContact O-CG2 3.4Å; V145-T149 PolarHBondContact O-N 2.84Å; V145-T149 PolarHBondContact O-OG1 3.48Å; S146-T149 PolarHBondContact O-N 2.87Å; T149-Q151 PolarHBondContact O-N 3.12Å; T149-Q151 WeakPolarHBondContact OG1-CB 3.49Å; T149-Q151 PolarHBondContact OG1-N 2.86Å; T149-L223 HydrophobicContact CG2-CD2 3.97Å; T149-M225 HydrophobicContact CG2-CE 4.24Å; T149-M225 HydrophobicContact CG2-CG 4.32Å; T149-M225 HydrophobicContact CG2-SD 3.98Å
150	G	98.1	Very high	98.2	Very high	66 Å²	66	38.5 Å²	38.5	68%	0.68	22%	0.221	S	C	*	.			trans	69.3	1.9	-169	0	0	0	0	0	114.1	S146	S146-G150 WeakPolarHBondContact O-CA 3.45Å; S146-G150 PolarHBondContact O-N 2.79Å
151	Q	98.3	Very high	98.2	Very high	79 Å²	79	34.3 Å²	34.3	37%	0.369	21%	0.205	S	C	.	.			trans	-89	147.7	179.2	-58.2	-60.2	-38.4	0	0	110.4	S146 T149 F153 P183 M225	S146-Q151 WeakPolarHBondContact CA-O 3.31Å; S146-Q151 WeakPolarHBondContact CB-O 3.41Å; S146-Q151 PolarHBondContact OG-O 2.87Å; S146-Q151 VanDerWaalsContact OG-O 3.13Å; T149-Q151 PolarHBondContact O-N 3.12Å; T149-Q151 WeakPolarHBondContact OG1-CB 3.49Å; T149-Q151 PolarHBondContact OG1-N 2.86Å; Q151-F153 HydrophobicContact CB-CE2 3.77Å; Q151-F153 HydrophobicContact CB-CZ 3.65Å; Q151-P183 HydrophobicContact CB-CG 4.34Å; Q151-P183 HydrophobicContact CG-CG 3.76Å; Q151-M225 HydrophobicContact CG-CE 3.97Å
152	T	98.1	Very high	98.2	Very high	78 Å²	78	39.6 Å²	39.6	48%	0.479	23%	0.228	S	C	.	.			trans	-116.9	143.8	177.7	49.2	0	0	0	0	111	K255	T152-K255 PolarHBondContact OG1-NZ 2.84Å
153	F	98.1	Very high	98.2	Very high	11 Å²	11	40 Å²	40	5%	0.048	23%	0.233	C	C	.	.			trans	-134.1	138.7	-176.1	-53.5	-82.9	0	0	0	109.6	R142 V145 Q151 A185 M225 F253	R142-F153 WeakPolarHBondContact CD-O 3.31Å; V145-F153 HydrophobicContact CG1-CD2 4.46Å; V145-F153 HydrophobicContact CG1-CE2 3.74Å; V145-F153 HydrophobicContact CG1-CZ 4.44Å; Q151-F153 HydrophobicContact CB-CE2 3.77Å; Q151-F153 HydrophobicContact CB-CZ 3.65Å; F153-A185 HydrophobicContact CE1-CB 3.88Å; F153-A185 HydrophobicContact CE2-CB 4.02Å; F153-A185 HydrophobicContact CZ-CB 3.47Å; F153-A185 VanDerWaalsContact CZ-CB 3.47Å; F153-M225 HydrophobicContact CZ-CE 4.31Å; F153-F253 HydrophobicContact CB-CB 3.88Å; F153-F253 HydrophobicContact CB-CD1 4.28Å; F153-F253 HydrophobicContact CD1-CB 3.72Å; F153-F253 HydrophobicContact CD2-CB 4.13Å; F153-F253 HydrophobicContact CE1-CB 4.29Å; F153-F253 HydrophobicContact CG-CB 3.63Å
154	N	97.7	Very high	98.2	Very high	19 Å²	19	36 Å²	36	10%	0.102	21%	0.211	C	C	.	.	S	Bend	trans	-116.5	0.3	-179.4	62.6	-3.8	0	0	0	112.3	G116 D117 L120 R254 K255 I256	G116-N154 CarbonylContact C-O 3.58Å; G116-N154 WeakPolarHBondContact CA-O 3.23Å; D117-N154 HydrophobicContact CB-CB 4.32Å; D117-N154 PolarHBondContact N-O 3.2Å; D117-N154 WeakPolarHBondContact OD2-CB 3.36Å; L120-N154 HydrophobicContact CD1-CB 3.99Å; L120-N154 WeakPolarHBondContact CD1-O 3.42Å; N154-R254 PolarHBondContact N-O 3.36Å; N154-R254 PolarHBondContact OD1-O 2.98Å; N154-K255 WeakPolarHBondContact OD1-CA 3.4Å; N154-I256 PolarHBondContact ND2-O 3.01Å; N154-I256 PolarHBondContact OD1-N 2.76Å
155	F	97.6	Very high	98.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	147.2	-177.4	177.3	-91.8	0	0	0	111.1	T114 Y115 L120 Y122 P131 L157 F253 R254 I256	T114-F155 HydrophobicContact CG2-CE2 4.01Å; T114-F155 HydrophobicContact CG2-CZ 3.56Å; Y115-F155 CarbonylContact O-C 3.51Å; Y115-F155 WeakPolarHBondContact O-CA 3.39Å; L120-F155 HydrophobicContact CD1-CB 4.43Å; Y122-F155 HydrophobicContact CD1-CE2 4.22Å; Y122-F155 AromaticContact CD1-CZ 3.67Å; Y122-F155 HydrophobicContact CD1-CZ 3.67Å; Y122-F155 HydrophobicContact CD2-CZ 4.26Å; Y122-F155 HydrophobicContact CE1-CZ 4.15Å; Y122-F155 HydrophobicContact CG-CE1 4.48Å; Y122-F155 AromaticContact CG-CE2 4Å; Y122-F155 HydrophobicContact CG-CE2 4Å; Y122-F155 AromaticContact CG-CZ 3.73Å; Y122-F155 HydrophobicContact CG-CZ 3.73Å; P131-F155 HydrophobicContact CB-CD2 4.12Å; P131-F155 HydrophobicContact CB-CE2 4.07Å; P131-F155 HydrophobicContact CG-CD2 4.27Å; F155-L157 HydrophobicContact CE1-CB 3.99Å; F155-F253 CarbonylContact O-C 3.54Å; F155-F253 WeakPolarHBondContact O-CA 3Å; F155-R254 HydrophobicContact CD1-CB 4.19Å; F155-R254 HydrophobicContact CD1-CG 4.48Å; F155-R254 PolarHBondContact N-O 2.72Å; F155-R254 PolarHBondContact O-N 2.7Å; F155-I256 HydrophobicContact CB-CB 4.39Å; F155-I256 HydrophobicContact CB-CG1 3.48Å; F155-I256 VanDerWaalsContact CB-CG1 3.48Å; F155-I256 HydrophobicContact CD1-CD1 4.29Å; F155-I256 HydrophobicContact CD1-CG1 4.02Å; F155-I256 HydrophobicContact CD2-CG1 4.29Å; F155-I256 HydrophobicContact CG-CD1 4.4Å; F155-I256 HydrophobicContact CG-CG1 3.69Å
156	V	98	Very high	98.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	133	169.3	68.4	0	0	0	0	111.3	T114 Y115 W134 L138 I158 L251 T252 F253	T114-V156 WeakPolarHBondContact CA-O 3.31Å; Y115-V156 PolarHBondContact N-O 3.38Å; Y115-V156 VanDerWaalsContact N-O 3.12Å; Y115-V156 PolarHBondContact O-N 3.46Å; W134-V156 HydrophobicContact CE3-CG1 4.37Å; W134-V156 HydrophobicContact CH2-CB 3.87Å; W134-V156 HydrophobicContact CH2-CG1 3.69Å; W134-V156 HydrophobicContact CZ3-CB 3.97Å; W134-V156 HydrophobicContact CZ3-CG1 3.35Å; L138-V156 HydrophobicContact CD1-CG1 4.36Å; V156-I158 HydrophobicContact CG1-CG1 4.23Å; V156-I158 HydrophobicContact CG2-CG1 4.23Å; V156-L251 HydrophobicContact CG2-CB 3.73Å; V156-L251 HydrophobicContact CG2-CD2 4.35Å; V156-L251 HydrophobicContact CG2-CG 4.32Å; V156-T252 WeakPolarHBondContact CA-O 3.4Å; V156-F253 HydrophobicContact CB-CD1 3.74Å; V156-F253 HydrophobicContact CB-CE1 3.8Å; V156-F253 HydrophobicContact CB-CG 4.32Å; V156-F253 HydrophobicContact CB-CZ 4.44Å; V156-F253 HydrophobicContact CG1-CE1 4.42Å; V156-F253 HydrophobicContact CG2-CD1 3.9Å; V156-F253 HydrophobicContact CG2-CD2 4.22Å; V156-F253 HydrophobicContact CG2-CE1 3.87Å; V156-F253 HydrophobicContact CG2-CE2 4.2Å; V156-F253 HydrophobicContact CG2-CG 4.07Å; V156-F253 HydrophobicContact CG2-CZ 4.03Å
157	L	96.1	Very high	98.1	Very high	10 Å²	10	36.3 Å²	36.3	5%	0.052	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	118.2	163.4	175	65.1	0	0	0	109.2	T114 F155 T252	T114-L157 HydrophobicContact CG2-CD1 3.77Å; F155-L157 HydrophobicContact CE1-CB 3.99Å; L157-T252 PolarHBondContact N-O 3.08Å; L157-T252 PolarHBondContact O-N 3.46Å
158	I	98.3	Very high	98	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	131.4	176.9	-49.2	179.2	0	0	0	108.7	V89 Y91 Q112 A113 Y115 L138 V156 V249 N250 L251	V89-I158 HydrophobicContact CG1-CD1 3.86Å; V89-I158 HydrophobicContact CG1-CG2 4.31Å; V89-I158 HydrophobicContact CG2-CD1 3.91Å; Y91-I158 HydrophobicContact CE1-CG2 4.13Å; Q112-I158 VanDerWaalsContact CA-O 3.23Å; Q112-I158 WeakPolarHBondContact CA-O 3.12Å; A113-I158 HydrophobicContact CB-CB 4.24Å; A113-I158 PolarHBondContact N-O 3.37Å; A113-I158 PolarHBondContact O-N 2.85Å; Y115-I158 HydrophobicContact CD2-CD1 3.82Å; Y115-I158 HydrophobicContact CE2-CD1 4.11Å; L138-I158 HydrophobicContact CD1-CD1 3.92Å; L138-I158 HydrophobicContact CD2-CD1 3.81Å; V156-I158 HydrophobicContact CG1-CG1 4.23Å; V156-I158 HydrophobicContact CG2-CG1 4.23Å; I158-V249 HydrophobicContact CG2-CG1 3.78Å; I158-N250 CarbonylContact C-O 3.58Å; I158-N250 VanDerWaalsContact CA-O 3.31Å; I158-N250 WeakPolarHBondContact CA-O 3.46Å; I158-L251 HydrophobicContact CG1-CG 4.41Å
159	N	98.4	Very high	97.9	Very high	6 Å²	6	34 Å²	34	3%	0.032	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	121.2	172.3	-69.3	-88.5	0	0	0	109	R110 K111 Q112 Y161 N250	R110-N159 WeakPolarHBondContact CD-OD1 3.3Å; R110-N159 PolarHBondContact NE-OD1 2.72Å; K111-N159 WeakPolarHBondContact O-CA 3.46Å; Q112-N159 PolarHBondContact NE2-OD1 3.3Å; Q112-N159 VanDerWaalsContact NE2-OD1 3.08Å; N159-Y161 HydrophobicContact CB-CE2 3.65Å; N159-N250 HydrophobicContact CB-CB 4.48Å; N159-N250 PolarHBondContact N-O 3.25Å; N159-N250 PolarHBondContact O-N 3.21Å
160	R	98.7	Very high	97.8	Very high	45 Å²	45	35.8 Å²	35.8	17%	0.17	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	122.3	173.7	178.7	-176.1	-174.3	-76.1	2.7	110.7	E86 Y91 R110 K111 R248 V249	E86-R160 VanDerWaalsContact CD-NE 3.33Å; E86-R160 VanDerWaalsContact OE1-CD 3.32Å; E86-R160 WeakPolarHBondContact OE1-CD 3.48Å; E86-R160 IonicContact OE1-CZ 2.67Å; E86-R160 IonicContact OE1-NE 3.64Å; E86-R160 PolarHBondContact OE1-NE 3.24Å; E86-R160 IonicContact OE1-NH2 3.89Å; E86-R160 IonicContact OE2-CZ 3.3Å; E86-R160 VanDerWaalsContact OE2-CZ 3.31Å; E86-R160 IonicContact OE2-NE 3.59Å; E86-R160 PolarHBondContact OE2-NE 2.81Å; E86-R160 IonicContact OE2-NH2 3.25Å; E86-R160 PolarHBondContact OE2-NH2 2.93Å; Y91-R160 HydrophobicContact CD1-CB 4.34Å; Y91-R160 HydrophobicContact CE1-CB 3.44Å; Y91-R160 VanDerWaalsContact CE1-CB 3.44Å; Y91-R160 HydrophobicContact CE1-CG 4.48Å; Y91-R160 HydrophobicContact CE2-CB 4.38Å; Y91-R160 VanDerWaalsContact CZ-CB 3.49Å; Y91-R160 WeakPolarHBondContact OH-CB 3.45Å; Y91-R160 WeakPolarHBondContact OH-CD 3.43Å; R110-R160 WeakPolarHBondContact CB-O 3.37Å; K111-R160 HydrophobicContact CB-CB 4.24Å; K111-R160 PolarHBondContact N-O 3.03Å; K111-R160 PolarHBondContact O-N 2.96Å; R160-R248 WeakPolarHBondContact CA-O 3.22Å; R160-V249 HydrophobicContact CB-CG2 4.24Å; R160-V249 HydrophobicContact CG-CG2 4Å
161	Y	98.8	Very high	97.6	Very high	7 Å²	7	34.9 Å²	34.9	3%	0.027	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.4	176.4	-53.5	-94.6	0	0	0	106.8	R110 N159 D163 D166 L238 P247 R248 N250	R110-Y161 HydrophobicContact CB-CD1 4.09Å; R110-Y161 HydrophobicContact CB-CE1 4.17Å; R110-Y161 VanDerWaalsContact CD-CE1 3.47Å; R110-Y161 HydrophobicContact CG-CE1 4.43Å; N159-Y161 HydrophobicContact CB-CE2 3.65Å; Y161-D163 PolarHBondContact O-N 3.01Å; Y161-D166 HydrophobicContact CD1-CB 3.98Å; Y161-D166 HydrophobicContact CG-CB 4.41Å; Y161-L238 HydrophobicContact CD1-CD2 3.74Å; Y161-L238 HydrophobicContact CD2-CD2 4.02Å; Y161-L238 HydrophobicContact CE1-CB 4.49Å; Y161-L238 HydrophobicContact CE1-CD2 3.53Å; Y161-L238 HydrophobicContact CE2-CD2 3.86Å; Y161-L238 HydrophobicContact CG-CD2 3.98Å; Y161-P247 CarbonylContact O-C 3.59Å; Y161-P247 VanDerWaalsContact O-CA 3.23Å; Y161-P247 WeakPolarHBondContact O-CA 3.41Å; Y161-R248 HydrophobicContact CD2-CB 4.39Å; Y161-R248 HydrophobicContact CD2-CG 4.37Å; Y161-R248 PolarHBondContact N-O 3.44Å; Y161-R248 PolarHBondContact O-N 3Å; Y161-N250 HydrophobicContact CE2-CB 4.22Å
162	K	98.6	Very high	97.3	Very high	110 Å²	110	36 Å²	36	48%	0.478	19%	0.186	S	C	.	.	S	Bend	trans	-64.9	-32.7	-177.4	76.7	-165.8	177.4	179	0	112.3	D166 P247	K162-D166 WeakPolarHBondContact CE-OD1 3.35Å; K162-D166 WeakPolarHBondContact CG-OD2 3.49Å; K162-D166 PolarHBondContact N-OD2 3Å; K162-D166 IonicContact NZ-OD1 2.7Å; K162-P247 WeakPolarHBondContact O-CA 3.46Å
163	D	98.6	Very high	96.9	Very high	40 Å²	40	32.9 Å²	32.9	21%	0.214	17%	0.167	C	C	.	.	S	Bend	trans	-160.5	-167.3	-177.1	61	25.2	0	0	0	109.6	Y161 C165 D166 R193	Y161-D163 PolarHBondContact O-N 3.01Å; D163-C165 VanDerWaalsContact C-N 3.31Å; D163-C165 PolarHBondContact O-N 2.98Å; D163-C165 WeakPolarHBondContact OD1-CA 3.18Å; D163-C165 VanDerWaalsContact OD1-CB 3.23Å; D163-C165 WeakPolarHBondContact OD1-CB 3.38Å; D163-C165 PolarHBondContact OD1-N 2.87Å; D163-D166 PolarHBondContact OD1-N 3.1Å; D163-R193 PolarHBondContact O-NH1 2.95Å
164	G	98.3	Very high	96.2	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	-74.4	-8.9	176.7	0	0	0	0	0	116.2	V240 R241 V244	G164-V240 CarbonylContact O-C 3.52Å; G164-V240 VanDerWaalsContact O-CA 3.32Å; G164-V240 WeakPolarHBondContact O-CA 3.48Å; G164-V240 WeakPolarHBondContact O-CG1 3.02Å; G164-R241 VanDerWaalsContact CA-O 3.31Å; G164-R241 WeakPolarHBondContact CA-O 3.46Å; G164-R241 PolarHBondContact O-N 3.16Å; G164-V244 WeakPolarHBondContact CA-O 3.48Å; G164-V244 PolarHBondContact N-O 3.21Å
165	C	98.3	Very high	95.3	Very high	65 Å²	65	37.9 Å²	37.9	44%	0.439	19%	0.191	S	C	.	.	S	Bend	trans	-82.4	-33.4	173.9	-61.6	0	0	0	0	111.3	D163 H167	D163-C165 VanDerWaalsContact C-N 3.31Å; D163-C165 PolarHBondContact O-N 2.98Å; D163-C165 WeakPolarHBondContact OD1-CA 3.18Å; D163-C165 VanDerWaalsContact OD1-CB 3.23Å; D163-C165 WeakPolarHBondContact OD1-CB 3.38Å; D163-C165 PolarHBondContact OD1-N 2.87Å; C165-H167 PolarHBondContact O-ND1 3.24Å
166	D	98.4	Very high	94.6	Very high	17 Å²	17	47.4 Å²	47.4	9%	0.091	23%	0.227	C	C	.	.			trans	-64.6	137	167.8	-77.7	7.2	0	0	0	110.1	P109 R110 Y161 K162 D163 R193	P109-D166 CarbonylContact O-C 3.5Å; P109-D166 WeakPolarHBondContact O-CA 3.42Å; P109-D166 WeakPolarHBondContact O-CB 3.46Å; R110-D166 HydrophobicContact CB-CB 4.47Å; Y161-D166 HydrophobicContact CD1-CB 3.98Å; Y161-D166 HydrophobicContact CG-CB 4.41Å; K162-D166 WeakPolarHBondContact CE-OD1 3.35Å; K162-D166 WeakPolarHBondContact CG-OD2 3.49Å; K162-D166 PolarHBondContact N-OD2 3Å; K162-D166 IonicContact NZ-OD1 2.7Å; D163-D166 PolarHBondContact OD1-N 3.1Å; D166-R193 PolarHBondContact O-NH1 2.85Å; D166-R193 VanDerWaalsContact O-NH1 3.14Å; D166-R193 PolarHBondContact O-NH2 3.06Å
167	H	97.9	Very high	93.8	Very high	64 Å²	64	49.6 Å²	49.6	30%	0.296	24%	0.238	S	C	.	.			trans	-157.9	172.6	-170.4	65.8	-80.6	0	0	0	112.8	P109 R110 C165 L238 V240	P109-H167 PolarHBondContact O-N 3.24Å; R110-H167 PolarHBondContact NH1-O 3.18Å; C165-H167 PolarHBondContact O-ND1 3.24Å; H167-L238 WeakPolarHBondContact CA-O 3.15Å; H167-L238 WeakPolarHBondContact CB-O 3.43Å; H167-V240 HydrophobicContact CB-CG2 3.86Å
168	I	96.3	Very high	93.4	Very high	21 Å²	21	49.6 Å²	49.6	11%	0.108	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	127.8	164.5	-168.1	168.3	0	0	0	108.2	R110 H171 S237 L238	R110-I168 VanDerWaalsContact CZ-CD1 3.47Å; R110-I168 VanDerWaalsContact NH2-CD1 3.27Å; I168-H171 WeakPolarHBondContact CD1-CE1 3.18Å; I168-H171 WeakPolarHBondContact CD1-NE2 3.03Å; I168-S237 WeakPolarHBondContact O-CB 3.27Å; I168-L238 HydrophobicContact CG2-CB 3.68Å; I168-L238 PolarHBondContact N-O 2.94Å; I168-L238 VanDerWaalsContact N-O 3.16Å; I168-L238 PolarHBondContact O-N 2.8Å
169	G	95.4	Very high	93	Very high	43 Å²	43	50.6 Å²	50.6	44%	0.443	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	176.8	177.6	0	0	0	0	0	112.2	H171	G169-H171 PolarHBondContact O-N 2.86Å; G169-H171 PolarHBondContact O-ND1 2.78Å
170	E	95.6	Very high	92.7	Very high	71 Å²	71	56 Å²	56	33%	0.332	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	119.4	175.2	-68.5	-176.8	178.9	0	0	110.9	R198 R203 Y235 H236	E170-R198 VanDerWaalsContact OE1-CD 3.23Å; E170-R198 WeakPolarHBondContact OE1-CD 3.13Å; E170-R198 IonicContact OE1-CZ 3.71Å; E170-R198 IonicContact OE1-NE 3.54Å; E170-R198 PolarHBondContact OE1-NE 2.93Å; E170-R198 IonicContact OE1-NH2 2.79Å; E170-R198 IonicContact OE2-NE 2.74Å; E170-R203 IonicContact OE2-CZ 2.7Å; E170-R203 IonicContact OE2-NE 2.72Å; E170-R203 PolarHBondContact OE2-NE 2.8Å; E170-R203 VanDerWaalsContact OE2-NE 3.08Å; E170-R203 IonicContact OE2-NH2 3.68Å; E170-Y235 HydrophobicContact CB-CD1 4.29Å; E170-H236 WeakPolarHBondContact CA-O 3.35Å
171	H	94.1	Very high	92.4	Very high	47 Å²	47	56.3 Å²	56.3	22%	0.218	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	170.8	176.2	66.1	-63.3	0	0	0	110.7	I168 G169 D173 Y235 H236	I168-H171 WeakPolarHBondContact CD1-CE1 3.18Å; I168-H171 WeakPolarHBondContact CD1-NE2 3.03Å; G169-H171 PolarHBondContact O-N 2.86Å; G169-H171 PolarHBondContact O-ND1 2.78Å; H171-D173 IonicContact CD2-OD1 3.91Å; H171-D173 IonicContact NE2-OD1 3.91Å; H171-Y235 CarbonylContact O-C 3.57Å; H171-Y235 VanDerWaalsContact O-CA 3.27Å; H171-Y235 WeakPolarHBondContact O-CA 3.43Å; H171-H236 AromaticContact CD2-NE2 3.88Å; H171-H236 AromaticContact CE1-CD2 3.39Å; H171-H236 PolarHBondContact CE1-CD2 2.89Å; H171-H236 AromaticContact CE1-NE2 3.41Å; H171-H236 PolarHBondContact CE1-NE2 3.35Å; H171-H236 PolarHBondContact N-O 2.7Å; H171-H236 PolarHBondContact ND1-O 2.83Å; H171-H236 VanDerWaalsContact ND1-O 3.08Å; H171-H236 AromaticContact NE2-CD2 3.71Å; H171-H236 AromaticContact NE2-NE2 3.19Å; H171-H236 PolarHBondContact NE2-NE2 2.85Å; H171-H236 VanDerWaalsContact NE2-NE2 3.19Å; H171-H236 PolarHBondContact O-N 3.21Å
172	R	93.3	Very high	92.2	Very high	101 Å²	101	57.2 Å²	57.2	38%	0.381	31%	0.306	S	S	.	.			trans	-121.1	147.4	163.4	-63.5	179.3	-58.4	157.7	5.7	106.1	N231 T232 W234 Y235	R172-N231 VanDerWaalsContact CD-O 3.27Å; R172-N231 WeakPolarHBondContact CD-O 3.49Å; R172-T232 PolarHBondContact NH1-O 3.21Å; R172-W234 WeakPolarHBondContact CG-O 3.5Å; R172-Y235 HydrophobicContact CG-CD1 3.96Å; R172-Y235 HydrophobicContact CG-CD2 3.91Å; R172-Y235 HydrophobicContact CG-CE1 4.01Å; R172-Y235 HydrophobicContact CG-CE2 3.99Å; R172-Y235 HydrophobicContact CG-CG 3.89Å; R172-Y235 PolarHBondContact NE-OH 3.12Å
173	D	89.7	Confident	92.2	Very high	14 Å²	14	52.5 Å²	52.5	8%	0.075	29%	0.287	C	S	.	.			trans	-66.2	141.9	172.4	-80	-8.6	0	0	0	109.1	H171 E175 I184 N231 H236 R254	H171-D173 IonicContact CD2-OD1 3.91Å; H171-D173 IonicContact NE2-OD1 3.91Å; D173-E175 PolarHBondContact O-N 2.83Å; D173-E175 VanDerWaalsContact O-N 3.16Å; D173-I184 HydrophobicContact CB-CD1 3.84Å; D173-I184 WeakPolarHBondContact OD2-CD1 3.21Å; D173-N231 PolarHBondContact N-OD1 2.8Å; D173-N231 PolarHBondContact O-ND2 3.23Å; D173-H236 IonicContact OD1-NE2 2.7Å; D173-R254 IonicContact OD1-CZ 3.77Å; D173-R254 IonicContact OD1-NH2 3.21Å; D173-R254 PolarHBondContact OD1-NH2 2.76Å; D173-R254 IonicContact OD2-CZ 3.84Å; D173-R254 IonicContact OD2-NE 3.07Å; D173-R254 PolarHBondContact OD2-NE 3.25Å; D173-R254 IonicContact OD2-NH2 3.31Å; D173-R254 PolarHBondContact OD2-NH2 3.24Å
174	D	83	Confident	92.2	Very high	56 Å²	56	50.9 Å²	50.9	30%	0.299	28%	0.278	S	S	.	.			trans	-72.1	107.6	177.5	-168.4	-16.4	0	0	0	109.3	R176	D174-R176 VanDerWaalsContact C-N 3.29Å; D174-R176 PolarHBondContact O-N 3Å; D174-R176 WeakPolarHBondContact OD1-CB 3.41Å; D174-R176 WeakPolarHBondContact OD1-CG 3.49Å; D174-R176 IonicContact OD1-CZ 3.92Å; D174-R176 PolarHBondContact OD1-N 2.88Å; D174-R176 VanDerWaalsContact OD1-N 3.14Å; D174-R176 IonicContact OD1-NE 3.86Å; D174-R176 PolarHBondContact OD1-NE 2.97Å; D174-R176 IonicContact OD1-NH2 3.96Å; D174-R176 IonicContact OD2-CZ 3.3Å; D174-R176 IonicContact OD2-NE 3.83Å; D174-R176 PolarHBondContact OD2-NE 2.87Å; D174-R176 IonicContact OD2-NH2 3.97Å; D174-R176 PolarHBondContact OD2-NH2 2.83Å
175	E	77.8	Confident	92.2	Very high	78 Å²	78	50.9 Å²	50.9	36%	0.364	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-78	-11	-175.6	-61.2	-174.8	157.8	0	0	113.3	D173 E177 L178 N231	D173-E175 PolarHBondContact O-N 2.83Å; D173-E175 VanDerWaalsContact O-N 3.16Å; E175-E177 VanDerWaalsContact C-N 3.28Å; E175-E177 PolarHBondContact O-N 2.94Å; E175-L178 PolarHBondContact O-N 3.12Å; E175-L178 VanDerWaalsContact O-N 3.08Å; E175-N231 WeakPolarHBondContact CG-ND2 3.23Å; E175-N231 VanDerWaalsContact OE1-CB 3.23Å; E175-N231 WeakPolarHBondContact OE1-CB 3.48Å; E175-N231 PolarHBondContact OE1-ND2 2.94Å
176	R	83.2	Confident	92.2	Very high	200 Å²	200	47.9 Å²	47.9	76%	0.755	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-63.8	-33.4	-173.3	-70.2	177.8	-69.6	-153.6	5.8	113.7	D174	D174-R176 VanDerWaalsContact C-N 3.29Å; D174-R176 PolarHBondContact O-N 3Å; D174-R176 WeakPolarHBondContact OD1-CB 3.41Å; D174-R176 WeakPolarHBondContact OD1-CG 3.49Å; D174-R176 IonicContact OD1-CZ 3.92Å; D174-R176 PolarHBondContact OD1-N 2.88Å; D174-R176 VanDerWaalsContact OD1-N 3.14Å; D174-R176 IonicContact OD1-NE 3.86Å; D174-R176 PolarHBondContact OD1-NE 2.97Å; D174-R176 IonicContact OD1-NH2 3.96Å; D174-R176 IonicContact OD2-CZ 3.3Å; D174-R176 IonicContact OD2-NE 3.83Å; D174-R176 PolarHBondContact OD2-NE 2.87Å; D174-R176 IonicContact OD2-NH2 3.97Å; D174-R176 PolarHBondContact OD2-NH2 2.83Å
177	E	82.1	Confident	92.2	Very high	47 Å²	47	47 Å²	47	22%	0.22	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-94.2	-4.3	178.6	-60.5	-174	167.8	0	0	112.2	Y122 T123 E175 I256 L257	Y122-E177 WeakPolarHBondContact CD2-OE2 3.35Å; Y122-E177 WeakPolarHBondContact CE2-OE2 3.21Å; T123-E177 WeakPolarHBondContact CB-OE1 3.5Å; T123-E177 PolarHBondContact N-OE1 3.47Å; T123-E177 PolarHBondContact N-OE2 2.81Å; T123-E177 PolarHBondContact OG1-OE1 3.03Å; E175-E177 VanDerWaalsContact C-N 3.28Å; E175-E177 PolarHBondContact O-N 2.94Å; E177-I256 CarbonylContact O-C 3.52Å; E177-I256 WeakPolarHBondContact O-CA 3.36Å; E177-L257 PolarHBondContact O-N 3.33Å
178	L	86.8	Confident	92.3	Very high	10 Å²	10	44 Å²	44	5%	0.052	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-87.4	147.5	179.2	-52.7	-173	0	0	0	110.5	E175 I184 R254 K255 I256	E175-L178 PolarHBondContact O-N 3.12Å; E175-L178 VanDerWaalsContact O-N 3.08Å; L178-I184 HydrophobicContact CD1-CD1 4.11Å; L178-I184 HydrophobicContact CD1-CG1 4.33Å; L178-R254 HydrophobicContact CD2-CB 4.04Å; L178-R254 HydrophobicContact CD2-CG 4.41Å; L178-K255 WeakPolarHBondContact CA-O 3.5Å; L178-I256 HydrophobicContact CD2-CD1 3.57Å
179	A	90.6	Very high	92.4	Very high	20 Å²	20	43.1 Å²	43.1	17%	0.165	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-57.5	128.4	168.6	0	0	0	0	0	109.2	G181 S182 K255 L257	A179-G181 PolarHBondContact O-N 2.89Å; A179-S182 VanDerWaalsContact O-CB 3.23Å; A179-S182 WeakPolarHBondContact O-CB 3.32Å; A179-S182 PolarHBondContact O-N 2.83Å; A179-S182 PolarHBondContact O-OG 3.16Å; A179-K255 HydrophobicContact CB-CB 4.25Å; A179-K255 HydrophobicContact CB-CD 4.31Å; A179-K255 HydrophobicContact CB-CG 4.04Å; A179-K255 PolarHBondContact N-O 3.01Å; A179-L257 HydrophobicContact CB-CD2 4.3Å
180	P	91.7	Very high	92.6	Very high	121 Å²	121	41.8 Å²	41.8	79%	0.786	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.3	130	-176.5	-29.7	35.3	0	0	0	112.7	S182	P180-S182 PolarHBondContact O-N 3.48Å
181	G	91.4	Very high	92.7	Very high	51 Å²	51	39.2 Å²	39.2	53%	0.526	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	-0.1	-179.9	0	0	0	0	0	115.5	A179	A179-G181 PolarHBondContact O-N 2.89Å
182	S	95.9	Very high	93	Very high	26 Å²	26	40 Å²	40	18%	0.182	22%	0.222	C	C	.	.			trans	-65.9	140.2	178.9	63.7	0	0	0	0	111.8	A179 P180	A179-S182 VanDerWaalsContact O-CB 3.23Å; A179-S182 WeakPolarHBondContact O-CB 3.32Å; A179-S182 PolarHBondContact O-N 2.83Å; A179-S182 PolarHBondContact O-OG 3.16Å; P180-S182 PolarHBondContact O-N 3.48Å
183	P	97.7	Very high	93.2	Very high	11 Å²	11	35.4 Å²	35.4	7%	0.071	20%	0.204	C	C	.	.			trans	-75.6	160.2	176.4	31.7	-34.1	0	0	0	111.1	Q151 M225 M226	Q151-P183 HydrophobicContact CB-CG 4.34Å; Q151-P183 HydrophobicContact CG-CG 3.76Å; P183-M225 HydrophobicContact CB-CE 3.97Å; P183-M225 HydrophobicContact CG-CE 4.03Å; P183-M226 WeakPolarHBondContact CA-O 3.41Å
184	I	98.3	Very high	93.6	Very high	5 Å²	5	37.3 Å²	37.3	3%	0.026	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	128	169.5	-65.7	156.4	0	0	0	108.3	D173 L178 M226 T252 R254	D173-I184 HydrophobicContact CB-CD1 3.84Å; D173-I184 WeakPolarHBondContact OD2-CD1 3.21Å; L178-I184 HydrophobicContact CD1-CD1 4.11Å; L178-I184 HydrophobicContact CD1-CG1 4.33Å; I184-M226 HydrophobicContact CB-CB 4.43Å; I184-M226 HydrophobicContact CB-CE 3.97Å; I184-M226 HydrophobicContact CG2-CE 3.58Å; I184-M226 PolarHBondContact N-O 3.16Å; I184-M226 PolarHBondContact O-N 3.17Å; I184-T252 HydrophobicContact CG2-CG2 3.25Å; I184-R254 HydrophobicContact CG1-CG 4.41Å
185	A	98.8	Very high	94.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	113.7	176.8	0	0	0	0	0	110.6	V145 F153 L223 M225 T252 F253	V145-A185 HydrophobicContact CG1-CB 3.91Å; F153-A185 HydrophobicContact CE1-CB 3.88Å; F153-A185 HydrophobicContact CE2-CB 4.02Å; F153-A185 HydrophobicContact CZ-CB 3.47Å; F153-A185 VanDerWaalsContact CZ-CB 3.47Å; A185-L223 HydrophobicContact CB-CD1 3.92Å; A185-M225 HydrophobicContact CB-CE 4.36Å; A185-M225 HydrophobicContact CB-SD 3.55Å; A185-M225 VanDerWaalsContact CB-SD 3.55Å; A185-T252 CarbonylContact O-C 3.54Å; A185-T252 WeakPolarHBondContact O-CA 3.38Å; A185-F253 HydrophobicContact CB-CB 4.18Å; A185-F253 PolarHBondContact N-O 3.43Å; A185-F253 VanDerWaalsContact N-O 3.1Å; A185-F253 PolarHBondContact O-N 2.85Å
186	S	98.8	Very high	95.4	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.014	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	111.9	178	174.2	0	0	0	0	110.4	L223 L224 N250 L251	S186-L223 CarbonylContact O-C 3.56Å; S186-L223 WeakPolarHBondContact O-CA 3.21Å; S186-L224 PolarHBondContact N-O 3.41Å; S186-L224 PolarHBondContact O-N 2.7Å; S186-N250 PolarHBondContact OG-OD1 3.08Å; S186-L251 CarbonylContact C-O 3.57Å; S186-L251 WeakPolarHBondContact CA-O 3.4Å
187	V	98.9	Very high	96.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	135.6	177	-171.2	0	0	0	0	109.8	F73 I141 V145 F189 S222 L223 N250 L251 F253	F73-V187 HydrophobicContact CD2-CG1 4.16Å; F73-V187 HydrophobicContact CE2-CG1 3.68Å; I141-V187 HydrophobicContact CG2-CB 4.34Å; I141-V187 HydrophobicContact CG2-CG1 4.14Å; I141-V187 HydrophobicContact CG2-CG2 4.13Å; V145-V187 HydrophobicContact CG2-CG2 3.71Å; V187-F189 HydrophobicContact CB-CE2 4.38Å; V187-F189 HydrophobicContact CG1-CD2 4.27Å; V187-F189 HydrophobicContact CG1-CE2 3.41Å; V187-F189 VanDerWaalsContact CG1-CE2 3.41Å; V187-F189 HydrophobicContact CG1-CZ 3.62Å; V187-S222 CarbonylContact C-O 3.57Å; V187-S222 VanDerWaalsContact CA-O 3.29Å; V187-S222 WeakPolarHBondContact CA-O 3.31Å; V187-L223 HydrophobicContact CG2-CD1 3.9Å; V187-N250 CarbonylContact O-C 3.54Å; V187-N250 WeakPolarHBondContact O-CA 3.45Å; V187-L251 HydrophobicContact CB-CB 4.42Å; V187-L251 PolarHBondContact N-O 3.14Å; V187-L251 PolarHBondContact O-N 2.92Å; V187-F253 HydrophobicContact CG2-CD2 4.18Å; V187-F253 HydrophobicContact CG2-CE2 4.04Å
188	S	98.9	Very high	96.9	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.007	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	131.7	-174.7	-61.1	0	0	0	0	113.2	G221 S222 R248	S188-G221 WeakPolarHBondContact O-CA 3.49Å; S188-G221 PolarHBondContact O-N 3.18Å; S188-S222 PolarHBondContact N-O 2.67Å; S188-S222 PolarHBondContact O-N 3.08Å; S188-R248 PolarHBondContact OG-NH2 3.37Å
189	F	98.9	Very high	97.5	Very high	1 Å²	1	22.8 Å²	22.8	0%	0.004	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	155.6	173.9	-59.1	-82.4	0	0	0	111.2	F73 A78 I81 F82 L85 I141 V187 R248 V249 L251	F73-F189 HydrophobicContact CB-CE1 4.34Å; F73-F189 AromaticContact CD2-CE1 3.97Å; F73-F189 HydrophobicContact CD2-CE1 3.97Å; F73-F189 AromaticContact CD2-CZ 3.78Å; F73-F189 HydrophobicContact CD2-CZ 3.78Å; F73-F189 AromaticContact CE2-CZ 3.87Å; F73-F189 HydrophobicContact CE2-CZ 3.87Å; F73-F189 HydrophobicContact CG-CE1 4.11Å; F73-F189 HydrophobicContact CG-CZ 4.23Å; F73-F189 HydrophobicContact CZ-CZ 4.39Å; A78-F189 HydrophobicContact CB-CD1 4.02Å; A78-F189 HydrophobicContact CB-CE1 4.06Å; I81-F189 HydrophobicContact CB-CD1 4.28Å; I81-F189 HydrophobicContact CB-CE1 3.92Å; I81-F189 HydrophobicContact CB-CZ 4.25Å; I81-F189 HydrophobicContact CD1-CE1 4.06Å; I81-F189 HydrophobicContact CD1-CZ 4.13Å; I81-F189 HydrophobicContact CG2-CD1 3.93Å; I81-F189 HydrophobicContact CG2-CD2 4.09Å; I81-F189 HydrophobicContact CG2-CE1 3.57Å; I81-F189 HydrophobicContact CG2-CE2 3.73Å; I81-F189 HydrophobicContact CG2-CG 4.19Å; I81-F189 HydrophobicContact CG2-CZ 3.47Å; I81-F189 VanDerWaalsContact CG2-CZ 3.47Å; F82-F189 HydrophobicContact CB-CB 4.09Å; F82-F189 HydrophobicContact CD2-CB 3.64Å; F82-F189 HydrophobicContact CG-CB 4.27Å; L85-F189 HydrophobicContact CD1-CB 4.41Å; L85-F189 HydrophobicContact CD1-CD2 3.59Å; L85-F189 HydrophobicContact CD1-CE2 4.1Å; L85-F189 HydrophobicContact CD1-CG 4.13Å; I141-F189 HydrophobicContact CD1-CE2 3.83Å; I141-F189 HydrophobicContact CD1-CZ 4.19Å; I141-F189 HydrophobicContact CG1-CE2 4.3Å; I141-F189 HydrophobicContact CG1-CZ 4.22Å; V187-F189 HydrophobicContact CB-CE2 4.38Å; V187-F189 HydrophobicContact CG1-CD2 4.27Å; V187-F189 HydrophobicContact CG1-CE2 3.41Å; V187-F189 VanDerWaalsContact CG1-CE2 3.41Å; V187-F189 HydrophobicContact CG1-CZ 3.62Å; F189-R248 WeakPolarHBondContact O-CA 3.23Å; F189-V249 PolarHBondContact N-O 3.07Å; F189-V249 PolarHBondContact O-N 2.82Å; F189-L251 HydrophobicContact CD2-CD1 3.74Å; F189-L251 HydrophobicContact CE2-CD1 3.88Å
190	G	98.8	Very high	97.8	Very high	16 Å²	16	25.6 Å²	25.6	17%	0.165	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	76.1	-143.6	-171.6	0	0	0	0	0	114.2	H220	G190-H220 PolarHBondContact N-ND1 2.93Å
191	A	98.8	Very high	98.1	Very high	17 Å²	17	22.3 Å²	22.3	14%	0.14	14%	0.135	C	C	.	.	S	Bend	trans	-61.4	135.1	-170.8	0	0	0	0	0	113.5	R193 V244 A246 P247 R248	A191-R193 PolarHBondContact O-N 3.01Å; A191-V244 HydrophobicContact CB-CG1 3.83Å; A191-A246 HydrophobicContact CB-CB 3.96Å; A191-A246 WeakPolarHBondContact CB-O 3.37Å; A191-P247 WeakPolarHBondContact CB-O 3.34Å; A191-P247 PolarHBondContact N-O 2.81Å; A191-R248 HydrophobicContact CB-CB 4.43Å; A191-R248 WeakPolarHBondContact O-CD 3.4Å
192	C	98.7	Very high	98.3	Very high	63 Å²	63	20.3 Å²	20.3	43%	0.426	11%	0.113	S	C	.	.			trans	-63.4	133.8	172.1	-178.5	0	0	0	0	110.8	P217 L218	C192-P217 VanDerWaalsContact SG-CB 3.52Å; C192-L218 WeakPolarHBondContact CA-O 3.44Å
193	R	98.7	Very high	98.3	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.015	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	139.9	178.9	-71.9	-70.4	-65.7	-89.1	2.2	111.5	D163 D166 A191 F195 L218 L238 P239 R248	D163-R193 PolarHBondContact O-NH1 2.95Å; D166-R193 PolarHBondContact O-NH1 2.85Å; D166-R193 VanDerWaalsContact O-NH1 3.14Å; D166-R193 PolarHBondContact O-NH2 3.06Å; A191-R193 PolarHBondContact O-N 3.01Å; R193-F195 PolarHBondContact O-N 2.93Å; R193-L218 PolarHBondContact N-O 3.3Å; R193-L218 PolarHBondContact O-N 3.28Å; R193-L238 HydrophobicContact CB-CD1 3.77Å; R193-L238 HydrophobicContact CB-CD2 3.99Å; R193-L238 HydrophobicContact CB-CG 4.02Å; R193-L238 HydrophobicContact CG-CD2 4.13Å; R193-P239 PolarHBondContact NH2-O 3.17Å; R193-R248 HydrophobicContact CG-CB 4.4Å; R193-R248 VanDerWaalsContact CG-CD 3.44Å
194	D	98.5	Very high	98	Very high	55 Å²	55	26 Å²	26	29%	0.294	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	127.2	172.1	-68.2	-11.4	0	0	0	110.1	L238 P239 R241	D194-L238 WeakPolarHBondContact O-CD1 3.34Å; D194-P239 WeakPolarHBondContact O-CD 3.23Å; D194-R241 IonicContact OD2-CZ 3.12Å; D194-R241 IonicContact OD2-NE 2.7Å; D194-R241 PolarHBondContact OD2-NE 2.98Å; D194-R241 IonicContact OD2-NH2 3.34Å; D194-R241 PolarHBondContact OD2-NH2 3.17Å
195	F	98.8	Very high	97.7	Very high	11 Å²	11	35.9 Å²	35.9	5%	0.048	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	134.7	170.3	-165.1	-91.6	0	0	0	108.9	R193 F197 R215 L216 L218 L224 M226 H236 L238	R193-F195 PolarHBondContact O-N 2.93Å; F195-F197 HydrophobicContact CD1-CD2 4.06Å; F195-F197 HydrophobicContact CD1-CE1 4.5Å; F195-F197 AromaticContact CD1-CE2 3.65Å; F195-F197 HydrophobicContact CD1-CE2 3.65Å; F195-F197 AromaticContact CD1-CZ 3.93Å; F195-F197 HydrophobicContact CD1-CZ 3.93Å; F195-F197 HydrophobicContact CE1-CD1 4.21Å; F195-F197 HydrophobicContact CE1-CD2 4.17Å; F195-F197 AromaticContact CE1-CE1 3.69Å; F195-F197 HydrophobicContact CE1-CE1 3.69Å; F195-F197 AromaticContact CE1-CE2 3.64Å; F195-F197 HydrophobicContact CE1-CE2 3.64Å; F195-F197 HydrophobicContact CE1-CG 4.45Å; F195-F197 AromaticContact CE1-CZ 3.4Å; F195-F197 HydrophobicContact CE1-CZ 3.4Å; F195-F197 VanDerWaalsContact CE1-CZ 3.4Å; F195-F197 HydrophobicContact CZ-CZ 4.49Å; F195-R215 WeakPolarHBondContact O-CA 3.38Å; F195-L216 HydrophobicContact CB-CD2 4.08Å; F195-L216 WeakPolarHBondContact CB-O 3.23Å; F195-L216 HydrophobicContact CD1-CD2 4.2Å; F195-L216 PolarHBondContact N-O 2.77Å; F195-L216 PolarHBondContact O-N 2.93Å; F195-L218 HydrophobicContact CB-CD1 3.69Å; F195-L218 HydrophobicContact CB-CG 3.74Å; F195-L218 HydrophobicContact CD2-CD1 3.6Å; F195-L218 HydrophobicContact CE2-CD1 4.35Å; F195-L218 HydrophobicContact CG-CD1 3.76Å; F195-L218 HydrophobicContact CG-CG 4.31Å; F195-L224 HydrophobicContact CD1-CD2 4.14Å; F195-L224 HydrophobicContact CE1-CD2 4Å; F195-L224 HydrophobicContact CZ-CD2 4.42Å; F195-M226 HydrophobicContact CE1-SD 4.36Å; F195-M226 HydrophobicContact CZ-SD 4.2Å; F195-H236 HydrophobicContact CE1-CB 3.56Å; F195-H236 HydrophobicContact CE2-CB 4.49Å; F195-H236 AromaticContact CE2-CD2 4Å; F195-H236 HydrophobicContact CZ-CB 3.53Å; F195-H236 AromaticContact CZ-CD2 3.42Å; F195-H236 VanDerWaalsContact CZ-CD2 3.42Å; F195-H236 WeakPolarHBondContact CZ-CD2 3.43Å; F195-H236 AromaticContact CZ-CG 3.66Å; F195-L238 HydrophobicContact CB-CD1 4.48Å; F195-L238 HydrophobicContact CD2-CD1 3.92Å
196	V	98.8	Very high	97.5	Very high	5 Å²	5	41.3 Å²	41.3	3%	0.03	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	124.1	-168.8	-177.3	0	0	0	0	109.7	V213 R215 H236 S237 P239	V196-V213 HydrophobicContact CG1-CG1 3.42Å; V196-V213 VanDerWaalsContact CG1-CG1 3.42Å; V196-R215 HydrophobicContact CG1-CG 4.37Å; V196-R215 HydrophobicContact CG2-CG 4.29Å; V196-R215 VanDerWaalsContact CG2-NH1 3.35Å; V196-H236 CarbonylContact O-C 3.59Å; V196-H236 WeakPolarHBondContact O-CA 3.47Å; V196-S237 PolarHBondContact N-O 2.78Å; V196-S237 PolarHBondContact O-N 3.44Å; V196-P239 HydrophobicContact CG2-CG 3.93Å
197	F	98.8	Very high	97.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	134.5	169.9	-64.7	-85.7	0	0	0	110.7	L65 F195 V213 V214 L216 L224 M226 T230 W234 Y235 H236	L65-F197 HydrophobicContact CD1-CD1 3.96Å; L65-F197 HydrophobicContact CD1-CE1 4.08Å; L65-F197 HydrophobicContact CD1-CG 4.17Å; L65-F197 HydrophobicContact CD1-CZ 4.38Å; F195-F197 HydrophobicContact CD1-CD2 4.06Å; F195-F197 HydrophobicContact CD1-CE1 4.5Å; F195-F197 AromaticContact CD1-CE2 3.65Å; F195-F197 HydrophobicContact CD1-CE2 3.65Å; F195-F197 AromaticContact CD1-CZ 3.93Å; F195-F197 HydrophobicContact CD1-CZ 3.93Å; F195-F197 HydrophobicContact CE1-CD1 4.21Å; F195-F197 HydrophobicContact CE1-CD2 4.17Å; F195-F197 AromaticContact CE1-CE1 3.69Å; F195-F197 HydrophobicContact CE1-CE1 3.69Å; F195-F197 AromaticContact CE1-CE2 3.64Å; F195-F197 HydrophobicContact CE1-CE2 3.64Å; F195-F197 HydrophobicContact CE1-CG 4.45Å; F195-F197 AromaticContact CE1-CZ 3.4Å; F195-F197 HydrophobicContact CE1-CZ 3.4Å; F195-F197 VanDerWaalsContact CE1-CZ 3.4Å; F195-F197 HydrophobicContact CZ-CZ 4.49Å; F197-V213 WeakPolarHBondContact O-CG1 3.08Å; F197-V214 HydrophobicContact CB-CB 4.22Å; F197-V214 HydrophobicContact CD2-CG1 4.47Å; F197-V214 PolarHBondContact N-O 3.39Å; F197-V214 PolarHBondContact O-N 3.41Å; F197-V214 VanDerWaalsContact O-N 3.1Å; F197-L216 HydrophobicContact CE2-CD2 4.22Å; F197-L224 HydrophobicContact CE2-CD2 4.38Å; F197-L224 HydrophobicContact CZ-CD2 4.06Å; F197-M226 HydrophobicContact CE1-CG 4.49Å; F197-M226 HydrophobicContact CE1-SD 3.89Å; F197-M226 HydrophobicContact CZ-CG 4.25Å; F197-M226 HydrophobicContact CZ-SD 3.99Å; F197-T230 HydrophobicContact CD1-CG2 4.33Å; F197-T230 HydrophobicContact CE1-CG2 3.85Å; F197-W234 HydrophobicContact CB-CD2 4.46Å; F197-W234 HydrophobicContact CB-CE3 3.67Å; F197-W234 HydrophobicContact CB-CZ3 4.23Å; F197-W234 HydrophobicContact CD1-CB 4.25Å; F197-Y235 CarbonylContact C-O 3.53Å; F197-Y235 VanDerWaalsContact CA-O 3.31Å; F197-Y235 WeakPolarHBondContact CA-O 3.46Å; F197-H236 HydrophobicContact CD1-CB 3.85Å; F197-H236 HydrophobicContact CE1-CB 4.05Å
198	R	98.5	Very high	97.1	Very high	69 Å²	69	48.5 Å²	48.5	26%	0.26	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	125.9	173.6	-177.1	-179	-62.6	-77.4	-0.8	110.4	E170 S202 R203 Y235	E170-R198 VanDerWaalsContact OE1-CD 3.23Å; E170-R198 WeakPolarHBondContact OE1-CD 3.13Å; E170-R198 IonicContact OE1-CZ 3.71Å; E170-R198 IonicContact OE1-NE 3.54Å; E170-R198 PolarHBondContact OE1-NE 2.93Å; E170-R198 IonicContact OE1-NH2 2.79Å; E170-R198 IonicContact OE2-NE 2.74Å; R198-S202 WeakPolarHBondContact CD-O 3.18Å; R198-R203 HydrophobicContact CG-CG 3.95Å; R198-Y235 PolarHBondContact N-O 3.2Å; R198-Y235 PolarHBondContact O-N 3.2Å
199	H	98.5	Very high	97	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	142.3	178	-168.3	-94.7	0	0	0	111.1	D201 S202 V211 W234	H199-D201 VanDerWaalsContact C-N 3.26Å; H199-D201 IonicContact CE1-OD2 3.36Å; H199-D201 PolarHBondContact CE1-OD2 3.1Å; H199-D201 PolarHBondContact ND1-N 2.99Å; H199-D201 IonicContact ND1-OD2 2.98Å; H199-D201 PolarHBondContact O-N 2.9Å; H199-S202 WeakPolarHBondContact O-CA 3.35Å; H199-S202 PolarHBondContact O-N 2.9Å; H199-V211 HydrophobicContact CB-CB 3.75Å; H199-V211 HydrophobicContact CB-CG1 3.91Å; H199-V211 HydrophobicContact CB-CG2 4.11Å; H199-W234 HydrophobicContact CB-CD2 4.17Å; H199-W234 HydrophobicContact CB-CE3 4.11Å; H199-W234 HydrophobicContact CB-CH2 4.06Å; H199-W234 HydrophobicContact CB-CZ2 4.07Å; H199-W234 HydrophobicContact CB-CZ3 4.07Å; H199-W234 AromaticContact CD2-CE2 3.68Å; H199-W234 AromaticContact CD2-CZ2 3.97Å; H199-W234 AromaticContact CD2-NE1 3.62Å
200	K	97.4	Very high	96.8	Very high	78 Å²	78	64.2 Å²	64.2	34%	0.339	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-56	-38	-175.3	64.6	179.7	-176.8	-175	0	113.2	S202 H233 Y235	K200-S202 PolarHBondContact O-N 2.82Å; K200-H233 WeakPolarHBondContact CB-O 3.44Å; K200-H233 WeakPolarHBondContact CG-O 3.44Å; K200-H233 PolarHBondContact N-O 2.68Å; K200-Y235 HydrophobicContact CB-CD2 4.2Å; K200-Y235 HydrophobicContact CB-CE2 4.01Å
201	D	97.4	Very high	96.7	Very high	52 Å²	52	64.8 Å²	64.8	28%	0.278	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-81	-2.2	-179.9	-58	-28	0	0	0	113.2	H199 S208 R209	H199-D201 VanDerWaalsContact C-N 3.26Å; H199-D201 IonicContact CE1-OD2 3.36Å; H199-D201 PolarHBondContact CE1-OD2 3.1Å; H199-D201 PolarHBondContact ND1-N 2.99Å; H199-D201 IonicContact ND1-OD2 2.98Å; H199-D201 PolarHBondContact O-N 2.9Å; D201-S208 PolarHBondContact O-N 3.3Å; D201-S208 PolarHBondContact O-OG 2.82Å; D201-R209 HydrophobicContact CB-CB 3.97Å; D201-R209 HydrophobicContact CB-CG 3.94Å; D201-R209 PolarHBondContact O-N 2.93Å; D201-R209 IonicContact OD2-NH1 3.18Å
202	S	97.1	Very high	96.7	Very high	10 Å²	10	67.7 Å²	67.7	7%	0.07	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-113.3	26.5	-178.6	-61.3	0	0	0	0	112.7	R198 H199 K200 R209 V211	R198-S202 WeakPolarHBondContact CD-O 3.18Å; H199-S202 WeakPolarHBondContact O-CA 3.35Å; H199-S202 PolarHBondContact O-N 2.9Å; K200-S202 PolarHBondContact O-N 2.82Å; S202-R209 WeakPolarHBondContact CA-O 3.38Å; S202-R209 WeakPolarHBondContact CB-O 3.33Å; S202-R209 PolarHBondContact OG-O 2.92Å; S202-V211 WeakPolarHBondContact OG-CB 3.24Å; S202-V211 PolarHBondContact OG-N 3.19Å
203	R	95.6	Very high	96.7	Very high	84 Å²	84	66.9 Å²	66.9	32%	0.317	36%	0.358	S	S	.	.			trans	-106.4	158.9	-179.4	-66.4	-179.9	68.2	-133.7	2.3	112	E170 R198 Y235	E170-R203 IonicContact OE2-CZ 2.7Å; E170-R203 IonicContact OE2-NE 2.72Å; E170-R203 PolarHBondContact OE2-NE 2.8Å; E170-R203 VanDerWaalsContact OE2-NE 3.08Å; E170-R203 IonicContact OE2-NH2 3.68Å; R198-R203 HydrophobicContact CG-CG 3.95Å; R203-Y235 VanDerWaalsContact CZ-CE1 3.43Å; R203-Y235 VanDerWaalsContact NH1-CE2 3.25Å; R203-Y235 PolarHBondContact NH1-OH 3.04Å
204	G	91.7	Very high	96.6	Very high	71 Å²	71	68.2 Å²	68.2	73%	0.732	37%	0.366	S	S	*	.	S	Bend	trans	84.5	-177.1	176.2	0	0	0	0	0	114.2
205	K	91.8	Very high	96.6	Very high	213 Å²	213	72.2 Å²	72.2	93%	0.926	38%	0.377	S	S	*	.	S	Bend	trans	-70.5	-33.8	-177.4	-67.6	-176.4	180	179.8	0	112.8
206	S	94.4	Very high	96.6	Very high	115 Å²	115	71.9 Å²	71.9	80%	0.804	38%	0.376	S	S	*	.	S	Bend	trans	-130.4	79.9	-178	-56.7	0	0	0	0	109.5
207	P	94.4	Very high	96.6	Very high	52 Å²	52	74.6 Å²	74.6	34%	0.338	39%	0.394	S	S	.	.			trans	-70.1	143.6	-176.4	28.6	-34.5	0	0	0	111.6	R209	P207-R209 VanDerWaalsContact C-N 3.26Å; P207-R209 WeakPolarHBondContact CB-O 3.42Å; P207-R209 PolarHBondContact O-N 2.82Å
208	S	95.5	Very high	96.6	Very high	101 Å²	101	74.6 Å²	74.6	71%	0.706	39%	0.394	S	S	*	.	S	Bend	trans	-69.3	-25.9	176.1	55.7	0	0	0	0	112.4	D201	D201-S208 PolarHBondContact O-N 3.3Å; D201-S208 PolarHBondContact O-OG 2.82Å
209	R	96.2	Very high	96.6	Very high	88 Å²	88	72.8 Å²	72.8	33%	0.332	39%	0.393	S	S	.	.			trans	-135.4	153.3	178.4	-60.5	-178.8	63.7	-153.9	-2	111.6	E63 D201 S202 P207 V211	E63-R209 VanDerWaalsContact CD-NH2 3.29Å; E63-R209 IonicContact OE1-CZ 3.43Å; E63-R209 IonicContact OE1-NH1 2.7Å; E63-R209 PolarHBondContact OE1-NH1 3.11Å; E63-R209 IonicContact OE1-NH2 3.68Å; E63-R209 PolarHBondContact OE1-NH2 3.49Å; E63-R209 VanDerWaalsContact OE1-NH2 3.12Å; E63-R209 IonicContact OE2-CZ 3.72Å; E63-R209 IonicContact OE2-NH1 3.08Å; E63-R209 IonicContact OE2-NH2 3.95Å; E63-R209 PolarHBondContact OE2-NH2 3.3Å; D201-R209 HydrophobicContact CB-CB 3.97Å; D201-R209 HydrophobicContact CB-CG 3.94Å; D201-R209 PolarHBondContact O-N 2.93Å; D201-R209 IonicContact OD2-NH1 3.18Å; S202-R209 WeakPolarHBondContact CA-O 3.38Å; S202-R209 WeakPolarHBondContact CB-O 3.33Å; S202-R209 PolarHBondContact OG-O 2.92Å; P207-R209 VanDerWaalsContact C-N 3.26Å; P207-R209 WeakPolarHBondContact CB-O 3.42Å; P207-R209 PolarHBondContact O-N 2.82Å; R209-V211 HydrophobicContact CB-CG2 4.28Å
210	R	94.9	Very high	96.6	Very high	243 Å²	243	74.7 Å²	74.7	92%	0.917	40%	0.402	S	S	*	.			trans	-108.8	60.9	176	-64.3	-172.5	178.3	-160.1	1.1	112
211	V	97	Very high	96.7	Very high	29 Å²	29	71 Å²	71	18%	0.176	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-74.7	134.8	172.9	-173.9	0	0	0	0	109	H199 S202 R209 W234	H199-V211 HydrophobicContact CB-CB 3.75Å; H199-V211 HydrophobicContact CB-CG1 3.91Å; H199-V211 HydrophobicContact CB-CG2 4.11Å; S202-V211 WeakPolarHBondContact OG-CB 3.24Å; S202-V211 PolarHBondContact OG-N 3.19Å; R209-V211 HydrophobicContact CB-CG2 4.28Å; V211-W234 HydrophobicContact CG1-CH2 3.62Å; V211-W234 HydrophobicContact CG1-CZ2 3.88Å
212	A	97.8	Very high	96.7	Very high	78 Å²	78	68.5 Å²	68.5	65%	0.645	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-62.3	140.4	-178.5	0	0	0	0	0	112	W234	A212-W234 WeakPolarHBondContact O-CH2 3.44Å
213	V	98.1	Very high	96.8	Very high	46 Å²	46	68 Å²	68	28%	0.279	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-74.3	130.3	174.2	173.7	0	0	0	0	109.1	V196 F197 R215	V196-V213 HydrophobicContact CG1-CG1 3.42Å; V196-V213 VanDerWaalsContact CG1-CG1 3.42Å; F197-V213 WeakPolarHBondContact O-CG1 3.08Å; V213-R215 HydrophobicContact CG1-CG 4.01Å
214	V	98.6	Very high	97	Very high	32 Å²	32	64 Å²	64	19%	0.194	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	131.8	174.4	-179.3	0	0	0	0	109	I60 A62 L65 F197 W234	I60-V214 HydrophobicContact CG2-CG1 3.73Å; A62-V214 HydrophobicContact CB-CG2 4.44Å; L65-V214 HydrophobicContact CD2-CB 4.03Å; L65-V214 HydrophobicContact CD2-CG1 4.14Å; L65-V214 HydrophobicContact CD2-CG2 3.74Å; F197-V214 HydrophobicContact CB-CB 4.22Å; F197-V214 HydrophobicContact CD2-CG1 4.47Å; F197-V214 PolarHBondContact N-O 3.39Å; F197-V214 PolarHBondContact O-N 3.41Å; F197-V214 VanDerWaalsContact O-N 3.1Å; V214-W234 HydrophobicContact CG2-CH2 4.21Å; V214-W234 HydrophobicContact CG2-CZ3 4.24Å
215	R	98.4	Very high	97.3	Very high	139 Å²	139	61.1 Å²	61.1	53%	0.525	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.2	-179.9	-56	-179	-175.6	-83.3	2.6	109.1	F195 V196 V213	F195-R215 WeakPolarHBondContact O-CA 3.38Å; V196-R215 HydrophobicContact CG1-CG 4.37Å; V196-R215 HydrophobicContact CG2-CG 4.29Å; V196-R215 VanDerWaalsContact CG2-NH1 3.35Å; V213-R215 HydrophobicContact CG1-CG 4.01Å
216	L	97.4	Very high	97.6	Very high	3 Å²	3	51.3 Å²	51.3	2%	0.016	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	141.9	164	96.8	150.2	0	0	0	111.9	I60 Y69 F195 F197 L218 L224	I60-L216 HydrophobicContact CD1-CD1 3.83Å; I60-L216 HydrophobicContact CD1-CD2 4.3Å; Y69-L216 HydrophobicContact CD1-CD1 4.06Å; Y69-L216 HydrophobicContact CD2-CD1 3.37Å; Y69-L216 HydrophobicContact CE1-CD1 4.38Å; Y69-L216 HydrophobicContact CE2-CD1 3.73Å; Y69-L216 HydrophobicContact CG-CD1 3.53Å; F195-L216 HydrophobicContact CB-CD2 4.08Å; F195-L216 WeakPolarHBondContact CB-O 3.23Å; F195-L216 HydrophobicContact CD1-CD2 4.2Å; F195-L216 PolarHBondContact N-O 2.77Å; F195-L216 PolarHBondContact O-N 2.93Å; F197-L216 HydrophobicContact CE2-CD2 4.22Å; L216-L218 HydrophobicContact CD1-CD2 3.86Å; L216-L218 HydrophobicContact CD2-CD2 3.9Å; L216-L218 HydrophobicContact CD2-CG 4.48Å; L216-L218 HydrophobicContact CG-CD2 3.86Å; L216-L218 HydrophobicContact CG-CG 4.48Å; L216-L224 HydrophobicContact CD2-CD1 4.38Å; L216-L224 HydrophobicContact CD2-CD2 4.3Å
217	P	98.3	Very high	97.8	Very high	63 Å²	63	47.9 Å²	47.9	41%	0.409	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	127.8	164.6	28.8	-30.8	0	0	0	110	C192	C192-P217 VanDerWaalsContact SG-CB 3.52Å
218	L	98.8	Very high	97.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	101	170.3	-65.6	-178.7	0	0	0	109.3	Y69 C192 R193 F195 L216 L224	Y69-L218 HydrophobicContact CD2-CD2 4Å; Y69-L218 HydrophobicContact CE2-CD2 3.73Å; C192-L218 WeakPolarHBondContact CA-O 3.44Å; R193-L218 PolarHBondContact N-O 3.3Å; R193-L218 PolarHBondContact O-N 3.28Å; F195-L218 HydrophobicContact CB-CD1 3.69Å; F195-L218 HydrophobicContact CB-CG 3.74Å; F195-L218 HydrophobicContact CD2-CD1 3.6Å; F195-L218 HydrophobicContact CE2-CD1 4.35Å; F195-L218 HydrophobicContact CG-CD1 3.76Å; F195-L218 HydrophobicContact CG-CG 4.31Å; L216-L218 HydrophobicContact CD1-CD2 3.86Å; L216-L218 HydrophobicContact CD2-CD2 3.9Å; L216-L218 HydrophobicContact CD2-CG 4.48Å; L216-L218 HydrophobicContact CG-CD2 3.86Å; L216-L218 HydrophobicContact CG-CG 4.48Å; L218-L224 HydrophobicContact CD1-CD2 4.49Å; L218-L224 HydrophobicContact CD2-CB 3.99Å; L218-L224 HydrophobicContact CD2-CD2 4.15Å
219	A	98.8	Very high	98	Very high	30 Å²	30	47.4 Å²	47.4	25%	0.248	24%	0.237	C	C	.	.			trans	-72.9	168.1	-178.9	0	0	0	0	0	113.7	Y69 S222	Y69-A219 WeakPolarHBondContact OH-CB 3.4Å; Y69-A219 PolarHBondContact OH-N 2.98Å; A219-S222 PolarHBondContact N-OG 3.49Å; A219-S222 VanDerWaalsContact O-CB 3.3Å; A219-S222 WeakPolarHBondContact O-CB 3.42Å; A219-S222 PolarHBondContact O-N 3.08Å; A219-S222 PolarHBondContact O-OG 2.67Å
220	H	98.9	Very high	98.1	Very high	42 Å²	42	43.3 Å²	43.3	19%	0.194	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	134.4	170	-175.4	49.6	0	0	0	111.5	A78 D79 G190 S222	A78-H220 VanDerWaalsContact CB-CE1 3.46Å; A78-H220 WeakPolarHBondContact CB-CE1 3.23Å; A78-H220 WeakPolarHBondContact CB-NE2 3.33Å; A78-H220 PolarHBondContact O-CE1 2.86Å; A78-H220 PolarHBondContact O-NE2 2.89Å; D79-H220 PolarHBondContact N-NE2 3.31Å; D79-H220 IonicContact OD1-CD2 2.64Å; D79-H220 IonicContact OD1-NE2 3.59Å; D79-H220 PolarHBondContact OD1-NE2 2.86Å; G190-H220 PolarHBondContact N-ND1 2.93Å; H220-S222 PolarHBondContact O-N 3.17Å
221	G	98.8	Very high	98.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	72	10.1	-178.6	0	0	0	0	0	114.2	L72 F73 S188	L72-G221 PolarHBondContact N-O 2.8Å; F73-G221 PolarHBondContact N-O 3.31Å; S188-G221 WeakPolarHBondContact O-CA 3.49Å; S188-G221 PolarHBondContact O-N 3.18Å
222	S	98.9	Very high	98.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	149.1	-175.5	69.6	0	0	0	0	114.1	Y69 T70 V187 S188 A219 H220	Y69-S222 VanDerWaalsContact CE2-CB 3.43Å; Y69-S222 VanDerWaalsContact OH-CB 3.24Å; Y69-S222 WeakPolarHBondContact OH-CB 3.37Å; T70-S222 CarbonylContact O-C 3.55Å; T70-S222 VanDerWaalsContact O-CA 3.29Å; T70-S222 WeakPolarHBondContact O-CA 3.29Å; T70-S222 WeakPolarHBondContact O-CB 3.49Å; V187-S222 CarbonylContact C-O 3.57Å; V187-S222 VanDerWaalsContact CA-O 3.29Å; V187-S222 WeakPolarHBondContact CA-O 3.31Å; S188-S222 PolarHBondContact N-O 2.67Å; S188-S222 PolarHBondContact O-N 3.08Å; A219-S222 PolarHBondContact N-OG 3.49Å; A219-S222 VanDerWaalsContact O-CB 3.3Å; A219-S222 WeakPolarHBondContact O-CB 3.42Å; A219-S222 PolarHBondContact O-N 3.08Å; A219-S222 PolarHBondContact O-OG 2.67Å; H220-S222 PolarHBondContact O-N 3.17Å
223	L	98.9	Very high	98.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.4	171.1	170.1	64	0	0	0	109.1	W57 Y69 T70 L72 V145 T149 A185 S186 V187 M225	W57-L223 HydrophobicContact CH2-CD2 3.8Å; W57-L223 HydrophobicContact CZ3-CD2 4.19Å; Y69-L223 WeakPolarHBondContact CA-O 3.19Å; Y69-L223 WeakPolarHBondContact CD2-O 3.48Å; T70-L223 HydrophobicContact CG2-CB 4.19Å; T70-L223 PolarHBondContact N-O 3.07Å; T70-L223 PolarHBondContact O-N 3.12Å; L72-L223 HydrophobicContact CB-CB 3.95Å; L72-L223 HydrophobicContact CD2-CB 4.11Å; L72-L223 HydrophobicContact CD2-CD2 3.92Å; V145-L223 HydrophobicContact CG1-CD1 4.32Å; V145-L223 HydrophobicContact CG1-CD2 4.29Å; V145-L223 HydrophobicContact CG2-CD1 4.41Å; T149-L223 HydrophobicContact CG2-CD2 3.97Å; A185-L223 HydrophobicContact CB-CD1 3.92Å; S186-L223 CarbonylContact O-C 3.56Å; S186-L223 WeakPolarHBondContact O-CA 3.21Å; V187-L223 HydrophobicContact CG2-CD1 3.9Å; L223-M225 HydrophobicContact CD1-CG 4.37Å; L223-M225 HydrophobicContact CD1-SD 3.87Å; L223-M225 HydrophobicContact CD2-CG 4.1Å; L223-M225 HydrophobicContact CD2-SD 4.06Å; L223-M225 HydrophobicContact CG-CG 4.18Å; L223-M225 HydrophobicContact CG-SD 4.23Å
224	L	98.9	Very high	98.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	113.2	165.6	175	70.7	0	0	0	108.9	I60 C67 S68 Y69 S186 F195 F197 L216 L218 M226	I60-L224 HydrophobicContact CD1-CD1 4.06Å; C67-L224 HydrophobicContact CB-CD1 4Å; S68-L224 WeakPolarHBondContact O-CA 3.42Å; Y69-L224 HydrophobicContact CD2-CB 4.38Å; S186-L224 PolarHBondContact N-O 3.41Å; S186-L224 PolarHBondContact O-N 2.7Å; F195-L224 HydrophobicContact CD1-CD2 4.14Å; F195-L224 HydrophobicContact CE1-CD2 4Å; F195-L224 HydrophobicContact CZ-CD2 4.42Å; F197-L224 HydrophobicContact CE2-CD2 4.38Å; F197-L224 HydrophobicContact CZ-CD2 4.06Å; L216-L224 HydrophobicContact CD2-CD1 4.38Å; L216-L224 HydrophobicContact CD2-CD2 4.3Å; L218-L224 HydrophobicContact CD1-CD2 4.49Å; L218-L224 HydrophobicContact CD2-CB 3.99Å; L218-L224 HydrophobicContact CD2-CD2 4.15Å; L224-M226 HydrophobicContact CD2-CG 4.07Å; L224-M226 HydrophobicContact CD2-SD 4.28Å; L224-M226 HydrophobicContact CG-CG 4.08Å
225	M	98.8	Very high	98.1	Very high	9 Å²	9	29.8 Å²	29.8	4%	0.044	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	120.7	168.9	-65.4	-60.8	-68.8	0	0	109.1	W57 C67 S68 T149 Q151 F153 P183 A185 L223	W57-M225 HydrophobicContact CH2-CG 4.49Å; W57-M225 HydrophobicContact CZ3-CG 4.18Å; C67-M225 CarbonylContact C-O 3.6Å; C67-M225 WeakPolarHBondContact CA-O 3.28Å; C67-M225 VanDerWaalsContact CB-O 3.31Å; C67-M225 WeakPolarHBondContact CB-O 3.35Å; S68-M225 PolarHBondContact N-O 3.27Å; S68-M225 PolarHBondContact O-N 3.45Å; T149-M225 HydrophobicContact CG2-CE 4.24Å; T149-M225 HydrophobicContact CG2-CG 4.32Å; T149-M225 HydrophobicContact CG2-SD 3.98Å; Q151-M225 HydrophobicContact CG-CE 3.97Å; F153-M225 HydrophobicContact CZ-CE 4.31Å; P183-M225 HydrophobicContact CB-CE 3.97Å; P183-M225 HydrophobicContact CG-CE 4.03Å; A185-M225 HydrophobicContact CB-CE 4.36Å; A185-M225 HydrophobicContact CB-SD 3.55Å; A185-M225 VanDerWaalsContact CB-SD 3.55Å; L223-M225 HydrophobicContact CD1-CG 4.37Å; L223-M225 HydrophobicContact CD1-SD 3.87Å; L223-M225 HydrophobicContact CD2-CG 4.1Å; L223-M225 HydrophobicContact CD2-SD 4.06Å; L223-M225 HydrophobicContact CG-CG 4.18Å; L223-M225 HydrophobicContact CG-SD 4.23Å
226	M	98.6	Very high	98.1	Very high	8 Å²	8	23.6 Å²	23.6	4%	0.039	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	104.1	173.1	-61.7	-174.3	-66.9	0	0	108.8	P183 I184 F195 F197 L224	P183-M226 WeakPolarHBondContact CA-O 3.41Å; I184-M226 HydrophobicContact CB-CB 4.43Å; I184-M226 HydrophobicContact CB-CE 3.97Å; I184-M226 HydrophobicContact CG2-CE 3.58Å; I184-M226 PolarHBondContact N-O 3.16Å; I184-M226 PolarHBondContact O-N 3.17Å; F195-M226 HydrophobicContact CE1-SD 4.36Å; F195-M226 HydrophobicContact CZ-SD 4.2Å; F197-M226 HydrophobicContact CE1-CG 4.49Å; F197-M226 HydrophobicContact CE1-SD 3.89Å; F197-M226 HydrophobicContact CZ-CG 4.25Å; F197-M226 HydrophobicContact CZ-SD 3.99Å; L224-M226 HydrophobicContact CD2-CG 4.07Å; L224-M226 HydrophobicContact CD2-SD 4.28Å; L224-M226 HydrophobicContact CG-CG 4.08Å
227	N	98.3	Very high	98.1	Very high	42 Å²	42	24 Å²	24	23%	0.225	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	156.8	-177.4	-57.1	-33.8	0	0	0	110.9	D66 T230	D66-N227 HydrophobicContact CB-CB 4.34Å; D66-N227 WeakPolarHBondContact O-CB 3.49Å; D66-N227 PolarHBondContact O-N 2.98Å; D66-N227 WeakPolarHBondContact OD2-CB 3.48Å; D66-N227 PolarHBondContact OD2-ND2 3.04Å; N227-T230 WeakPolarHBondContact O-CB 3.46Å; N227-T230 PolarHBondContact O-N 2.94Å; N227-T230 PolarHBondContact O-OG1 3.3Å
228	H	96.7	Very high	98.2	Very high	106 Å²	106	21 Å²	21	49%	0.491	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	137.6	166.7	-174.2	81.5	0	0	0	110.1
229	P	97.3	Very high	98.1	Very high	38 Å²	38	22.4 Å²	22.4	25%	0.247	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	cis	-101.3	25.6	9.2	41.8	-37.8	0	0	0	113.9	N231 T232 H233	P229-N231 VanDerWaalsContact C-N 3.35Å; P229-N231 PolarHBondContact O-N 2.94Å; P229-T232 WeakPolarHBondContact O-CA 3.38Å; P229-T232 VanDerWaalsContact O-CB 3.23Å; P229-T232 WeakPolarHBondContact O-CB 3.37Å; P229-T232 PolarHBondContact O-N 3.27Å; P229-H233 PolarHBondContact O-CD2 3.16Å; P229-H233 PolarHBondContact O-N 2.87Å; P229-H233 VanDerWaalsContact O-N 3.17Å
230	T	98.3	Very high	98.1	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-49.6	-53.6	-175.4	-64.8	0	0	0	0	112.3	G64 L65 D66 F197 N227 T232 H233 W234	G64-T230 WeakPolarHBondContact O-CA 3.22Å; L65-T230 HydrophobicContact CD1-CG2 3.44Å; L65-T230 VanDerWaalsContact CD1-CG2 3.44Å; D66-T230 PolarHBondContact N-OG1 2.8Å; D66-T230 PolarHBondContact O-OG1 3.1Å; F197-T230 HydrophobicContact CD1-CG2 4.33Å; F197-T230 HydrophobicContact CE1-CG2 3.85Å; N227-T230 WeakPolarHBondContact O-CB 3.46Å; N227-T230 PolarHBondContact O-N 2.94Å; N227-T230 PolarHBondContact O-OG1 3.3Å; T230-T232 PolarHBondContact O-N 2.7Å; T230-H233 PolarHBondContact O-N 2.85Å; T230-H233 VanDerWaalsContact O-N 3.16Å; T230-W234 HydrophobicContact CG2-CB 4.35Å; T230-W234 WeakPolarHBondContact O-CB 3.39Å; T230-W234 PolarHBondContact O-N 3.08Å
231	N	96	Very high	98.1	Very high	10 Å²	10	25.4 Å²	25.4	5%	0.053	13%	0.129	C	C	.	.	H	α-helix	trans	-74.2	-7.9	-175.7	-170.6	72.8	0	0	0	113	R172 D173 E175 P229	R172-N231 VanDerWaalsContact CD-O 3.27Å; R172-N231 WeakPolarHBondContact CD-O 3.49Å; D173-N231 PolarHBondContact N-OD1 2.8Å; D173-N231 PolarHBondContact O-ND2 3.23Å; E175-N231 WeakPolarHBondContact CG-ND2 3.23Å; E175-N231 VanDerWaalsContact OE1-CB 3.23Å; E175-N231 WeakPolarHBondContact OE1-CB 3.48Å; E175-N231 PolarHBondContact OE1-ND2 2.94Å; P229-N231 VanDerWaalsContact C-N 3.35Å; P229-N231 PolarHBondContact O-N 2.94Å
232	T	95.6	Very high	98	Very high	38 Å²	38	33.5 Å²	33.5	23%	0.233	16%	0.164	C	C	.	.	H	α-helix	trans	-80.1	-43.7	166.9	-50.8	0	0	0	0	111.8	R172 P229 T230	R172-T232 PolarHBondContact NH1-O 3.21Å; P229-T232 WeakPolarHBondContact O-CA 3.38Å; P229-T232 VanDerWaalsContact O-CB 3.23Å; P229-T232 WeakPolarHBondContact O-CB 3.37Å; P229-T232 PolarHBondContact O-N 3.27Å; T230-T232 PolarHBondContact O-N 2.7Å
233	H	97.5	Very high	98	Very high	54 Å²	54	43.4 Å²	43.4	25%	0.25	21%	0.207	C	C	.	.	H	α-helix	trans	-99.7	-24.8	-171.3	-67.8	-87.9	0	0	0	114.8	K200 P229 T230	K200-H233 WeakPolarHBondContact CB-O 3.44Å; K200-H233 WeakPolarHBondContact CG-O 3.44Å; K200-H233 PolarHBondContact N-O 2.68Å; P229-H233 PolarHBondContact O-CD2 3.16Å; P229-H233 PolarHBondContact O-N 2.87Å; P229-H233 VanDerWaalsContact O-N 3.17Å; T230-H233 PolarHBondContact O-N 2.85Å; T230-H233 VanDerWaalsContact O-N 3.16Å
234	W	98.4	Very high	98	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	128	-170.2	-66.9	79.6	0	0	0	111.6	A62 E63 G64 L65 R172 F197 H199 V211 A212 V214 T230	A62-W234 HydrophobicContact CB-CH2 4.05Å; A62-W234 HydrophobicContact CB-CZ2 3.71Å; E63-W234 WeakPolarHBondContact O-CZ2 3.46Å; E63-W234 PolarHBondContact O-NE1 2.85Å; G64-W234 PolarHBondContact O-NE1 3.29Å; L65-W234 HydrophobicContact CB-CD2 4.25Å; L65-W234 HydrophobicContact CB-CG 4.37Å; L65-W234 HydrophobicContact CB-CZ2 4.09Å; L65-W234 HydrophobicContact CD1-CD2 4.34Å; L65-W234 HydrophobicContact CD1-CG 4.11Å; R172-W234 WeakPolarHBondContact CG-O 3.5Å; F197-W234 HydrophobicContact CB-CD2 4.46Å; F197-W234 HydrophobicContact CB-CE3 3.67Å; F197-W234 HydrophobicContact CB-CZ3 4.23Å; F197-W234 HydrophobicContact CD1-CB 4.25Å; H199-W234 HydrophobicContact CB-CD2 4.17Å; H199-W234 HydrophobicContact CB-CE3 4.11Å; H199-W234 HydrophobicContact CB-CH2 4.06Å; H199-W234 HydrophobicContact CB-CZ2 4.07Å; H199-W234 HydrophobicContact CB-CZ3 4.07Å; H199-W234 AromaticContact CD2-CE2 3.68Å; H199-W234 AromaticContact CD2-CZ2 3.97Å; H199-W234 AromaticContact CD2-NE1 3.62Å; V211-W234 HydrophobicContact CG1-CH2 3.62Å; V211-W234 HydrophobicContact CG1-CZ2 3.88Å; A212-W234 WeakPolarHBondContact O-CH2 3.44Å; V214-W234 HydrophobicContact CG2-CH2 4.21Å; V214-W234 HydrophobicContact CG2-CZ3 4.24Å; T230-W234 HydrophobicContact CG2-CB 4.35Å; T230-W234 WeakPolarHBondContact O-CB 3.39Å; T230-W234 PolarHBondContact O-N 3.08Å
235	Y	98.3	Very high	98	Very high	43 Å²	43	52 Å²	52	17%	0.169	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	146.7	162.7	-77.2	-105.8	0	0	0	109	E170 H171 R172 F197 R198 K200 R203	E170-Y235 HydrophobicContact CB-CD1 4.29Å; H171-Y235 CarbonylContact O-C 3.57Å; H171-Y235 VanDerWaalsContact O-CA 3.27Å; H171-Y235 WeakPolarHBondContact O-CA 3.43Å; R172-Y235 HydrophobicContact CG-CD1 3.96Å; R172-Y235 HydrophobicContact CG-CD2 3.91Å; R172-Y235 HydrophobicContact CG-CE1 4.01Å; R172-Y235 HydrophobicContact CG-CE2 3.99Å; R172-Y235 HydrophobicContact CG-CG 3.89Å; R172-Y235 PolarHBondContact NE-OH 3.12Å; F197-Y235 CarbonylContact C-O 3.53Å; F197-Y235 VanDerWaalsContact CA-O 3.31Å; F197-Y235 WeakPolarHBondContact CA-O 3.46Å; R198-Y235 PolarHBondContact N-O 3.2Å; R198-Y235 PolarHBondContact O-N 3.2Å; K200-Y235 HydrophobicContact CB-CD2 4.2Å; K200-Y235 HydrophobicContact CB-CE2 4.01Å; R203-Y235 VanDerWaalsContact CZ-CE1 3.43Å; R203-Y235 VanDerWaalsContact NH1-CE2 3.25Å; R203-Y235 PolarHBondContact NH1-OH 3.04Å
236	H	98.5	Very high	98	Very high	8 Å²	8	54.1 Å²	54.1	4%	0.037	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	156.2	174.8	59.6	-91.4	0	0	0	112.3	E170 H171 D173 F195 V196 F197	E170-H236 WeakPolarHBondContact CA-O 3.35Å; H171-H236 AromaticContact CD2-NE2 3.88Å; H171-H236 AromaticContact CE1-CD2 3.39Å; H171-H236 PolarHBondContact CE1-CD2 2.89Å; H171-H236 AromaticContact CE1-NE2 3.41Å; H171-H236 PolarHBondContact CE1-NE2 3.35Å; H171-H236 PolarHBondContact N-O 2.7Å; H171-H236 PolarHBondContact ND1-O 2.83Å; H171-H236 VanDerWaalsContact ND1-O 3.08Å; H171-H236 AromaticContact NE2-CD2 3.71Å; H171-H236 AromaticContact NE2-NE2 3.19Å; H171-H236 PolarHBondContact NE2-NE2 2.85Å; H171-H236 VanDerWaalsContact NE2-NE2 3.19Å; H171-H236 PolarHBondContact O-N 3.21Å; D173-H236 IonicContact OD1-NE2 2.7Å; F195-H236 HydrophobicContact CE1-CB 3.56Å; F195-H236 HydrophobicContact CE2-CB 4.49Å; F195-H236 AromaticContact CE2-CD2 4Å; F195-H236 HydrophobicContact CZ-CB 3.53Å; F195-H236 AromaticContact CZ-CD2 3.42Å; F195-H236 VanDerWaalsContact CZ-CD2 3.42Å; F195-H236 WeakPolarHBondContact CZ-CD2 3.43Å; F195-H236 AromaticContact CZ-CG 3.66Å; V196-H236 CarbonylContact O-C 3.59Å; V196-H236 WeakPolarHBondContact O-CA 3.47Å; F197-H236 HydrophobicContact CD1-CB 3.85Å; F197-H236 HydrophobicContact CE1-CB 4.05Å
237	S	98.5	Very high	98	Very high	11 Å²	11	55.4 Å²	55.4	8%	0.077	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	156	-177.7	60.1	0	0	0	0	112.2	I168 V196 P239	I168-S237 WeakPolarHBondContact O-CB 3.27Å; V196-S237 PolarHBondContact N-O 2.78Å; V196-S237 PolarHBondContact O-N 3.44Å; S237-P239 WeakPolarHBondContact O-CD 3.27Å
238	L	98.6	Very high	98	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	84.3	167.9	-157.2	93.3	0	0	0	107.7	Y161 H167 I168 R193 D194 F195	Y161-L238 HydrophobicContact CD1-CD2 3.74Å; Y161-L238 HydrophobicContact CD2-CD2 4.02Å; Y161-L238 HydrophobicContact CE1-CB 4.49Å; Y161-L238 HydrophobicContact CE1-CD2 3.53Å; Y161-L238 HydrophobicContact CE2-CD2 3.86Å; Y161-L238 HydrophobicContact CG-CD2 3.98Å; H167-L238 WeakPolarHBondContact CA-O 3.15Å; H167-L238 WeakPolarHBondContact CB-O 3.43Å; I168-L238 HydrophobicContact CG2-CB 3.68Å; I168-L238 PolarHBondContact N-O 2.94Å; I168-L238 VanDerWaalsContact N-O 3.16Å; I168-L238 PolarHBondContact O-N 2.8Å; R193-L238 HydrophobicContact CB-CD1 3.77Å; R193-L238 HydrophobicContact CB-CD2 3.99Å; R193-L238 HydrophobicContact CB-CG 4.02Å; R193-L238 HydrophobicContact CG-CD2 4.13Å; D194-L238 WeakPolarHBondContact O-CD1 3.34Å; F195-L238 HydrophobicContact CB-CD1 4.48Å; F195-L238 HydrophobicContact CD2-CD1 3.92Å
239	P	98.4	Very high	98.1	Very high	30 Å²	30	48.4 Å²	48.4	20%	0.195	25%	0.247	C	C	.	.			trans	-67.4	162.6	-170.7	28.4	-38.7	0	0	0	113.5	R193 D194 V196 S237 R241	R193-P239 PolarHBondContact NH2-O 3.17Å; D194-P239 WeakPolarHBondContact O-CD 3.23Å; V196-P239 HydrophobicContact CG2-CG 3.93Å; S237-P239 WeakPolarHBondContact O-CD 3.27Å; P239-R241 VanDerWaalsContact CG-NH1 3.29Å; P239-R241 PolarHBondContact O-N 2.87Å
240	V	98.6	Very high	98.2	Very high	57 Å²	57	47 Å²	47	35%	0.345	24%	0.238	S	C	.	.			trans	-58.5	134.4	173.4	174.2	0	0	0	0	110.6	G164 H167 K242	G164-V240 CarbonylContact O-C 3.52Å; G164-V240 VanDerWaalsContact O-CA 3.32Å; G164-V240 WeakPolarHBondContact O-CA 3.48Å; G164-V240 WeakPolarHBondContact O-CG1 3.02Å; H167-V240 HydrophobicContact CB-CG2 3.86Å; V240-K242 HydrophobicContact CG1-CG 3.94Å
241	R	98.3	Very high	98.2	Very high	78 Å²	78	46.9 Å²	46.9	29%	0.294	24%	0.237	S	C	.	.			trans	-140.2	79	177.1	-68.8	-63.1	-176.6	-89	-2.7	109.6	G164 D194 P239 K243 V244	G164-R241 VanDerWaalsContact CA-O 3.31Å; G164-R241 WeakPolarHBondContact CA-O 3.46Å; G164-R241 PolarHBondContact O-N 3.16Å; D194-R241 IonicContact OD2-CZ 3.12Å; D194-R241 IonicContact OD2-NE 2.7Å; D194-R241 PolarHBondContact OD2-NE 2.98Å; D194-R241 IonicContact OD2-NH2 3.34Å; D194-R241 PolarHBondContact OD2-NH2 3.17Å; P239-R241 VanDerWaalsContact CG-NH1 3.29Å; P239-R241 PolarHBondContact O-N 2.87Å; R241-K243 PolarHBondContact O-N 3.18Å; R241-V244 HydrophobicContact CB-CG2 3.95Å; R241-V244 PolarHBondContact O-N 3.47Å
242	K	97.5	Very high	98.3	Very high	170 Å²	170	47 Å²	47	74%	0.739	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-19.4	-172.1	-62.8	-172.9	177.3	-176.5	0	116.1	V240	V240-K242 HydrophobicContact CG1-CG 3.94Å
243	K	98.4	Very high	98.5	Very high	207 Å²	207	45.2 Å²	45.2	90%	0.9	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-11.8	177	-63.3	-174.1	178.3	-176.4	0	113.8	R241	R241-K243 PolarHBondContact O-N 3.18Å
244	V	98.6	Very high	98.5	Very high	35 Å²	35	42.9 Å²	42.9	21%	0.212	22%	0.216	C	C	.	.			trans	-86	114.6	175.1	-179.3	0	0	0	0	108.2	G164 A191 R241	G164-V244 WeakPolarHBondContact CA-O 3.48Å; G164-V244 PolarHBondContact N-O 3.21Å; A191-V244 HydrophobicContact CB-CG1 3.83Å; R241-V244 HydrophobicContact CB-CG2 3.95Å; R241-V244 PolarHBondContact O-N 3.47Å
245	L	98.6	Very high	98.3	Very high	147 Å²	147	47 Å²	47	77%	0.77	23%	0.234	S	C	*	.			trans	-105.8	-10.9	-176.2	-54.2	-178.8	0	0	0	113.1
246	A	98.7	Very high	98.1	Very high	52 Å²	52	45.3 Å²	45.3	43%	0.43	23%	0.228	S	C	.	.	S	Bend	trans	-97.7	151.3	-177.5	0	0	0	0	0	111.8	A191	A191-A246 HydrophobicContact CB-CB 3.96Å; A191-A246 WeakPolarHBondContact CB-O 3.37Å
247	P	98.8	Very high	97.6	Very high	35 Å²	35	48.7 Å²	48.7	23%	0.227	25%	0.246	C	C	.	.			trans	-70.5	153.9	179	25.8	-32.9	0	0	0	113.2	F82 Y161 K162 A191	F82-P247 HydrophobicContact CZ-CB 4.33Å; F82-P247 HydrophobicContact CZ-CG 3.95Å; Y161-P247 CarbonylContact O-C 3.59Å; Y161-P247 VanDerWaalsContact O-CA 3.23Å; Y161-P247 WeakPolarHBondContact O-CA 3.41Å; K162-P247 WeakPolarHBondContact O-CA 3.46Å; A191-P247 WeakPolarHBondContact CB-O 3.34Å; A191-P247 PolarHBondContact N-O 2.81Å
248	R	98.9	Very high	96.8	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.008	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	133.3	170.8	174.2	-177.4	176.5	-97.2	-2.5	109.6	R160 Y161 S188 F189 A191 R193 N250	R160-R248 WeakPolarHBondContact CA-O 3.22Å; Y161-R248 HydrophobicContact CD2-CB 4.39Å; Y161-R248 HydrophobicContact CD2-CG 4.37Å; Y161-R248 PolarHBondContact N-O 3.44Å; Y161-R248 PolarHBondContact O-N 3Å; S188-R248 PolarHBondContact OG-NH2 3.37Å; F189-R248 WeakPolarHBondContact O-CA 3.23Å; A191-R248 HydrophobicContact CB-CB 4.43Å; A191-R248 WeakPolarHBondContact O-CD 3.4Å; R193-R248 HydrophobicContact CG-CB 4.4Å; R193-R248 VanDerWaalsContact CG-CD 3.44Å; R248-N250 PolarHBondContact NH2-OD1 2.8Å
249	V	98.9	Very high	95.3	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	130.4	169	177.8	0	0	0	0	108.6	F82 L85 E86 I158 R160 F189 L251	F82-V249 HydrophobicContact CD2-CB 4.48Å; F82-V249 HydrophobicContact CD2-CG2 4.4Å; F82-V249 HydrophobicContact CE2-CB 4.22Å; F82-V249 HydrophobicContact CE2-CG2 3.84Å; L85-V249 HydrophobicContact CD1-CG1 4.09Å; E86-V249 VanDerWaalsContact OE1-CG2 3.25Å; E86-V249 WeakPolarHBondContact OE1-CG2 3.5Å; I158-V249 HydrophobicContact CG2-CG1 3.78Å; R160-V249 HydrophobicContact CB-CG2 4.24Å; R160-V249 HydrophobicContact CG-CG2 4Å; F189-V249 PolarHBondContact N-O 3.07Å; F189-V249 PolarHBondContact O-N 2.82Å; V249-L251 HydrophobicContact CG1-CD1 4Å
250	N	98.9	Very high	92.9	Very high	7 Å²	7	66.8 Å²	66.8	4%	0.037	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.8	178.5	169.1	104.8	0	0	0	110.1	I158 N159 Y161 S186 V187 R248 T252	I158-N250 CarbonylContact C-O 3.58Å; I158-N250 VanDerWaalsContact CA-O 3.31Å; I158-N250 WeakPolarHBondContact CA-O 3.46Å; N159-N250 HydrophobicContact CB-CB 4.48Å; N159-N250 PolarHBondContact N-O 3.25Å; N159-N250 PolarHBondContact O-N 3.21Å; Y161-N250 HydrophobicContact CE2-CB 4.22Å; S186-N250 PolarHBondContact OG-OD1 3.08Å; V187-N250 CarbonylContact O-C 3.54Å; V187-N250 WeakPolarHBondContact O-CA 3.45Å; R248-N250 PolarHBondContact NH2-OD1 2.8Å; N250-T252 PolarHBondContact ND2-OG1 3.25Å
251	L	98.9	Very high	90.4	Very high	0 Å²	0	77.2 Å²	77.2	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117.9	175.2	-64.9	84.3	0	0	0	108.5	L85 L138 I141 V156 I158 S186 V187 F189 V249 F253	L85-L251 HydrophobicContact CD1-CD1 3.89Å; L85-L251 HydrophobicContact CD2-CD2 4.36Å; L138-L251 HydrophobicContact CD2-CD2 3.41Å; L138-L251 VanDerWaalsContact CD2-CD2 3.41Å; I141-L251 HydrophobicContact CD1-CD2 3.62Å; I141-L251 HydrophobicContact CG2-CD2 4.41Å; V156-L251 HydrophobicContact CG2-CB 3.73Å; V156-L251 HydrophobicContact CG2-CD2 4.35Å; V156-L251 HydrophobicContact CG2-CG 4.32Å; I158-L251 HydrophobicContact CG1-CG 4.41Å; S186-L251 CarbonylContact C-O 3.57Å; S186-L251 WeakPolarHBondContact CA-O 3.4Å; V187-L251 HydrophobicContact CB-CB 4.42Å; V187-L251 PolarHBondContact N-O 3.14Å; V187-L251 PolarHBondContact O-N 2.92Å; F189-L251 HydrophobicContact CD2-CD1 3.74Å; F189-L251 HydrophobicContact CE2-CD1 3.88Å; V249-L251 HydrophobicContact CG1-CD1 4Å; L251-F253 HydrophobicContact CB-CD2 4.21Å; L251-F253 HydrophobicContact CB-CE2 3.64Å; L251-F253 HydrophobicContact CB-CZ 4.23Å; L251-F253 HydrophobicContact CD2-CE2 3.97Å; L251-F253 HydrophobicContact CD2-CZ 3.81Å; L251-F253 HydrophobicContact CG-CE2 4.49Å
252	T	98.4	Very high	90	Very high	12 Å²	12	77.2 Å²	77.2	7%	0.074	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	95.9	176.4	-56.7	0	0	0	0	108.4	V156 L157 I184 A185 N250 R254	V156-T252 WeakPolarHBondContact CA-O 3.4Å; L157-T252 PolarHBondContact N-O 3.08Å; L157-T252 PolarHBondContact O-N 3.46Å; I184-T252 HydrophobicContact CG2-CG2 3.25Å; A185-T252 CarbonylContact O-C 3.54Å; A185-T252 WeakPolarHBondContact O-CA 3.38Å; N250-T252 PolarHBondContact ND2-OG1 3.25Å; T252-R254 HydrophobicContact CG2-CG 4.37Å
253	F	98.4	Very high	89.6	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	138.8	178	-67	-87.8	0	0	0	111	W134 I141 R142 F153 F155 V156 A185 V187 L251	W134-F253 HydrophobicContact CH2-CD1 4.14Å; W134-F253 AromaticContact CH2-CE1 3.95Å; W134-F253 HydrophobicContact CH2-CE1 3.95Å; W134-F253 AromaticContact CZ3-CE1 3.95Å; W134-F253 HydrophobicContact CZ3-CE1 3.95Å; I141-F253 HydrophobicContact CB-CE2 4.46Å; I141-F253 HydrophobicContact CB-CZ 4.09Å; I141-F253 HydrophobicContact CG2-CE2 3.58Å; I141-F253 HydrophobicContact CG2-CZ 3.71Å; R142-F253 HydrophobicContact CB-CD1 4.31Å; R142-F253 HydrophobicContact CB-CE1 3.72Å; R142-F253 HydrophobicContact CB-CZ 4.28Å; R142-F253 HydrophobicContact CG-CD1 4.4Å; R142-F253 HydrophobicContact CG-CE1 4.27Å; F153-F253 HydrophobicContact CB-CB 3.88Å; F153-F253 HydrophobicContact CB-CD1 4.28Å; F153-F253 HydrophobicContact CD1-CB 3.72Å; F153-F253 HydrophobicContact CD2-CB 4.13Å; F153-F253 HydrophobicContact CE1-CB 4.29Å; F153-F253 HydrophobicContact CG-CB 3.63Å; F155-F253 CarbonylContact O-C 3.54Å; F155-F253 WeakPolarHBondContact O-CA 3Å; V156-F253 HydrophobicContact CB-CD1 3.74Å; V156-F253 HydrophobicContact CB-CE1 3.8Å; V156-F253 HydrophobicContact CB-CG 4.32Å; V156-F253 HydrophobicContact CB-CZ 4.44Å; V156-F253 HydrophobicContact CG1-CE1 4.42Å; V156-F253 HydrophobicContact CG2-CD1 3.9Å; V156-F253 HydrophobicContact CG2-CD2 4.22Å; V156-F253 HydrophobicContact CG2-CE1 3.87Å; V156-F253 HydrophobicContact CG2-CE2 4.2Å; V156-F253 HydrophobicContact CG2-CG 4.07Å; V156-F253 HydrophobicContact CG2-CZ 4.03Å; A185-F253 HydrophobicContact CB-CB 4.18Å; A185-F253 PolarHBondContact N-O 3.43Å; A185-F253 VanDerWaalsContact N-O 3.1Å; A185-F253 PolarHBondContact O-N 2.85Å; V187-F253 HydrophobicContact CG2-CD2 4.18Å; V187-F253 HydrophobicContact CG2-CE2 4.04Å; L251-F253 HydrophobicContact CB-CD2 4.21Å; L251-F253 HydrophobicContact CB-CE2 3.64Å; L251-F253 HydrophobicContact CB-CZ 4.23Å; L251-F253 HydrophobicContact CD2-CE2 3.97Å; L251-F253 HydrophobicContact CD2-CZ 3.81Å; L251-F253 HydrophobicContact CG-CE2 4.49Å
254	R	96.9	Very high	89.1	Confident	6 Å²	6	64.8 Å²	64.8	2%	0.023	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	158.2	-174	-56.4	179.6	177.6	163.8	-1.3	110.5	Y122 N154 F155 D173 L178 I184 T252	Y122-R254 PolarHBondContact OH-NH1 3.32Å; N154-R254 PolarHBondContact N-O 3.36Å; N154-R254 PolarHBondContact OD1-O 2.98Å; F155-R254 HydrophobicContact CD1-CB 4.19Å; F155-R254 HydrophobicContact CD1-CG 4.48Å; F155-R254 PolarHBondContact N-O 2.72Å; F155-R254 PolarHBondContact O-N 2.7Å; D173-R254 IonicContact OD1-CZ 3.77Å; D173-R254 IonicContact OD1-NH2 3.21Å; D173-R254 PolarHBondContact OD1-NH2 2.76Å; D173-R254 IonicContact OD2-CZ 3.84Å; D173-R254 IonicContact OD2-NE 3.07Å; D173-R254 PolarHBondContact OD2-NE 3.25Å; D173-R254 IonicContact OD2-NH2 3.31Å; D173-R254 PolarHBondContact OD2-NH2 3.24Å; L178-R254 HydrophobicContact CD2-CB 4.04Å; L178-R254 HydrophobicContact CD2-CG 4.41Å; I184-R254 HydrophobicContact CG1-CG 4.41Å; T252-R254 HydrophobicContact CG2-CG 4.37Å
255	K	96.1	Very high	88.6	Confident	86 Å²	86	66.6 Å²	66.6	37%	0.374	34%	0.335	S	S	.	.			trans	-107.3	98.6	170	-166.5	167.7	-170.9	159.6	0	108.8	T152 N154 L178 A179	T152-K255 PolarHBondContact OG1-NZ 2.84Å; N154-K255 WeakPolarHBondContact OD1-CA 3.4Å; L178-K255 WeakPolarHBondContact CA-O 3.5Å; A179-K255 HydrophobicContact CB-CB 4.25Å; A179-K255 HydrophobicContact CB-CD 4.31Å; A179-K255 HydrophobicContact CB-CG 4.04Å; A179-K255 PolarHBondContact N-O 3.01Å
256	I	92.6	Very high	88	Confident	7 Å²	7	61.6 Å²	61.6	4%	0.036	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-83.5	140.5	-178.9	-60.3	-74.3	0	0	0	109.4	L120 Y122 N154 F155 E177 L178	L120-I256 HydrophobicContact CD2-CB 4.35Å; L120-I256 HydrophobicContact CD2-CG2 4.21Å; Y122-I256 HydrophobicContact CD2-CD1 3.95Å; Y122-I256 HydrophobicContact CE2-CD1 4.4Å; N154-I256 PolarHBondContact ND2-O 3.01Å; N154-I256 PolarHBondContact OD1-N 2.76Å; F155-I256 HydrophobicContact CB-CB 4.39Å; F155-I256 HydrophobicContact CB-CG1 3.48Å; F155-I256 VanDerWaalsContact CB-CG1 3.48Å; F155-I256 HydrophobicContact CD1-CD1 4.29Å; F155-I256 HydrophobicContact CD1-CG1 4.02Å; F155-I256 HydrophobicContact CD2-CG1 4.29Å; F155-I256 HydrophobicContact CG-CD1 4.4Å; F155-I256 HydrophobicContact CG-CG1 3.69Å; E177-I256 CarbonylContact O-C 3.52Å; E177-I256 WeakPolarHBondContact O-CA 3.36Å; L178-I256 HydrophobicContact CD2-CD1 3.57Å
257	L	89.1	Confident	87.2	Confident	80 Å²	80	62.2 Å²	62.2	42%	0.419	30%	0.3	S	S	.	.			trans	-65.4	133.3	171.4	-69.6	173.6	0	0	0	109.8	E177 A179 T259	E177-L257 PolarHBondContact O-N 3.33Å; A179-L257 HydrophobicContact CB-CD2 4.3Å; L257-T259 PolarHBondContact O-N 3.26Å; L257-T259 VanDerWaalsContact O-N 3.12Å
258	L	80.8	Confident	86.4	Confident	128 Å²	128	64.1 Å²	64.1	67%	0.67	31%	0.305	S	S	*	.			trans	-66.3	114.6	168	-66	168.5	0	0	0	107.7	L120 K260	L120-L258 HydrophobicContact CD2-CD2 3.68Å; L258-K260 PolarHBondContact O-N 3.12Å
259	T	66.6	Low	85.5	Confident	86 Å²	86	68.9 Å²	68.9	53%	0.528	33%	0.328	S	S	.	.			trans	-59.8	111.2	166.7	39.4	0	0	0	0	107.5	T121 L257 K261	T121-T259 PolarHBondContact OG1-OG1 3.22Å; L257-T259 PolarHBondContact O-N 3.26Å; L257-T259 VanDerWaalsContact O-N 3.12Å; T259-K261 PolarHBondContact O-N 2.91Å
260	K	49.8	Very low	84.3	Confident	207 Å²	207	74.7 Å²	74.7	90%	0.9	36%	0.355	S	S	*	.			trans	-59.8	122	168.1	-70.6	-175.6	178.3	-178.3	0	106.8	L258	L258-K260 PolarHBondContact O-N 3.12Å
261	K	45.6	Very low	83	Confident	277 Å²	277	80.8 Å²	80.8	100%	1.204	38%	0.384	S	S	*	.			trans	-61.3	0	165.5	-76.3	-175.3	177	180	0	109.8	T259	T259-K261 PolarHBondContact O-N 2.91Å

Retrieved 261 of 261 residues in 69.9 ms (Link to these results)

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