A0A096MZD1_PAPAN Loading...

3'-5' exoribonuclease 1

AlphaFold DB , UniProt , Accession A0A096MZD1, Species PAPAN (Papio anubis, Olive baboon), Gene ERI1, Length 349 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	38.8	Very low	36.6	Very low	238 Å²	238	150.7 Å²	150.7	100%	1.172	82%	0.818	S	S	*	*				0	118	0	-60.1	177.3	-155.9	0	0	106.1
2	E	39.3	Very low	36.1	Very low	186 Å²	186	155.1 Å²	155.1	87%	0.869	83%	0.829	S	S	*	*			cis	-172.3	129.2	-8.5	-120	175	161.8	0	0	101.1
3	E	39.5	Very low	35.7	Very low	154 Å²	154	150.2 Å²	150.2	72%	0.72	82%	0.823	S	S	*	*			trans	-65.5	164.2	152.2	-78.5	-170.3	151.9	0	0	107.9
4	P	48.4	Very low	35.4	Very low	129 Å²	129	149.9 Å²	149.9	84%	0.838	83%	0.828	S	S	*	*				-140	148.9	104.4	29.5	-12.6	0	0	0	115.8
5	Q	34.3	Very low	35.4	Very low	156 Å²	156	148.4 Å²	148.4	73%	0.729	82%	0.824	S	S	*	*			trans	-61	175.7	166	-65.9	169.6	-23.9	0	0	115.2
6	S	33.8	Very low	35.6	Very low	101 Å²	101	146.1 Å²	146.1	71%	0.706	82%	0.818	S	S	*	*			trans	103.3	138.8	143.4	81.6	0	0	0	0	115
7	K	35.9	Very low	35.2	Very low	196 Å²	196	145.8 Å²	145.8	85%	0.852	82%	0.82	S	S	*	*			cis	-167.9	146.6	20.8	-127.1	154.7	-169.5	-176.5	0	109.4
8	E	34.1	Very low	35	Very low	177 Å²	177	146.3 Å²	146.3	83%	0.827	82%	0.82	S	S	*	*			trans	-63.4	172.4	158.5	-69.5	178	143.7	0	0	111.9
9	P	37.5	Very low	34.7	Very low	130 Å²	130	147.1 Å²	147.1	84%	0.844	82%	0.821	S	S	*	*				-126.5	143.6	122.9	34.1	-24.6	0	0	0	114.6
10	A	31.8	Very low	34.4	Very low	79 Å²	79	148.3 Å²	148.3	65%	0.653	82%	0.82	S	S	*	*			trans	-57.6	137.3	172.5	0	0	0	0	0	113.2
11	S	29.3	Very low	34.3	Very low	112 Å²	112	146.8 Å²	146.8	78%	0.783	82%	0.82	S	S	*	*				81.9	121.1	93.2	88.8	0	0	0	0	115
12	E	30.5	Very low	33.9	Very low	203 Å²	203	141.5 Å²	141.5	95%	0.949	80%	0.803	S	S	*	*			trans	-146.8	135.7	138.8	-119.8	175.1	-166.4	0	0	109.9
13	A	31.1	Very low	33.5	Very low	91 Å²	91	144.1 Å²	144.1	75%	0.752	81%	0.805	S	S	*	*			trans	-99.9	144.2	-167.3	0	0	0	0	0	111.1
14	V	31.7	Very low	33.7	Very low	147 Å²	147	142.1 Å²	142.1	89%	0.891	81%	0.805	S	S	*	*			trans	-145.3	119.4	150.1	-172.9	0	0	0	0	108.6
15	T	34.5	Very low	32.8	Very low	127 Å²	127	145.1 Å²	145.1	78%	0.779	81%	0.808	S	S	*	*			trans	-112.9	-177.5	165.7	48.7	0	0	0	0	108.6
16	P	38.8	Very low	32.4	Very low	112 Å²	112	141 Å²	141	73%	0.727	81%	0.808	S	S	*	*				-116.3	165.6	-78.7	34.3	-18.3	0	0	0	111
17	V	29.6	Very low	32.1	Very low	141 Å²	141	147.9 Å²	147.9	86%	0.855	82%	0.818	S	S	*	*			trans	-127.5	107.1	166.6	-176.7	0	0	0	0	109.9
18	L	31.5	Very low	31.7	Very low	154 Å²	154	146.9 Å²	146.9	81%	0.806	82%	0.817	S	S	*	*			trans	-85.2	135.8	157.3	-99.1	146.1	0	0	0	107.7
19	L	28.2	Very low	31.5	Very low	162 Å²	162	147.4 Å²	147.4	85%	0.848	82%	0.819	S	S	*	*			trans	-162	144.5	144.4	-111.6	138.2	0	0	0	112.8
20	E	28.9	Very low	30.9	Very low	171 Å²	171	149.5 Å²	149.5	80%	0.799	82%	0.818	S	S	*	*			trans	-83	169.7	-159.2	-65.4	167.5	132.2	0	0	115.4
21	S	32.5	Very low	30.8	Very low	117 Å²	117	152 Å²	152	82%	0.818	83%	0.827	S	S	*	*			trans	-45.6	160.7	166.6	-43.9	0	0	0	0	115.7
22	P	31.7	Very low	30.8	Very low	126 Å²	126	157.4 Å²	157.4	82%	0.818	83%	0.83	S	S	*	*			trans	-140	137.7	130.3	26.8	-7.7	0	0	0	115.7
23	R	29.1	Very low	30.8	Very low	241 Å²	241	153.9 Å²	153.9	91%	0.909	83%	0.825	S	S	*	*			trans	-117.5	172.1	141.1	-76.4	-173.5	-178.6	-174.4	1.2	105.7
24	P	44.7	Very low	30.7	Very low	112 Å²	112	155 Å²	155	73%	0.727	83%	0.828	S	S	*	*			cis	-133.4	171.5	9.1	26.5	-0.3	0	0	0	113.1
25	E	28.5	Very low	30.7	Very low	192 Å²	192	153.3 Å²	153.3	90%	0.897	82%	0.819	S	S	*	*				151.4	149	105	-77.5	-172	161.7	0	0	104.9
26	G	27.3	Very low	30.3	Very low	70 Å²	70	155.4 Å²	155.4	72%	0.722	82%	0.82	S	S	*	*			cis	176.8	157.1	0.6	0	0	0	0	0	108.8
27	R	26.6	Very low	29.8	Very low	245 Å²	245	159.6 Å²	159.6	93%	0.925	83%	0.83	S	S	*	*			trans	45.7	129.7	153.3	-59.7	-179.4	178.3	-175.4	-0.5	119.6
28	E	28.1	Very low	29.6	Very low	175 Å²	175	159.1 Å²	159.1	82%	0.818	83%	0.828	S	S	*	*				-167.6	125.9	74	-86.9	175.9	166.9	0	0	109.4
29	E	28.7	Very low	29.4	Very low	189 Å²	189	160.8 Å²	160.8	88%	0.883	83%	0.832	S	S	*	*				96.9	137.6	104.2	-84.8	-164.5	161.9	0	0	116.2
30	Q	26.2	Very low	29.3	Very low	173 Å²	173	160.8 Å²	160.8	81%	0.808	83%	0.827	S	S	*	*			trans	-82.8	167.8	-165.7	-62.1	-179.5	-17.8	0	0	113.7
31	P	28.4	Very low	29.1	Very low	131 Å²	131	163.8 Å²	163.8	85%	0.851	83%	0.833	S	S	*	*			trans	-119.1	145.4	130.5	10.8	9	0	0	0	113
32	R	30.8	Very low	28.7	Very low	227 Å²	227	167.7 Å²	167.7	86%	0.857	83%	0.83	S	S	*	*			trans	-66.5	160.8	-178.3	-77	179.2	-174.6	178.2	2.1	114.1
33	P	29.8	Very low	28.5	Very low	129 Å²	129	171.5 Å²	171.5	84%	0.838	83%	0.834	S	S	*	*			trans	-90.6	154.5	-171.8	36.7	-33.1	0	0	0	113.4
34	S	28.8	Very low	28.4	Very low	115 Å²	115	166.2 Å²	166.2	80%	0.804	82%	0.823	S	S	*	*			trans	-124.2	155.3	164.2	56.2	0	0	0	0	109.7
35	P	31.8	Very low	27.6	Very low	110 Å²	110	163.6 Å²	163.6	71%	0.714	82%	0.817	S	S	*	*				-104.7	164.2	-128.9	38.4	-35.9	0	0	0	115.7
36	E	26.7	Very low	27.8	Very low	172 Å²	172	163.1 Å²	163.1	80%	0.804	82%	0.815	S	S	*	*			trans	69.5	104.1	150.8	-73.3	169.5	-159.6	0	0	119.4
37	E	27.6	Very low	28	Very low	199 Å²	199	169.2 Å²	169.2	93%	0.93	82%	0.824	S	S	*	*				-162.5	84	129.1	-106	175.4	-166.6	0	0	109.3	Q39	E37-Q39 PolarHBondContact O-N 2.63Å
38	T	26	Very low	28.5	Very low	132 Å²	132	162.8 Å²	162.8	81%	0.81	81%	0.813	S	S	*	*			trans	-76.6	95.4	177	-14.7	0	0	0	0	109.6	Q40	T38-Q40 PolarHBondContact O-N 2.81Å
39	Q	27.6	Very low	28.9	Very low	189 Å²	189	164.4 Å²	164.4	88%	0.883	82%	0.817	S	S	*	*			trans	-80.7	93.4	162.1	-93.8	-179.2	0.2	0	0	109.3	E37 Y41	E37-Q39 PolarHBondContact O-N 2.63Å; Q39-Y41 PolarHBondContact O-N 3.4Å
40	Q	25.5	Very low	29.4	Very low	162 Å²	162	158.9 Å²	158.9	76%	0.757	81%	0.81	S	S	*	*			trans	-60.3	109.5	175.4	-130.1	169.3	2.1	0	0	110.1	T38 R42	T38-Q40 PolarHBondContact O-N 2.81Å; Q40-R42 PolarHBondContact O-N 3.24Å; Q40-R42 VanDerWaalsContact O-N 3.16Å
41	Y	25.2	Very low	29.7	Very low	234 Å²	234	156.2 Å²	156.2	92%	0.918	81%	0.811	S	S	*	*			trans	-61.3	109.9	159.9	-89.5	-97.9	0	0	0	108.5	Q39	Q39-Y41 PolarHBondContact O-N 3.4Å
42	R	24.6	Very low	29.8	Very low	199 Å²	199	158.9 Å²	158.9	75%	0.751	81%	0.809	S	S	*	*			trans	-85.1	118.3	169.3	-83.2	-166.5	-173.4	-179.2	3.3	110.4	Q40	Q40-R42 PolarHBondContact O-N 3.24Å; Q40-R42 VanDerWaalsContact O-N 3.16Å
43	F	27.5	Very low	29.7	Very low	205 Å²	205	157.5 Å²	157.5	90%	0.899	81%	0.81	S	S	*	*			trans	-88	93.6	163.1	-154	-87.5	0	0	0	106.5
44	D	26	Very low	29.7	Very low	130 Å²	130	157.9 Å²	157.9	70%	0.695	80%	0.803	S	S	*	*			trans	-104.1	87.7	173.5	-78.9	-28.5	0	0	0	109.2
45	G	28.8	Very low	30	Very low	58 Å²	58	158.5 Å²	158.5	60%	0.598	80%	0.803	S	S	*	*			trans	-70.9	147.1	150	0	0	0	0	0	109.2
46	Q	31	Very low	30.1	Very low	182 Å²	182	157 Å²	157	85%	0.85	80%	0.795	S	S	*	*			trans	91.2	58.2	168.8	-142.1	168.5	27.9	0	0	117	T48	Q46-T48 VanDerWaalsContact C-N 3.28Å; Q46-T48 PolarHBondContact O-N 3.35Å; Q46-T48 VanDerWaalsContact O-N 3.09Å
47	E	31.9	Very low	30.6	Very low	197 Å²	197	154.9 Å²	154.9	92%	0.921	80%	0.799	S	S	*	*			trans	-80.3	75.7	157.1	-83	-166.5	151.1	0	0	111.2
48	T	38.2	Very low	31.2	Very low	111 Å²	111	150 Å²	150	68%	0.681	78%	0.782	S	S	*	*			trans	-120.1	89.5	150.1	52.8	0	0	0	0	107.7	Q46	Q46-T48 VanDerWaalsContact C-N 3.28Å; Q46-T48 PolarHBondContact O-N 3.35Å; Q46-T48 VanDerWaalsContact O-N 3.09Å
49	K	35.5	Very low	32.1	Very low	209 Å²	209	147.4 Å²	147.4	91%	0.909	77%	0.769	S	S	*	*	S	Bend	trans	151.5	109.8	147.6	-85.4	169.1	-179	-177	0	110.8
50	G	39.6	Very low	33.5	Very low	72 Å²	72	144.7 Å²	144.7	74%	0.742	76%	0.761	S	S	*	*			trans	78.2	86.7	144.9	0	0	0	0	0	117.7
51	S	31.5	Very low	35.5	Very low	117 Å²	117	143.9 Å²	143.9	82%	0.818	76%	0.755	S	S	*	*	S	Bend	trans	-151.9	139.1	140	-166.5	0	0	0	0	111.1
52	K	31.2	Very low	37.8	Very low	188 Å²	188	136.1 Å²	136.1	82%	0.817	74%	0.735	S	S	*	*			trans	77.7	55.8	-168.9	-58.6	-174.6	180	177.2	0	117	I54	K52-I54 VanDerWaalsContact C-N 3.33Å; K52-I54 PolarHBondContact O-N 3.42Å
53	F	29.1	Very low	40.4	Very low	198 Å²	198	128.9 Å²	128.9	87%	0.868	71%	0.712	S	S	*	*			trans	-79.6	88.8	143.7	-87.2	-85.3	0	0	0	108.4
54	I	29.9	Very low	43.2	Very low	137 Å²	137	123.4 Å²	123.4	70%	0.703	70%	0.696	S	S	*	*			trans	-88.4	106.5	152.1	-64.3	175.6	0	0	0	104.8	K52 S56	K52-I54 VanDerWaalsContact C-N 3.33Å; K52-I54 PolarHBondContact O-N 3.42Å; I54-S56 VanDerWaalsContact C-N 3.33Å; I54-S56 PolarHBondContact O-N 3.37Å
55	T	35.3	Very low	46.1	Very low	128 Å²	128	118 Å²	118	79%	0.785	67%	0.668	S	S	*	*			trans	-66.5	94.1	165.1	45.9	0	0	0	0	108.7
56	S	34.2	Very low	48.9	Very low	79 Å²	79	118.2 Å²	118.2	55%	0.552	65%	0.651	S	S	*	*			trans	-119.7	81	162	61.3	0	0	0	0	109.2	I54 V58	I54-S56 VanDerWaalsContact C-N 3.33Å; I54-S56 PolarHBondContact O-N 3.37Å; S56-V58 PolarHBondContact O-N 3.32Å
57	S	37.1	Very low	51.7	Low	127 Å²	127	116.9 Å²	116.9	89%	0.888	64%	0.643	S	S	*	*			trans	-75.4	56.8	159.6	57.8	0	0	0	0	109.7
58	V	40.2	Very low	54.4	Low	95 Å²	95	112.3 Å²	112.3	58%	0.576	62%	0.621	S	S	*	*	S	Bend	trans	-112.9	111.3	164.7	-177.5	0	0	0	0	103.7	S56 D60 S62	S56-V58 PolarHBondContact O-N 3.32Å; V58-D60 PolarHBondContact O-N 2.78Å; V58-S62 WeakPolarHBondContact CG1-OG 3.32Å
59	S	43.2	Very low	56.9	Low	78 Å²	78	107.7 Å²	107.7	55%	0.545	59%	0.592	S	S	.	*			trans	-46.5	126.2	-176.6	54.7	0	0	0	0	110.9	F61 S62	S59-F61 PolarHBondContact O-N 2.71Å; S59-S62 VanDerWaalsContact O-CB 3.25Å; S59-S62 WeakPolarHBondContact O-CB 3.45Å; S59-S62 PolarHBondContact O-N 3.23Å; S59-S62 PolarHBondContact O-OG 3.27Å
60	D	58.7	Low	59.6	Low	132 Å²	132	100.5 Å²	100.5	71%	0.706	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	-11.7	178	-65.7	-31.7	0	0	0	113.7	V58 Y66	V58-D60 PolarHBondContact O-N 2.78Å; D60-Y66 WeakPolarHBondContact O-CE2 3.23Å
61	F	66.6	Low	62.2	Low	145 Å²	145	102.8 Å²	102.8	64%	0.636	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	8.9	177	-55.9	-74	0	0	0	114.5	S59 D63 Y66	S59-F61 PolarHBondContact O-N 2.71Å; F61-D63 PolarHBondContact O-N 2.83Å; F61-Y66 HydrophobicContact CB-CD2 4.44Å; F61-Y66 AromaticContact CD1-CD1 3.85Å; F61-Y66 HydrophobicContact CD1-CD1 3.85Å; F61-Y66 HydrophobicContact CD1-CD2 4.37Å; F61-Y66 AromaticContact CD1-CE1 3.83Å; F61-Y66 HydrophobicContact CD1-CE1 3.83Å; F61-Y66 HydrophobicContact CD1-CE2 4.37Å; F61-Y66 HydrophobicContact CD1-CG 4.12Å; F61-Y66 HydrophobicContact CE1-CD1 4.47Å; F61-Y66 HydrophobicContact CE1-CE1 4.12Å
62	S	73.6	Confident	65.1	Low	71 Å²	71	98.6 Å²	98.6	50%	0.497	54%	0.536	S	S	.	.			trans	-71.7	-15.4	179	54	0	0	0	0	113.1	V58 S59	V58-S62 WeakPolarHBondContact CG1-OG 3.32Å; S59-S62 VanDerWaalsContact O-CB 3.25Å; S59-S62 WeakPolarHBondContact O-CB 3.45Å; S59-S62 PolarHBondContact O-N 3.23Å; S59-S62 PolarHBondContact O-OG 3.27Å
63	D	79.9	Confident	68.2	Low	48 Å²	48	91.8 Å²	91.8	26%	0.257	51%	0.508	S	S	.	.	S	Bend	trans	-65	132.6	-179.3	-161.9	-63.5	0	0	0	112	F61 V65 Y66 K118	F61-D63 PolarHBondContact O-N 2.83Å; D63-V65 HydrophobicContact CB-CG1 4.01Å; D63-V65 PolarHBondContact O-N 3.11Å; D63-V65 WeakPolarHBondContact OD1-CB 3.41Å; D63-V65 VanDerWaalsContact OD1-CG1 3.26Å; D63-V65 WeakPolarHBondContact OD1-CG1 3.43Å; D63-V65 PolarHBondContact OD1-N 3.11Å; D63-Y66 HydrophobicContact CB-CD2 3.74Å; D63-Y66 HydrophobicContact CB-CE2 4.03Å; D63-Y66 PolarHBondContact O-N 3.26Å; D63-K118 IonicContact OD1-NZ 2.93Å; D63-K118 PolarHBondContact OD1-NZ 2.73Å; D63-K118 IonicContact OD2-NZ 3.22Å; D63-K118 PolarHBondContact OD2-NZ 2.68Å
64	P	85.6	Confident	71.3	Confident	89 Å²	89	83.2 Å²	83.2	58%	0.578	48%	0.476	S	S	*	.	H	α-helix	trans	-50.7	-31	176.5	-28	34.5	0	0	0	114.4	Y66 K67 E68	P64-Y66 PolarHBondContact O-N 3.13Å; P64-K67 WeakPolarHBondContact O-CB 3.46Å; P64-K67 PolarHBondContact O-N 3.42Å; P64-E68 PolarHBondContact O-N 2.86Å
65	V	86.7	Confident	74.4	Confident	17 Å²	17	79.6 Å²	79.6	10%	0.103	46%	0.462	C	S	.	.	H	α-helix	trans	-57.2	-33.6	178.4	75.5	0	0	0	0	112.1	D63 E68 I69 K114 L115	D63-V65 HydrophobicContact CB-CG1 4.01Å; D63-V65 PolarHBondContact O-N 3.11Å; D63-V65 WeakPolarHBondContact OD1-CB 3.41Å; D63-V65 VanDerWaalsContact OD1-CG1 3.26Å; D63-V65 WeakPolarHBondContact OD1-CG1 3.43Å; D63-V65 PolarHBondContact OD1-N 3.11Å; V65-E68 PolarHBondContact O-N 2.99Å; V65-I69 HydrophobicContact CG2-CD1 4.2Å; V65-I69 VanDerWaalsContact O-CG1 3.28Å; V65-I69 WeakPolarHBondContact O-CG1 3.46Å; V65-I69 PolarHBondContact O-N 3.41Å; V65-K114 HydrophobicContact CG2-CB 3.96Å; V65-L115 HydrophobicContact CG1-CD2 3.98Å
66	Y	87.7	Confident	77.3	Confident	62 Å²	62	73.7 Å²	73.7	24%	0.243	43%	0.425	C	S	.	.	H	α-helix	trans	-71.3	-30.5	178.9	-71	-72	0	0	0	112.8	D60 F61 D63 P64 E68 I69 A70	D60-Y66 WeakPolarHBondContact O-CE2 3.23Å; F61-Y66 HydrophobicContact CB-CD2 4.44Å; F61-Y66 AromaticContact CD1-CD1 3.85Å; F61-Y66 HydrophobicContact CD1-CD1 3.85Å; F61-Y66 HydrophobicContact CD1-CD2 4.37Å; F61-Y66 AromaticContact CD1-CE1 3.83Å; F61-Y66 HydrophobicContact CD1-CE1 3.83Å; F61-Y66 HydrophobicContact CD1-CE2 4.37Å; F61-Y66 HydrophobicContact CD1-CG 4.12Å; F61-Y66 HydrophobicContact CE1-CD1 4.47Å; F61-Y66 HydrophobicContact CE1-CE1 4.12Å; D63-Y66 HydrophobicContact CB-CD2 3.74Å; D63-Y66 HydrophobicContact CB-CE2 4.03Å; D63-Y66 PolarHBondContact O-N 3.26Å; P64-Y66 PolarHBondContact O-N 3.13Å; Y66-E68 VanDerWaalsContact C-N 3.34Å; Y66-I69 HydrophobicContact CD1-CD1 4.09Å; Y66-I69 HydrophobicContact CE1-CD1 4.46Å; Y66-I69 PolarHBondContact O-N 3.24Å; Y66-A70 WeakPolarHBondContact O-CB 3.45Å; Y66-A70 PolarHBondContact O-N 2.72Å
67	K	89.3	Confident	80.2	Confident	155 Å²	155	73.6 Å²	73.6	67%	0.674	42%	0.419	S	S	*	.	H	α-helix	trans	-64.6	-43	171.9	-67.4	-178.1	179	175.5	0	110.4	P64 A70 I71	P64-K67 WeakPolarHBondContact O-CB 3.46Å; P64-K67 PolarHBondContact O-N 3.42Å; K67-A70 WeakPolarHBondContact O-CB 3.18Å; K67-A70 PolarHBondContact O-N 2.88Å; K67-I71 WeakPolarHBondContact O-CG1 3.48Å; K67-I71 PolarHBondContact O-N 2.82Å
68	E	89.4	Confident	83.1	Confident	101 Å²	101	76.3 Å²	76.3	47%	0.472	41%	0.409	S	S	.	.	H	α-helix	trans	-66.4	-41.2	176.5	-52.8	-176.3	-178	0	0	112.4	P64 V65 Y66 A70 I71 T72 K114	P64-E68 PolarHBondContact O-N 2.86Å; V65-E68 PolarHBondContact O-N 2.99Å; Y66-E68 VanDerWaalsContact C-N 3.34Å; E68-A70 PolarHBondContact O-N 3.03Å; E68-I71 PolarHBondContact O-N 3.41Å; E68-T72 PolarHBondContact O-N 2.85Å; E68-T72 PolarHBondContact O-OG1 2.88Å; E68-T72 VanDerWaalsContact O-OG1 3.08Å; E68-K114 IonicContact OE2-NZ 3.42Å; E68-K114 PolarHBondContact OE2-NZ 3.46Å
69	I	90.9	Very high	85.8	Confident	13 Å²	13	73.2 Å²	73.2	7%	0.067	39%	0.389	C	S	.	.	H	α-helix	trans	-58.6	-41.1	174.3	-70.1	162.1	0	0	0	109.9	V65 Y66 T72 N73 K111 K114 L115	V65-I69 HydrophobicContact CG2-CD1 4.2Å; V65-I69 VanDerWaalsContact O-CG1 3.28Å; V65-I69 WeakPolarHBondContact O-CG1 3.46Å; V65-I69 PolarHBondContact O-N 3.41Å; Y66-I69 HydrophobicContact CD1-CD1 4.09Å; Y66-I69 HydrophobicContact CE1-CD1 4.46Å; Y66-I69 PolarHBondContact O-N 3.24Å; I69-T72 PolarHBondContact O-N 3.29Å; I69-N73 VanDerWaalsContact O-CB 3.29Å; I69-N73 WeakPolarHBondContact O-CB 3.11Å; I69-N73 PolarHBondContact O-N 3.05Å; I69-N73 PolarHBondContact O-ND2 2.61Å; I69-K111 HydrophobicContact CD1-CG 4.23Å; I69-K114 HydrophobicContact CG1-CB 4.37Å; I69-K114 HydrophobicContact CG1-CD 3.87Å; I69-L115 HydrophobicContact CD1-CD2 4.39Å; I69-L115 HydrophobicContact CD1-CG 4.4Å
70	A	92.5	Very high	88.4	Confident	59 Å²	59	71.3 Å²	71.3	49%	0.488	38%	0.376	S	S	.	.	H	α-helix	trans	-62.8	-43.2	176.8	0	0	0	0	0	112.3	Y66 K67 E68 N73 G74	Y66-A70 WeakPolarHBondContact O-CB 3.45Å; Y66-A70 PolarHBondContact O-N 2.72Å; K67-A70 WeakPolarHBondContact O-CB 3.18Å; K67-A70 PolarHBondContact O-N 2.88Å; E68-A70 PolarHBondContact O-N 3.03Å; A70-N73 PolarHBondContact O-N 2.98Å; A70-G74 PolarHBondContact O-N 2.82Å
71	I	93.3	Very high	90.2	Very high	119 Å²	119	68.3 Å²	68.3	61%	0.61	36%	0.356	S	S	*	.	H	α-helix	trans	-62.3	-48.8	175.5	-65.1	166	0	0	0	110.5	K67 E68 N73 G74 C75	K67-I71 WeakPolarHBondContact O-CG1 3.48Å; K67-I71 PolarHBondContact O-N 2.82Å; E68-I71 PolarHBondContact O-N 3.41Å; I71-N73 VanDerWaalsContact C-N 3.32Å; I71-N73 PolarHBondContact O-N 2.92Å; I71-G74 WeakPolarHBondContact O-CA 3.29Å; I71-G74 PolarHBondContact O-N 3.31Å; I71-C75 PolarHBondContact O-N 2.98Å
72	T	93.2	Very high	91.6	Very high	30 Å²	30	67.2 Å²	67.2	18%	0.184	35%	0.353	C	S	.	.	H	α-helix	trans	-58.1	-43.9	176.5	-58	0	0	0	0	111.4	E68 I69 G74 C75 I76 Y110	E68-T72 PolarHBondContact O-N 2.85Å; E68-T72 PolarHBondContact O-OG1 2.88Å; E68-T72 VanDerWaalsContact O-OG1 3.08Å; I69-T72 PolarHBondContact O-N 3.29Å; T72-G74 VanDerWaalsContact C-N 3.28Å; T72-G74 PolarHBondContact O-N 2.71Å; T72-C75 WeakPolarHBondContact O-CB 3.28Å; T72-C75 PolarHBondContact O-N 3.05Å; T72-C75 VanDerWaalsContact O-N 3.16Å; T72-I76 HydrophobicContact CG2-CD1 3.95Å; T72-I76 WeakPolarHBondContact O-CG1 3.47Å; T72-I76 PolarHBondContact O-N 3.05Å; T72-Y110 HydrophobicContact CG2-CD1 4.36Å; T72-Y110 HydrophobicContact CG2-CD2 4.06Å; T72-Y110 HydrophobicContact CG2-CG 3.92Å
73	N	94.7	Very high	92.8	Very high	44 Å²	44	68.7 Å²	68.7	24%	0.235	35%	0.352	C	S	.	.	H	α-helix	trans	-60.5	-38	175.5	-74	-22.6	0	0	0	112.2	I69 A70 I71 I76 N77 K107	I69-N73 VanDerWaalsContact O-CB 3.29Å; I69-N73 WeakPolarHBondContact O-CB 3.11Å; I69-N73 PolarHBondContact O-N 3.05Å; I69-N73 PolarHBondContact O-ND2 2.61Å; A70-N73 PolarHBondContact O-N 2.98Å; I71-N73 VanDerWaalsContact C-N 3.32Å; I71-N73 PolarHBondContact O-N 2.92Å; N73-I76 PolarHBondContact O-N 3.48Å; N73-N77 VanDerWaalsContact O-CG 3.25Å; N73-N77 PolarHBondContact O-N 2.87Å; N73-N77 PolarHBondContact O-ND2 2.82Å; N73-K107 HydrophobicContact CB-CD 4.45Å; N73-K107 WeakPolarHBondContact OD1-CB 3.36Å; N73-K107 VanDerWaalsContact OD1-CG 3.23Å; N73-K107 WeakPolarHBondContact OD1-CG 3.45Å
74	G	94.9	Very high	93.6	Very high	19 Å²	19	66.4 Å²	66.4	20%	0.196	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-43.6	173.6	0	0	0	0	0	112.4	A70 I71 T72 N77 R78	A70-G74 PolarHBondContact O-N 2.82Å; I71-G74 WeakPolarHBondContact O-CA 3.29Å; I71-G74 PolarHBondContact O-N 3.31Å; T72-G74 VanDerWaalsContact C-N 3.28Å; T72-G74 PolarHBondContact O-N 2.71Å; G74-N77 PolarHBondContact O-N 3.19Å; G74-R78 VanDerWaalsContact O-CZ 3.28Å; G74-R78 PolarHBondContact O-NH1 2.75Å
75	C	95.6	Very high	94.2	Very high	60 Å²	60	66.7 Å²	66.7	41%	0.405	33%	0.33	S	S	.	.	H	α-helix	trans	-61.1	-49.2	173.9	-64.1	0	0	0	0	111.4	I71 T72 N77 R78 M79	I71-C75 PolarHBondContact O-N 2.98Å; T72-C75 WeakPolarHBondContact O-CB 3.28Å; T72-C75 PolarHBondContact O-N 3.05Å; T72-C75 VanDerWaalsContact O-N 3.16Å; C75-N77 PolarHBondContact O-N 3.09Å; C75-R78 PolarHBondContact O-N 2.79Å; C75-R78 PolarHBondContact SG-NH2 2.89Å; C75-M79 PolarHBondContact O-N 2.79Å
76	I	96.1	Very high	94.7	Very high	4 Å²	4	68.8 Å²	68.8	2%	0.021	35%	0.348	C	S	.	.	H	α-helix	trans	-60.5	-34.6	179.8	-64	165.2	0	0	0	111.9	T72 N73 R78 M79 L84 K103 L106 K107 Y110	T72-I76 HydrophobicContact CG2-CD1 3.95Å; T72-I76 WeakPolarHBondContact O-CG1 3.47Å; T72-I76 PolarHBondContact O-N 3.05Å; N73-I76 PolarHBondContact O-N 3.48Å; I76-R78 PolarHBondContact O-N 3.4Å; I76-M79 HydrophobicContact CG1-SD 4.33Å; I76-M79 PolarHBondContact O-N 2.83Å; I76-L84 HydrophobicContact CG2-CD2 3.81Å; I76-K103 HydrophobicContact CG2-CB 4.33Å; I76-K103 HydrophobicContact CG2-CG 4.28Å; I76-L106 HydrophobicContact CD1-CB 4.48Å; I76-L106 HydrophobicContact CD1-CD2 4.35Å; I76-L106 HydrophobicContact CD1-CG 4.03Å; I76-L106 HydrophobicContact CG1-CD2 4.07Å; I76-L106 HydrophobicContact CG1-CG 4.31Å; I76-L106 HydrophobicContact CG2-CB 4.44Å; I76-L106 HydrophobicContact CG2-CD2 4.25Å; I76-K107 HydrophobicContact CB-CG 4.16Å; I76-K107 HydrophobicContact CD1-CB 4.35Å; I76-K107 HydrophobicContact CD1-CG 3.72Å; I76-K107 HydrophobicContact CG2-CG 3.87Å; I76-Y110 HydrophobicContact CD1-CD2 3.86Å; I76-Y110 HydrophobicContact CD1-CE2 4.39Å
77	N	95.7	Very high	95.1	Very high	77 Å²	77	69.3 Å²	69.3	41%	0.412	35%	0.352	S	S	.	.	H	α-helix	trans	-61.6	-32.1	177	-79.9	-25.2	0	0	0	113.4	N73 G74 C75 K103 K107	N73-N77 VanDerWaalsContact O-CG 3.25Å; N73-N77 PolarHBondContact O-N 2.87Å; N73-N77 PolarHBondContact O-ND2 2.82Å; G74-N77 PolarHBondContact O-N 3.19Å; C75-N77 PolarHBondContact O-N 3.09Å; N77-K103 WeakPolarHBondContact O-CE 3.5Å; N77-K103 PolarHBondContact O-NZ 3.36Å; N77-K107 VanDerWaalsContact OD1-CE 3.24Å; N77-K107 WeakPolarHBondContact OD1-CE 3.16Å; N77-K107 PolarHBondContact OD1-NZ 3.33Å
78	R	96.5	Very high	95.5	Very high	184 Å²	184	62 Å²	62	69%	0.694	32%	0.32	S	S	*	.	H	α-helix	trans	-84.5	-14.8	-178.3	-66.5	-176.3	-69	-92.6	3.6	113.7	G74 C75 I76	G74-R78 VanDerWaalsContact O-CZ 3.28Å; G74-R78 PolarHBondContact O-NH1 2.75Å; C75-R78 PolarHBondContact O-N 2.79Å; C75-R78 PolarHBondContact SG-NH2 2.89Å; I76-R78 PolarHBondContact O-N 3.4Å
79	M	97.3	Very high	95.8	Very high	31 Å²	31	60.8 Å²	60.8	15%	0.153	32%	0.323	C	S	.	.			trans	-66.1	146.1	-177.6	-65	174.9	74.7	0	0	112.9	C75 I76 E83 L84 K87 K99 L106	C75-M79 PolarHBondContact O-N 2.79Å; I76-M79 HydrophobicContact CG1-SD 4.33Å; I76-M79 PolarHBondContact O-N 2.83Å; M79-E83 VanDerWaalsContact CA-OE2 3.22Å; M79-E83 WeakPolarHBondContact CA-OE2 3.36Å; M79-E83 HydrophobicContact CB-CB 4.21Å; M79-E83 HydrophobicContact CE-CB 3.7Å; M79-E83 WeakPolarHBondContact CE-O 3.47Å; M79-L84 HydrophobicContact CB-CD2 3.92Å; M79-L84 HydrophobicContact CB-CG 3.83Å; M79-L84 HydrophobicContact CE-CD2 4.34Å; M79-L84 HydrophobicContact SD-CD2 3.95Å; M79-K87 HydrophobicContact CE-CB 4.17Å; M79-K87 HydrophobicContact CE-CG 3.59Å; M79-K99 WeakPolarHBondContact O-CE 3.44Å; M79-K99 PolarHBondContact O-NZ 3.2Å; M79-K99 VanDerWaalsContact O-NZ 3.13Å; M79-L106 HydrophobicContact CE-CD2 4.39Å; M79-L106 HydrophobicContact SD-CD2 4.1Å
80	S	97.6	Very high	96.1	Very high	37 Å²	37	65.7 Å²	65.7	26%	0.259	35%	0.346	S	S	.	.			trans	-70.2	169.7	167.9	80.7	0	0	0	0	111.2	E82 E83 L84	S80-E82 VanDerWaalsContact C-N 3.27Å; S80-E82 PolarHBondContact O-N 3.48Å; S80-E82 PolarHBondContact OG-N 3.01Å; S80-E82 PolarHBondContact OG-OE2 2.66Å; S80-E83 PolarHBondContact N-OE2 2.91Å; S80-E83 VanDerWaalsContact OG-CG 3.26Å; S80-E83 WeakPolarHBondContact OG-CG 3.26Å; S80-E83 PolarHBondContact OG-N 2.84Å; S80-E83 VanDerWaalsContact OG-N 3.1Å; S80-L84 WeakPolarHBondContact O-CD1 3.44Å; S80-L84 WeakPolarHBondContact O-CG 3.26Å; S80-L84 PolarHBondContact O-N 3.36Å; S80-L84 VanDerWaalsContact O-N 3.13Å
81	K	96.6	Very high	96.2	Very high	69 Å²	69	65.4 Å²	65.4	30%	0.3	33%	0.334	S	S	.	.	H	α-helix	trans	-68.7	-34.7	179.3	-172.4	-178.1	-179	-175.7	0	110.5	L84 R85 L102	K81-L84 PolarHBondContact O-N 3.5Å; K81-R85 WeakPolarHBondContact O-CG 3.17Å; K81-R85 PolarHBondContact O-N 3.27Å; K81-L102 HydrophobicContact CG-CD1 4.03Å
82	E	97.1	Very high	96.4	Very high	123 Å²	123	69.2 Å²	69.2	58%	0.575	35%	0.346	S	S	*	.	H	α-helix	trans	-69	-45.9	-179.1	-62.3	62.8	-134.3	0	0	110.1	S80 L84 R85 A86	S80-E82 VanDerWaalsContact C-N 3.27Å; S80-E82 PolarHBondContact O-N 3.48Å; S80-E82 PolarHBondContact OG-N 3.01Å; S80-E82 PolarHBondContact OG-OE2 2.66Å; E82-L84 PolarHBondContact O-N 2.93Å; E82-R85 PolarHBondContact O-N 2.61Å; E82-A86 WeakPolarHBondContact O-CB 3.48Å; E82-A86 PolarHBondContact O-N 2.81Å
83	E	97.6	Very high	96.5	Very high	101 Å²	101	70.2 Å²	70.2	47%	0.472	35%	0.35	S	S	.	.	H	α-helix	trans	-62.9	-41.4	175.2	-69.6	171	153.5	0	0	111.8	M79 S80 A86 K87	M79-E83 VanDerWaalsContact CA-OE2 3.22Å; M79-E83 WeakPolarHBondContact CA-OE2 3.36Å; M79-E83 HydrophobicContact CB-CB 4.21Å; M79-E83 HydrophobicContact CE-CB 3.7Å; M79-E83 WeakPolarHBondContact CE-O 3.47Å; S80-E83 PolarHBondContact N-OE2 2.91Å; S80-E83 VanDerWaalsContact OG-CG 3.26Å; S80-E83 WeakPolarHBondContact OG-CG 3.26Å; S80-E83 PolarHBondContact OG-N 2.84Å; S80-E83 VanDerWaalsContact OG-N 3.1Å; E83-A86 PolarHBondContact O-N 2.9Å; E83-K87 PolarHBondContact O-N 3.4Å
84	L	97.6	Very high	96.6	Very high	0 Å²	0	71 Å²	71	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-61.4	-45.3	175.8	-72.2	166.5	0	0	0	111.1	I76 M79 S80 K81 E82 K87 L88 K99 L102 K103 L106	I76-L84 HydrophobicContact CG2-CD2 3.81Å; M79-L84 HydrophobicContact CB-CD2 3.92Å; M79-L84 HydrophobicContact CB-CG 3.83Å; M79-L84 HydrophobicContact CE-CD2 4.34Å; M79-L84 HydrophobicContact SD-CD2 3.95Å; S80-L84 WeakPolarHBondContact O-CD1 3.44Å; S80-L84 WeakPolarHBondContact O-CG 3.26Å; S80-L84 PolarHBondContact O-N 3.36Å; S80-L84 VanDerWaalsContact O-N 3.13Å; K81-L84 PolarHBondContact O-N 3.5Å; E82-L84 PolarHBondContact O-N 2.93Å; L84-K87 PolarHBondContact O-N 3.09Å; L84-L88 WeakPolarHBondContact O-CB 3.19Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.39Å; L84-L88 PolarHBondContact O-N 3.07Å; L84-K99 HydrophobicContact CD1-CG 3.92Å; L84-L102 HydrophobicContact CB-CB 4.11Å; L84-L102 HydrophobicContact CB-CD1 4.43Å; L84-L102 HydrophobicContact CD1-CB 4.28Å; L84-K103 HydrophobicContact CD1-CG 3.57Å; L84-K103 HydrophobicContact CD2-CG 4.16Å; L84-L106 HydrophobicContact CD2-CD2 3.79Å
85	R	97	Very high	96.6	Very high	96 Å²	96	72.3 Å²	72.3	36%	0.362	36%	0.356	S	S	.	.	H	α-helix	trans	-62.7	-43.7	176.4	-76.1	178.4	169.4	167.6	-8.9	111.7	K81 E82 K87 L88 S89 L102	K81-R85 WeakPolarHBondContact O-CG 3.17Å; K81-R85 PolarHBondContact O-N 3.27Å; E82-R85 PolarHBondContact O-N 2.61Å; R85-K87 PolarHBondContact O-N 2.66Å; R85-L88 PolarHBondContact O-N 2.82Å; R85-S89 VanDerWaalsContact O-CB 3.3Å; R85-S89 WeakPolarHBondContact O-CB 3.32Å; R85-S89 PolarHBondContact O-N 3.06Å; R85-L102 HydrophobicContact CG-CD1 3.68Å
86	A	97.4	Very high	96.7	Very high	60 Å²	60	74.9 Å²	74.9	50%	0.496	36%	0.357	S	S	.	.	H	α-helix	trans	-59.3	-47.5	177.3	0	0	0	0	0	111.3	E82 E83 S89 E90	E82-A86 WeakPolarHBondContact O-CB 3.48Å; E82-A86 PolarHBondContact O-N 2.81Å; E83-A86 PolarHBondContact O-N 2.9Å; A86-S89 WeakPolarHBondContact O-CB 3.41Å; A86-S89 PolarHBondContact O-N 2.97Å; A86-E90 PolarHBondContact O-N 3.32Å
87	K	97.1	Very high	96.7	Very high	74 Å²	74	75.1 Å²	75.1	32%	0.322	36%	0.361	S	S	.	.	H	α-helix	trans	-66	-40.1	177	-76.4	-54.8	-173	-176	0	113.7	M79 E83 L84 R85 S89 E90 F91 L106	M79-K87 HydrophobicContact CE-CB 4.17Å; M79-K87 HydrophobicContact CE-CG 3.59Å; E83-K87 PolarHBondContact O-N 3.4Å; L84-K87 PolarHBondContact O-N 3.09Å; R85-K87 PolarHBondContact O-N 2.66Å; K87-S89 VanDerWaalsContact C-N 3.33Å; K87-E90 WeakPolarHBondContact CD-OE2 3.21Å; K87-E90 IonicContact NZ-OE1 2.58Å; K87-E90 IonicContact NZ-OE2 2.88Å; K87-E90 PolarHBondContact NZ-OE2 2.78Å; K87-E90 WeakPolarHBondContact O-CB 3.31Å; K87-E90 PolarHBondContact O-N 2.89Å; K87-F91 WeakPolarHBondContact O-CD2 3.43Å; K87-F91 PolarHBondContact O-N 2.92Å; K87-L106 HydrophobicContact CB-CD1 4.38Å; K87-L106 HydrophobicContact CB-CD2 4.04Å
88	L	96.9	Very high	96.6	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-63.1	-42.4	174.5	-73.5	168.2	0	0	0	111.2	L84 R85 E90 F91 K92 L93 T95 L102 R105 L106	L84-L88 WeakPolarHBondContact O-CB 3.19Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.39Å; L84-L88 PolarHBondContact O-N 3.07Å; R85-L88 PolarHBondContact O-N 2.82Å; L88-E90 PolarHBondContact O-N 3.32Å; L88-F91 CarbonylContact O-C 3.52Å; L88-F91 PolarHBondContact O-N 3.28Å; L88-K92 PolarHBondContact O-N 3.15Å; L88-L93 HydrophobicContact CB-CB 4.28Å; L88-L93 HydrophobicContact CD2-CB 3.88Å; L88-L93 HydrophobicContact CD2-CD1 3.69Å; L88-L93 HydrophobicContact CD2-CG 4.46Å; L88-L93 WeakPolarHBondContact O-CB 3.31Å; L88-L93 PolarHBondContact O-N 3.14Å; L88-T95 HydrophobicContact CB-CG2 4.05Å; L88-L102 HydrophobicContact CD1-CB 3.79Å; L88-L102 HydrophobicContact CD1-CD2 3.57Å; L88-L102 HydrophobicContact CD1-CG 4.2Å; L88-R105 HydrophobicContact CD2-CB 4.23Å; L88-R105 HydrophobicContact CD2-CG 3.76Å; L88-L106 HydrophobicContact CD2-CB 4.03Å; L88-L106 HydrophobicContact CD2-CD1 4.07Å; L88-L106 HydrophobicContact CG-CB 4.49Å
89	S	97	Very high	96.6	Very high	77 Å²	77	68.5 Å²	68.5	54%	0.538	34%	0.337	S	S	.	.	H	α-helix	trans	-62.7	-40.3	176.6	-169.6	0	0	0	0	112.4	R85 A86 K87 F91 K92	R85-S89 VanDerWaalsContact O-CB 3.3Å; R85-S89 WeakPolarHBondContact O-CB 3.32Å; R85-S89 PolarHBondContact O-N 3.06Å; A86-S89 WeakPolarHBondContact O-CB 3.41Å; A86-S89 PolarHBondContact O-N 2.97Å; K87-S89 VanDerWaalsContact C-N 3.33Å; S89-F91 PolarHBondContact O-N 2.85Å; S89-K92 PolarHBondContact O-N 3.29Å
90	E	96.9	Very high	96.5	Very high	116 Å²	116	71 Å²	71	54%	0.542	35%	0.35	S	S	.	.	H	α-helix	trans	-56.1	-39.3	175.1	-174.8	-175.6	151.5	0	0	111.4	A86 K87 L88 K92	A86-E90 PolarHBondContact O-N 3.32Å; K87-E90 WeakPolarHBondContact CD-OE2 3.21Å; K87-E90 IonicContact NZ-OE1 2.58Å; K87-E90 IonicContact NZ-OE2 2.88Å; K87-E90 PolarHBondContact NZ-OE2 2.78Å; K87-E90 WeakPolarHBondContact O-CB 3.31Å; K87-E90 PolarHBondContact O-N 2.89Å; L88-E90 PolarHBondContact O-N 3.32Å; E90-K92 VanDerWaalsContact C-N 3.31Å; E90-K92 PolarHBondContact O-N 3.21Å
91	F	95.1	Very high	96.4	Very high	52 Å²	52	69.2 Å²	69.2	23%	0.228	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	10.2	177.3	-58.3	-51.5	0	0	0	114.3	K87 L88 S89 L93 L106 Y109 Y110	K87-F91 WeakPolarHBondContact O-CD2 3.43Å; K87-F91 PolarHBondContact O-N 2.92Å; L88-F91 CarbonylContact O-C 3.52Å; L88-F91 PolarHBondContact O-N 3.28Å; S89-F91 PolarHBondContact O-N 2.85Å; F91-L93 HydrophobicContact CB-CD1 3.99Å; F91-L93 HydrophobicContact CB-CG 3.95Å; F91-L93 PolarHBondContact O-N 3.13Å; F91-L93 VanDerWaalsContact O-N 3.16Å; F91-L106 HydrophobicContact CD2-CD1 4.11Å; F91-L106 HydrophobicContact CE2-CD1 4.15Å; F91-Y109 HydrophobicContact CB-CE1 4.06Å; F91-Y109 HydrophobicContact CB-CE2 4.45Å; F91-Y109 AromaticContact CD1-CE1 3.79Å; F91-Y109 HydrophobicContact CD1-CE1 3.79Å; F91-Y109 AromaticContact CD1-CZ 3.94Å; F91-Y109 WeakPolarHBondContact CD1-OH 3.14Å; F91-Y109 AromaticContact CD2-CD1 3.98Å; F91-Y109 HydrophobicContact CD2-CD1 3.98Å; F91-Y109 AromaticContact CD2-CE1 3.6Å; F91-Y109 HydrophobicContact CD2-CE1 3.6Å; F91-Y109 HydrophobicContact CE1-CE1 4.15Å; F91-Y109 HydrophobicContact CE2-CD1 4.36Å; F91-Y109 AromaticContact CE2-CE1 3.97Å; F91-Y109 HydrophobicContact CE2-CE1 3.97Å; F91-Y109 HydrophobicContact CG-CD1 4.28Å; F91-Y109 AromaticContact CG-CE1 3.52Å; F91-Y109 HydrophobicContact CG-CE1 3.52Å; F91-Y109 AromaticContact CG-CZ 3.79Å; F91-Y109 HydrophobicContact CZ-CE1 4.23Å; F91-Y110 HydrophobicContact CE2-CE2 4.16Å; F91-Y110 AromaticContact CE2-CZ 3.8Å; F91-Y110 WeakPolarHBondContact CE2-OH 3.46Å; F91-Y110 HydrophobicContact CZ-CE1 4.42Å; F91-Y110 AromaticContact CZ-CZ 3.96Å; F91-Y110 WeakPolarHBondContact CZ-OH 3.45Å
92	K	96.1	Very high	96.4	Very high	200 Å²	200	66 Å²	66	87%	0.87	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	31.3	-176	-53.7	179.2	-178.3	179.8	0	112.9	L88 S89 E90	L88-K92 PolarHBondContact O-N 3.15Å; S89-K92 PolarHBondContact O-N 3.29Å; E90-K92 VanDerWaalsContact C-N 3.31Å; E90-K92 PolarHBondContact O-N 3.21Å
93	L	95.8	Very high	96.4	Very high	50 Å²	50	61.7 Å²	61.7	26%	0.262	30%	0.304	S	S	.	.			trans	-91.6	155.4	174	-61.4	173.4	0	0	0	109.8	L88 F91 T95 Y109	L88-L93 HydrophobicContact CB-CB 4.28Å; L88-L93 HydrophobicContact CD2-CB 3.88Å; L88-L93 HydrophobicContact CD2-CD1 3.69Å; L88-L93 HydrophobicContact CD2-CG 4.46Å; L88-L93 WeakPolarHBondContact O-CB 3.31Å; L88-L93 PolarHBondContact O-N 3.14Å; F91-L93 HydrophobicContact CB-CD1 3.99Å; F91-L93 HydrophobicContact CB-CG 3.95Å; F91-L93 PolarHBondContact O-N 3.13Å; F91-L93 VanDerWaalsContact O-N 3.16Å; L93-T95 WeakPolarHBondContact O-CG2 3.5Å; L93-T95 PolarHBondContact O-N 2.95Å; L93-Y109 HydrophobicContact CD1-CD1 4.24Å; L93-Y109 HydrophobicContact CD1-CD2 3.67Å; L93-Y109 HydrophobicContact CD1-CE2 4.25Å; L93-Y109 HydrophobicContact CD1-CG 3.66Å; L93-Y109 HydrophobicContact CD2-CD2 4.23Å; L93-Y109 HydrophobicContact CG-CD2 4.42Å
94	E	96.1	Very high	96.3	Very high	61 Å²	61	59.5 Å²	59.5	29%	0.285	29%	0.292	S	S	.	.			trans	-63.7	135.8	178.4	177.5	56.7	-88.5	0	0	111.8	R96 R105 R308	E94-R96 VanDerWaalsContact CD-NE 3.33Å; E94-R96 HydrophobicContact CG-CB 4.36Å; E94-R96 WeakPolarHBondContact OE1-CB 3.29Å; E94-R96 VanDerWaalsContact OE1-CG 3.3Å; E94-R96 WeakPolarHBondContact OE1-CG 3.39Å; E94-R96 PolarHBondContact OE1-N 3.45Å; E94-R96 IonicContact OE1-NE 2.93Å; E94-R96 PolarHBondContact OE1-NE 3.25Å; E94-R96 IonicContact OE2-CZ 3.49Å; E94-R96 VanDerWaalsContact OE2-CZ 3.26Å; E94-R96 IonicContact OE2-NE 3.65Å; E94-R96 PolarHBondContact OE2-NE 2.85Å; E94-R96 IonicContact OE2-NH2 3.15Å; E94-R96 PolarHBondContact OE2-NH2 3.17Å; E94-R105 VanDerWaalsContact O-CD 3.29Å; E94-R105 WeakPolarHBondContact O-CD 3.41Å; E94-R105 PolarHBondContact O-NH1 3.47Å; E94-R308 VanDerWaalsContact CB-NH1 3.32Å; E94-R308 VanDerWaalsContact CG-CZ 3.45Å
95	T	96.5	Very high	96.3	Very high	46 Å²	46	59.9 Å²	59.9	28%	0.282	29%	0.294	S	S	.	.			trans	-110.1	-4.3	-170.8	63.6	0	0	0	0	113.2	L88 L93 L102	L88-T95 HydrophobicContact CB-CG2 4.05Å; L93-T95 WeakPolarHBondContact O-CG2 3.5Å; L93-T95 PolarHBondContact O-N 2.95Å; T95-L102 VanDerWaalsContact O-CD2 3.3Å; T95-L102 WeakPolarHBondContact O-CD2 3.29Å
96	R	96.4	Very high	96.3	Very high	115 Å²	115	55.4 Å²	55.4	43%	0.434	28%	0.277	S	S	.	.			trans	-70.3	151.2	172.5	-70.4	-176.8	-60.6	158.1	-8.3	112.8	E94 L102 R105 G285	E94-R96 VanDerWaalsContact CD-NE 3.33Å; E94-R96 HydrophobicContact CG-CB 4.36Å; E94-R96 WeakPolarHBondContact OE1-CB 3.29Å; E94-R96 VanDerWaalsContact OE1-CG 3.3Å; E94-R96 WeakPolarHBondContact OE1-CG 3.39Å; E94-R96 PolarHBondContact OE1-N 3.45Å; E94-R96 IonicContact OE1-NE 2.93Å; E94-R96 PolarHBondContact OE1-NE 3.25Å; E94-R96 IonicContact OE2-CZ 3.49Å; E94-R96 VanDerWaalsContact OE2-CZ 3.26Å; E94-R96 IonicContact OE2-NE 3.65Å; E94-R96 PolarHBondContact OE2-NE 2.85Å; E94-R96 IonicContact OE2-NH2 3.15Å; E94-R96 PolarHBondContact OE2-NH2 3.17Å; R96-L102 WeakPolarHBondContact O-CD2 3.19Å; R96-R105 PolarHBondContact O-NH1 2.93Å; R96-G285 WeakPolarHBondContact CD-O 3.31Å; R96-G285 PolarHBondContact NH1-O 3.47Å
97	G	95.5	Very high	96.2	Very high	9 Å²	9	54.6 Å²	54.6	9%	0.093	26%	0.262	C	S	.	.	S	Bend	trans	112.2	176.6	177.5	0	0	0	0	0	115.1	K283	G97-K283 CarbonylContact C-O 3.46Å; G97-K283 WeakPolarHBondContact CA-O 3.43Å
98	V	95.6	Very high	96.1	Very high	40 Å²	40	52.3 Å²	52.3	24%	0.242	25%	0.254	C	S	.	.			trans	-78	165.8	176.6	-64.5	0	0	0	0	112.5	D100 V101 L102 K283	V98-D100 VanDerWaalsContact C-N 3.26Å; V98-D100 PolarHBondContact O-N 3.26Å; V98-D100 VanDerWaalsContact O-N 3.14Å; V98-V101 HydrophobicContact CG2-CB 4.38Å; V98-V101 HydrophobicContact CG2-CG2 3.84Å; V98-V101 WeakPolarHBondContact O-CB 3.44Å; V98-V101 PolarHBondContact O-N 3.5Å; V98-L102 WeakPolarHBondContact O-CG 3.46Å; V98-L102 PolarHBondContact O-N 2.92Å; V98-L102 VanDerWaalsContact O-N 3.13Å; V98-K283 HydrophobicContact CB-CD 4.32Å; V98-K283 HydrophobicContact CG1-CD 3.51Å; V98-K283 HydrophobicContact CG2-CB 4.22Å; V98-K283 HydrophobicContact CG2-CD 3.9Å; V98-K283 PolarHBondContact N-O 2.93Å
99	K	95.8	Very high	95.9	Very high	82 Å²	82	55.2 Å²	55.2	36%	0.357	27%	0.265	S	S	.	.	H	α-helix	trans	-51.5	-41.7	-174.6	-169.8	175.1	-175.2	174.3	0	113.1	M79 L84 L102 K103	M79-K99 WeakPolarHBondContact O-CE 3.44Å; M79-K99 PolarHBondContact O-NZ 3.2Å; M79-K99 VanDerWaalsContact O-NZ 3.13Å; L84-K99 HydrophobicContact CD1-CG 3.92Å; K99-L102 PolarHBondContact O-N 3.32Å; K99-K103 WeakPolarHBondContact O-CG 3.35Å; K99-K103 PolarHBondContact O-N 2.86Å
100	D	94.3	Very high	95.8	Very high	82 Å²	82	54.5 Å²	54.5	44%	0.439	25%	0.251	S	S	.	.	H	α-helix	trans	-69.5	-35.6	-178.3	-62.1	-41.5	0	0	0	113.2	V98 K103 K104	V98-D100 VanDerWaalsContact C-N 3.26Å; V98-D100 PolarHBondContact O-N 3.26Å; V98-D100 VanDerWaalsContact O-N 3.14Å; D100-K103 PolarHBondContact O-N 2.81Å; D100-K104 WeakPolarHBondContact O-CB 3.43Å; D100-K104 PolarHBondContact O-N 3.48Å
101	V	95.9	Very high	95.5	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-62	-48.6	172.3	171	0	0	0	0	110	V98 K103 K104 R105 Y268 L284	V98-V101 HydrophobicContact CG2-CB 4.38Å; V98-V101 HydrophobicContact CG2-CG2 3.84Å; V98-V101 WeakPolarHBondContact O-CB 3.44Å; V98-V101 PolarHBondContact O-N 3.5Å; V101-K103 PolarHBondContact O-N 2.92Å; V101-K104 PolarHBondContact O-N 2.78Å; V101-R105 WeakPolarHBondContact O-CB 3.24Å; V101-R105 PolarHBondContact O-N 3.25Å; V101-Y268 HydrophobicContact CB-CD1 4.29Å; V101-Y268 HydrophobicContact CB-CE1 4.3Å; V101-Y268 HydrophobicContact CG1-CE1 4.06Å; V101-Y268 HydrophobicContact CG2-CD1 3.84Å; V101-Y268 HydrophobicContact CG2-CE1 4.08Å; V101-Y268 HydrophobicContact CG2-CG 4.24Å; V101-L284 HydrophobicContact CG1-CD2 3.87Å; V101-L284 HydrophobicContact CG2-CD2 4.05Å
102	L	97.3	Very high	95.2	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-44.1	179.1	-56.9	179.5	0	0	0	112	K81 L84 R85 L88 T95 R96 V98 K99 K104 R105 L106	K81-L102 HydrophobicContact CG-CD1 4.03Å; L84-L102 HydrophobicContact CB-CB 4.11Å; L84-L102 HydrophobicContact CB-CD1 4.43Å; L84-L102 HydrophobicContact CD1-CB 4.28Å; R85-L102 HydrophobicContact CG-CD1 3.68Å; L88-L102 HydrophobicContact CD1-CB 3.79Å; L88-L102 HydrophobicContact CD1-CD2 3.57Å; L88-L102 HydrophobicContact CD1-CG 4.2Å; T95-L102 VanDerWaalsContact O-CD2 3.3Å; T95-L102 WeakPolarHBondContact O-CD2 3.29Å; R96-L102 WeakPolarHBondContact O-CD2 3.19Å; V98-L102 WeakPolarHBondContact O-CG 3.46Å; V98-L102 PolarHBondContact O-N 2.92Å; V98-L102 VanDerWaalsContact O-N 3.13Å; K99-L102 PolarHBondContact O-N 3.32Å; L102-K104 VanDerWaalsContact C-N 3.32Å; L102-K104 PolarHBondContact O-N 3.27Å; L102-R105 PolarHBondContact O-N 2.68Å; L102-L106 WeakPolarHBondContact O-CB 3.41Å; L102-L106 PolarHBondContact O-N 2.9Å
103	K	96.6	Very high	94.8	Very high	34 Å²	34	51.5 Å²	51.5	15%	0.148	24%	0.238	C	C	.	.	H	α-helix	trans	-56.8	-48	173.5	-77.9	-179	172.4	-178.2	0	110.9	I76 N77 L84 K99 D100 V101 L106 K107	I76-K103 HydrophobicContact CG2-CB 4.33Å; I76-K103 HydrophobicContact CG2-CG 4.28Å; N77-K103 WeakPolarHBondContact O-CE 3.5Å; N77-K103 PolarHBondContact O-NZ 3.36Å; L84-K103 HydrophobicContact CD1-CG 3.57Å; L84-K103 HydrophobicContact CD2-CG 4.16Å; K99-K103 WeakPolarHBondContact O-CG 3.35Å; K99-K103 PolarHBondContact O-N 2.86Å; D100-K103 PolarHBondContact O-N 2.81Å; V101-K103 PolarHBondContact O-N 2.92Å; K103-L106 PolarHBondContact O-N 3.35Å; K103-K107 WeakPolarHBondContact O-CB 3.43Å; K103-K107 WeakPolarHBondContact O-CG 3.35Å; K103-K107 PolarHBondContact O-N 2.87Å
104	K	96.1	Very high	94.4	Very high	54 Å²	54	51.3 Å²	51.3	24%	0.235	24%	0.235	C	C	.	.	H	α-helix	trans	-65.3	-44.7	-175.8	-171.9	58.5	177	161.1	0	111.6	D100 V101 L102 K107 N108 F267 Y268	D100-K104 WeakPolarHBondContact O-CB 3.43Å; D100-K104 PolarHBondContact O-N 3.48Å; V101-K104 PolarHBondContact O-N 2.78Å; L102-K104 VanDerWaalsContact C-N 3.32Å; L102-K104 PolarHBondContact O-N 3.27Å; K104-K107 PolarHBondContact O-N 3.13Å; K104-N108 PolarHBondContact NZ-OD1 3.38Å; K104-N108 WeakPolarHBondContact O-CB 3.42Å; K104-N108 PolarHBondContact O-N 3.37Å; K104-F267 HydrophobicContact CD-CE1 4.49Å; K104-F267 HydrophobicContact CD-CE2 4.39Å; K104-F267 HydrophobicContact CD-CZ 4.29Å; K104-F267 VanDerWaalsContact CE-CD2 3.46Å; K104-F267 VanDerWaalsContact CE-O 3.29Å; K104-F267 WeakPolarHBondContact CE-O 3.49Å; K104-F267 HydrophobicContact CG-CD1 3.98Å; K104-F267 HydrophobicContact CG-CE1 3.54Å; K104-F267 HydrophobicContact CG-CE2 4.26Å; K104-F267 HydrophobicContact CG-CZ 3.71Å; K104-Y268 HydrophobicContact CB-CD1 4.03Å; K104-Y268 HydrophobicContact CB-CE1 4.35Å; K104-Y268 HydrophobicContact CG-CD1 4.13Å; K104-Y268 HydrophobicContact CG-CE1 4.36Å
105	R	97.1	Very high	93.8	Very high	9 Å²	9	50.3 Å²	50.3	3%	0.034	23%	0.231	C	C	.	.	H	α-helix	trans	-56.2	-51.6	174.4	-175.9	176.4	-63.6	125.9	23.6	111.7	L88 E94 R96 V101 L102 K107 N108 Y109 R308 D312	L88-R105 HydrophobicContact CD2-CB 4.23Å; L88-R105 HydrophobicContact CD2-CG 3.76Å; E94-R105 VanDerWaalsContact O-CD 3.29Å; E94-R105 WeakPolarHBondContact O-CD 3.41Å; E94-R105 PolarHBondContact O-NH1 3.47Å; R96-R105 PolarHBondContact O-NH1 2.93Å; V101-R105 WeakPolarHBondContact O-CB 3.24Å; V101-R105 PolarHBondContact O-N 3.25Å; L102-R105 PolarHBondContact O-N 2.68Å; R105-K107 PolarHBondContact O-N 3.28Å; R105-N108 PolarHBondContact O-N 3.27Å; R105-Y109 PolarHBondContact O-N 3.29Å; R105-R308 VanDerWaalsContact CZ-CZ 3.45Å; R105-D312 IonicContact CZ-OD1 4Å; R105-D312 IonicContact CZ-OD2 3.88Å; R105-D312 IonicContact NE-OD1 3.78Å; R105-D312 PolarHBondContact NE-OD1 3.27Å; R105-D312 IonicContact NE-OD2 3.73Å; R105-D312 IonicContact NH2-OD1 2.84Å; R105-D312 PolarHBondContact NH2-OD1 3.2Å; R105-D312 IonicContact NH2-OD2 2.76Å; R105-D312 PolarHBondContact NH2-OD2 2.91Å
106	L	96.8	Very high	92.9	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-65	-41.8	-177.9	-170.5	60.4	0	0	0	112.3	I76 M79 L84 K87 L88 F91 L102 K103 N108 Y109 Y110	I76-L106 HydrophobicContact CD1-CB 4.48Å; I76-L106 HydrophobicContact CD1-CD2 4.35Å; I76-L106 HydrophobicContact CD1-CG 4.03Å; I76-L106 HydrophobicContact CG1-CD2 4.07Å; I76-L106 HydrophobicContact CG1-CG 4.31Å; I76-L106 HydrophobicContact CG2-CB 4.44Å; I76-L106 HydrophobicContact CG2-CD2 4.25Å; M79-L106 HydrophobicContact CE-CD2 4.39Å; M79-L106 HydrophobicContact SD-CD2 4.1Å; L84-L106 HydrophobicContact CD2-CD2 3.79Å; K87-L106 HydrophobicContact CB-CD1 4.38Å; K87-L106 HydrophobicContact CB-CD2 4.04Å; L88-L106 HydrophobicContact CD2-CB 4.03Å; L88-L106 HydrophobicContact CD2-CD1 4.07Å; L88-L106 HydrophobicContact CG-CB 4.49Å; F91-L106 HydrophobicContact CD2-CD1 4.11Å; F91-L106 HydrophobicContact CE2-CD1 4.15Å; L102-L106 WeakPolarHBondContact O-CB 3.41Å; L102-L106 PolarHBondContact O-N 2.9Å; K103-L106 PolarHBondContact O-N 3.35Å; L106-N108 VanDerWaalsContact C-N 3.35Å; L106-N108 PolarHBondContact O-N 2.92Å; L106-Y109 PolarHBondContact O-N 2.9Å; L106-Y110 HydrophobicContact CD1-CD2 3.97Å; L106-Y110 HydrophobicContact CD1-CE2 3.62Å; L106-Y110 HydrophobicContact CD2-CE2 4.42Å; L106-Y110 HydrophobicContact CG-CD2 3.99Å; L106-Y110 HydrophobicContact CG-CE2 3.86Å; L106-Y110 WeakPolarHBondContact O-CD2 3.37Å; L106-Y110 PolarHBondContact O-N 3.46Å; L106-Y110 VanDerWaalsContact O-N 3.09Å
107	K	95.9	Very high	91.3	Very high	43 Å²	43	55.4 Å²	55.4	19%	0.187	26%	0.262	C	S	.	.	H	α-helix	trans	-59.8	-45.6	175.8	-73.2	178	-178.4	175.6	0	111.9	N73 I76 N77 K103 K104 R105 Y110 K111	N73-K107 HydrophobicContact CB-CD 4.45Å; N73-K107 WeakPolarHBondContact OD1-CB 3.36Å; N73-K107 VanDerWaalsContact OD1-CG 3.23Å; N73-K107 WeakPolarHBondContact OD1-CG 3.45Å; I76-K107 HydrophobicContact CB-CG 4.16Å; I76-K107 HydrophobicContact CD1-CB 4.35Å; I76-K107 HydrophobicContact CD1-CG 3.72Å; I76-K107 HydrophobicContact CG2-CG 3.87Å; N77-K107 VanDerWaalsContact OD1-CE 3.24Å; N77-K107 WeakPolarHBondContact OD1-CE 3.16Å; N77-K107 PolarHBondContact OD1-NZ 3.33Å; K103-K107 WeakPolarHBondContact O-CB 3.43Å; K103-K107 WeakPolarHBondContact O-CG 3.35Å; K103-K107 PolarHBondContact O-N 2.87Å; K104-K107 PolarHBondContact O-N 3.13Å; R105-K107 PolarHBondContact O-N 3.28Å; K107-Y110 PolarHBondContact O-N 2.9Å; K107-K111 WeakPolarHBondContact O-CB 3.38Å; K107-K111 PolarHBondContact O-N 2.99Å
108	N	94	Very high	89.7	Confident	27 Å²	27	60.8 Å²	60.8	14%	0.144	28%	0.283	C	S	.	.	H	α-helix	trans	-69.4	-36.6	-179	-84.2	10.8	0	0	0	111.9	K104 R105 L106 K111 K112 F267 D312 G313	K104-N108 PolarHBondContact NZ-OD1 3.38Å; K104-N108 WeakPolarHBondContact O-CB 3.42Å; K104-N108 PolarHBondContact O-N 3.37Å; R105-N108 PolarHBondContact O-N 3.27Å; L106-N108 VanDerWaalsContact C-N 3.35Å; L106-N108 PolarHBondContact O-N 2.92Å; N108-K111 PolarHBondContact O-N 2.77Å; N108-K112 WeakPolarHBondContact O-CB 3.31Å; N108-K112 PolarHBondContact O-N 2.97Å; N108-F267 VanDerWaalsContact ND2-CE2 3.34Å; N108-F267 WeakPolarHBondContact ND2-CE2 3.45Å; N108-F267 WeakPolarHBondContact ND2-CZ 3.38Å; N108-D312 WeakPolarHBondContact CB-O 3.39Å; N108-D312 PolarHBondContact ND2-O 3.44Å; N108-G313 PolarHBondContact ND2-O 3.25Å
109	Y	94.1	Very high	87.9	Confident	60 Å²	60	66 Å²	66	24%	0.235	30%	0.304	C	S	.	.	H	α-helix	trans	-57.2	-53.1	171.8	175.5	-100.9	0	0	0	111.8	F91 L93 R105 L106 K111 K112 Q113	F91-Y109 HydrophobicContact CB-CE1 4.06Å; F91-Y109 HydrophobicContact CB-CE2 4.45Å; F91-Y109 AromaticContact CD1-CE1 3.79Å; F91-Y109 HydrophobicContact CD1-CE1 3.79Å; F91-Y109 AromaticContact CD1-CZ 3.94Å; F91-Y109 WeakPolarHBondContact CD1-OH 3.14Å; F91-Y109 AromaticContact CD2-CD1 3.98Å; F91-Y109 HydrophobicContact CD2-CD1 3.98Å; F91-Y109 AromaticContact CD2-CE1 3.6Å; F91-Y109 HydrophobicContact CD2-CE1 3.6Å; F91-Y109 HydrophobicContact CE1-CE1 4.15Å; F91-Y109 HydrophobicContact CE2-CD1 4.36Å; F91-Y109 AromaticContact CE2-CE1 3.97Å; F91-Y109 HydrophobicContact CE2-CE1 3.97Å; F91-Y109 HydrophobicContact CG-CD1 4.28Å; F91-Y109 AromaticContact CG-CE1 3.52Å; F91-Y109 HydrophobicContact CG-CE1 3.52Å; F91-Y109 AromaticContact CG-CZ 3.79Å; F91-Y109 HydrophobicContact CZ-CE1 4.23Å; L93-Y109 HydrophobicContact CD1-CD1 4.24Å; L93-Y109 HydrophobicContact CD1-CD2 3.67Å; L93-Y109 HydrophobicContact CD1-CE2 4.25Å; L93-Y109 HydrophobicContact CD1-CG 3.66Å; L93-Y109 HydrophobicContact CD2-CD2 4.23Å; L93-Y109 HydrophobicContact CG-CD2 4.42Å; R105-Y109 PolarHBondContact O-N 3.29Å; L106-Y109 PolarHBondContact O-N 2.9Å; Y109-K111 VanDerWaalsContact C-N 3.34Å; Y109-K111 PolarHBondContact O-N 3.49Å; Y109-K112 PolarHBondContact O-N 3.29Å; Y109-Q113 HydrophobicContact CD1-CG 4.33Å; Y109-Q113 HydrophobicContact CD2-CG 4.49Å; Y109-Q113 HydrophobicContact CE1-CG 3.97Å; Y109-Q113 HydrophobicContact CE2-CG 4.14Å; Y109-Q113 WeakPolarHBondContact O-CG 2.89Å; Y109-Q113 PolarHBondContact O-N 3.24Å
110	Y	93.4	Very high	85.5	Confident	63 Å²	63	67.4 Å²	67.4	25%	0.247	32%	0.324	C	S	.	.	H	α-helix	trans	-62.8	-39.1	178	-82.9	-69.3	0	0	0	112.8	T72 I76 F91 L106 K107 K112 Q113 K114	T72-Y110 HydrophobicContact CG2-CD1 4.36Å; T72-Y110 HydrophobicContact CG2-CD2 4.06Å; T72-Y110 HydrophobicContact CG2-CG 3.92Å; I76-Y110 HydrophobicContact CD1-CD2 3.86Å; I76-Y110 HydrophobicContact CD1-CE2 4.39Å; F91-Y110 HydrophobicContact CE2-CE2 4.16Å; F91-Y110 AromaticContact CE2-CZ 3.8Å; F91-Y110 WeakPolarHBondContact CE2-OH 3.46Å; F91-Y110 HydrophobicContact CZ-CE1 4.42Å; F91-Y110 AromaticContact CZ-CZ 3.96Å; F91-Y110 WeakPolarHBondContact CZ-OH 3.45Å; L106-Y110 HydrophobicContact CD1-CD2 3.97Å; L106-Y110 HydrophobicContact CD1-CE2 3.62Å; L106-Y110 HydrophobicContact CD2-CE2 4.42Å; L106-Y110 HydrophobicContact CG-CD2 3.99Å; L106-Y110 HydrophobicContact CG-CE2 3.86Å; L106-Y110 WeakPolarHBondContact O-CD2 3.37Å; L106-Y110 PolarHBondContact O-N 3.46Å; L106-Y110 VanDerWaalsContact O-N 3.09Å; K107-Y110 PolarHBondContact O-N 2.9Å; Y110-K112 VanDerWaalsContact C-N 3.34Å; Y110-K112 PolarHBondContact O-N 3.15Å; Y110-Q113 PolarHBondContact O-N 3.02Å; Y110-K114 WeakPolarHBondContact O-CB 3.45Å; Y110-K114 WeakPolarHBondContact O-CG 3.39Å; Y110-K114 PolarHBondContact O-N 3.23Å
111	K	91.6	Very high	83.4	Confident	88 Å²	88	71 Å²	71	38%	0.383	34%	0.344	S	S	.	.	H	α-helix	trans	-57.9	-48.1	173.7	-179.1	-177.4	177.4	-169.9	0	110.6	I69 K107 N108 Y109 K114 L115	I69-K111 HydrophobicContact CD1-CG 4.23Å; K107-K111 WeakPolarHBondContact O-CB 3.38Å; K107-K111 PolarHBondContact O-N 2.99Å; N108-K111 PolarHBondContact O-N 2.77Å; Y109-K111 VanDerWaalsContact C-N 3.34Å; Y109-K111 PolarHBondContact O-N 3.49Å; K111-K114 PolarHBondContact O-N 2.94Å; K111-L115 HydrophobicContact CD-CD1 4.34Å; K111-L115 HydrophobicContact CG-CD1 3.76Å; K111-L115 HydrophobicContact CG-CG 4.44Å; K111-L115 WeakPolarHBondContact O-CB 3.47Å; K111-L115 WeakPolarHBondContact O-CG 3.48Å; K111-L115 PolarHBondContact O-N 3.43Å
112	K	88.3	Confident	80.8	Confident	135 Å²	135	77.3 Å²	77.3	59%	0.587	39%	0.386	S	S	*	.	H	α-helix	trans	-61.8	-47.6	179.7	-173.4	173.1	-179.6	176.8	0	111.2	N108 Y109 Y110 K114 L115 M116	N108-K112 WeakPolarHBondContact O-CB 3.31Å; N108-K112 PolarHBondContact O-N 2.97Å; Y109-K112 PolarHBondContact O-N 3.29Å; Y110-K112 VanDerWaalsContact C-N 3.34Å; Y110-K112 PolarHBondContact O-N 3.15Å; K112-K114 PolarHBondContact O-N 3.07Å; K112-L115 PolarHBondContact O-N 2.96Å; K112-M116 HydrophobicContact CD-SD 4.23Å; K112-M116 WeakPolarHBondContact CE-SD 3.31Å; K112-M116 HydrophobicContact CG-CG 4.04Å; K112-M116 HydrophobicContact CG-SD 3.75Å; K112-M116 VanDerWaalsContact O-CB 3.31Å; K112-M116 WeakPolarHBondContact O-CB 3.39Å; K112-M116 VanDerWaalsContact O-CG 3.26Å; K112-M116 WeakPolarHBondContact O-CG 3.3Å; K112-M116 PolarHBondContact O-N 2.95Å
113	Q	88	Confident	78.8	Confident	82 Å²	82	81.4 Å²	81.4	38%	0.383	42%	0.42	S	S	.	.	H	α-helix	trans	-56.6	-48.3	177.3	-69.6	-63.1	-34.8	0	0	112	Y109 Y110 L115 L117	Y109-Q113 HydrophobicContact CD1-CG 4.33Å; Y109-Q113 HydrophobicContact CD2-CG 4.49Å; Y109-Q113 HydrophobicContact CE1-CG 3.97Å; Y109-Q113 HydrophobicContact CE2-CG 4.14Å; Y109-Q113 WeakPolarHBondContact O-CG 2.89Å; Y109-Q113 PolarHBondContact O-N 3.24Å; Y110-Q113 PolarHBondContact O-N 3.02Å; Q113-L115 PolarHBondContact O-N 3.31Å; Q113-L117 VanDerWaalsContact O-CD1 3.3Å; Q113-L117 WeakPolarHBondContact O-CD1 3.38Å; Q113-L117 WeakPolarHBondContact O-CG 3.04Å; Q113-L117 PolarHBondContact O-N 2.78Å
114	K	86.8	Confident	77	Confident	46 Å²	46	86.2 Å²	86.2	20%	0.2	45%	0.448	C	S	.	.	H	α-helix	trans	-67.6	-33.9	-178.3	-71.8	-169.2	173.3	-148.3	0	114.2	V65 E68 I69 Y110 K111 K112	V65-K114 HydrophobicContact CG2-CB 3.96Å; E68-K114 IonicContact OE2-NZ 3.42Å; E68-K114 PolarHBondContact OE2-NZ 3.46Å; I69-K114 HydrophobicContact CG1-CB 4.37Å; I69-K114 HydrophobicContact CG1-CD 3.87Å; Y110-K114 WeakPolarHBondContact O-CB 3.45Å; Y110-K114 WeakPolarHBondContact O-CG 3.39Å; Y110-K114 PolarHBondContact O-N 3.23Å; K111-K114 PolarHBondContact O-N 2.94Å; K112-K114 PolarHBondContact O-N 3.07Å
115	L	84.3	Confident	76.3	Confident	40 Å²	40	87.6 Å²	87.6	21%	0.209	46%	0.464	C	S	.	.	H	α-helix	trans	-80.9	-38.4	178.3	-66.6	175.3	0	0	0	112.1	V65 I69 K111 K112 Q113 L117 K118 E119	V65-L115 HydrophobicContact CG1-CD2 3.98Å; I69-L115 HydrophobicContact CD1-CD2 4.39Å; I69-L115 HydrophobicContact CD1-CG 4.4Å; K111-L115 HydrophobicContact CD-CD1 4.34Å; K111-L115 HydrophobicContact CG-CD1 3.76Å; K111-L115 HydrophobicContact CG-CG 4.44Å; K111-L115 WeakPolarHBondContact O-CB 3.47Å; K111-L115 WeakPolarHBondContact O-CG 3.48Å; K111-L115 PolarHBondContact O-N 3.43Å; K112-L115 PolarHBondContact O-N 2.96Å; Q113-L115 PolarHBondContact O-N 3.31Å; L115-L117 VanDerWaalsContact C-N 3.28Å; L115-L117 PolarHBondContact O-N 3.39Å; L115-K118 PolarHBondContact O-N 2.73Å; L115-E119 PolarHBondContact O-N 3.11Å
116	M	77.5	Confident	76.2	Confident	119 Å²	119	89.8 Å²	89.8	59%	0.586	47%	0.472	S	S	*	.	H	α-helix	trans	-67	-27.5	177	-72.3	-166.7	80.6	0	0	113.3	K112 K118	K112-M116 HydrophobicContact CD-SD 4.23Å; K112-M116 WeakPolarHBondContact CE-SD 3.31Å; K112-M116 HydrophobicContact CG-CG 4.04Å; K112-M116 HydrophobicContact CG-SD 3.75Å; K112-M116 VanDerWaalsContact O-CB 3.31Å; K112-M116 WeakPolarHBondContact O-CB 3.39Å; K112-M116 VanDerWaalsContact O-CG 3.26Å; K112-M116 WeakPolarHBondContact O-CG 3.3Å; K112-M116 PolarHBondContact O-N 2.95Å; M116-K118 PolarHBondContact O-N 2.98Å
117	L	63.4	Low	76.2	Confident	148 Å²	148	89.8 Å²	89.8	78%	0.775	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-12	170.3	-79.2	158.8	0	0	0	113.1	Q113 L115	Q113-L117 VanDerWaalsContact O-CD1 3.3Å; Q113-L117 WeakPolarHBondContact O-CD1 3.38Å; Q113-L117 WeakPolarHBondContact O-CG 3.04Å; Q113-L117 PolarHBondContact O-N 2.78Å; L115-L117 VanDerWaalsContact C-N 3.28Å; L115-L117 PolarHBondContact O-N 3.39Å
118	K	60.3	Low	76.3	Confident	123 Å²	123	89.4 Å²	89.4	54%	0.535	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-33.3	-172.1	-156.5	180	-173.3	-178.5	0	114.5	D63 L115 M116	D63-K118 IonicContact OD1-NZ 2.93Å; D63-K118 PolarHBondContact OD1-NZ 2.73Å; D63-K118 IonicContact OD2-NZ 3.22Å; D63-K118 PolarHBondContact OD2-NZ 2.68Å; L115-K118 PolarHBondContact O-N 2.73Å; M116-K118 PolarHBondContact O-N 2.98Å
119	E	57.5	Low	76.5	Confident	149 Å²	149	89 Å²	89	70%	0.696	47%	0.469	S	S	*	.			trans	-123.8	120.1	-178.9	-74.2	179.6	164.8	0	0	111	L115	L115-E119 PolarHBondContact O-N 3.11Å
120	S	46.2	Very low	76.8	Confident	111 Å²	111	86.2 Å²	86.2	78%	0.776	46%	0.458	S	S	*	.			trans	-107.2	7.9	179.1	42.6	0	0	0	0	114.5
121	N	49.9	Very low	77	Confident	158 Å²	158	83.2 Å²	83.2	85%	0.845	45%	0.447	S	S	*	.			trans	-157.8	106.7	178.8	-82.6	-42.9	0	0	0	114
122	C	42	Very low	77.4	Confident	134 Å²	134	79 Å²	79	91%	0.905	43%	0.428	S	S	*	.			trans	-166.5	91	145.3	-166.9	0	0	0	0	107.5
123	A	54.6	Low	77.9	Confident	85 Å²	85	72.8 Å²	72.8	70%	0.702	40%	0.401	S	S	*	.			trans	-99.8	157.8	-179.3	0	0	0	0	0	112.1
124	D	59.4	Low	78.4	Confident	136 Å²	136	69.9 Å²	69.9	73%	0.727	39%	0.388	S	S	*	.			trans	72	58.9	156.3	-66.1	-16.5	0	0	0	119.8
125	S	80.3	Confident	79	Confident	83 Å²	83	68 Å²	68	58%	0.58	38%	0.38	S	S	*	.			trans	-121.3	2.7	155.5	75.4	0	0	0	0	114.5	K224	S125-K224 PolarHBondContact O-NZ 2.78Å
126	Y	95.1	Very high	79.7	Confident	54 Å²	54	67 Å²	67	21%	0.212	37%	0.374	C	S	.	.	S	Bend	trans	-77.9	169.6	177	-163.5	-116.4	0	0	0	111.3	T161 L310 E315 L316 I336	Y126-T161 HydrophobicContact CD1-CG2 4.48Å; Y126-T161 HydrophobicContact CE1-CG2 4.07Å; Y126-L310 HydrophobicContact CE1-CD2 3.87Å; Y126-L310 VanDerWaalsContact OH-CD2 3.31Å; Y126-L310 WeakPolarHBondContact OH-CD2 3.21Å; Y126-E315 HydrophobicContact CD2-CG 3.6Å; Y126-E315 HydrophobicContact CE2-CB 4.42Å; Y126-E315 HydrophobicContact CE2-CG 3.31Å; Y126-L316 VanDerWaalsContact CE2-O 3.31Å; Y126-L316 WeakPolarHBondContact CE2-O 3.49Å; Y126-L316 WeakPolarHBondContact OH-CA 3.26Å; Y126-L316 WeakPolarHBondContact OH-CB 3.42Å; Y126-L316 PolarHBondContact OH-N 2.5Å; Y126-L316 PolarHBondContact OH-O 3.3Å; Y126-I336 HydrophobicContact CD2-CD1 3.62Å; Y126-I336 HydrophobicContact CE2-CD1 3.94Å
127	Y	97.8	Very high	80.7	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.008	35%	0.349	C	S	.	.			trans	-66.8	135.6	174.1	-51.3	-62.5	0	0	0	109.7	T161 K224 I258 L316 I318 I336 E337	Y127-T161 WeakPolarHBondContact O-CB 3.41Å; Y127-T161 WeakPolarHBondContact O-CG2 3.39Å; Y127-T161 PolarHBondContact O-OG1 3.42Å; Y127-K224 CarbonylContact C-O 3.58Å; Y127-K224 HydrophobicContact CD1-CD 4.45Å; Y127-K224 HydrophobicContact CD1-CG 4.13Å; Y127-I258 HydrophobicContact CD2-CD1 4.5Å; Y127-I258 HydrophobicContact CE2-CD1 4.1Å; Y127-L316 VanDerWaalsContact CE2-O 3.31Å; Y127-L316 WeakPolarHBondContact CE2-O 3.34Å; Y127-I318 WeakPolarHBondContact OH-CG1 3.42Å; Y127-I336 HydrophobicContact CD1-CG2 4.32Å; Y127-I336 HydrophobicContact CE1-CG2 3.69Å; Y127-I336 HydrophobicContact CE2-CG2 4.07Å; Y127-E337 VanDerWaalsContact CE1-O 3.29Å; Y127-E337 WeakPolarHBondContact CE1-O 3.29Å; Y127-E337 PolarHBondContact OH-O 2.58Å
128	D	98.1	Very high	82.4	Confident	34 Å²	34	54.8 Å²	54.8	18%	0.182	31%	0.314	C	S	.	.	S	Bend	trans	-72.9	-37.1	166.8	-56.7	-63.1	0	0	0	110.4	T161 H162 Y223 K224	D128-T161 PolarHBondContact O-N 3.31Å; D128-T161 PolarHBondContact O-OG1 3.48Å; D128-T161 VanDerWaalsContact O-OG1 3.08Å; D128-H162 IonicContact OD1-CD2 3.29Å; D128-H162 IonicContact OD1-CE1 3.16Å; D128-H162 IonicContact OD1-NE2 3.82Å; D128-H162 PolarHBondContact OD1-NE2 3.46Å; D128-Y223 HydrophobicContact CB-CD1 4.19Å; D128-Y223 WeakPolarHBondContact OD2-CA 3.28Å; D128-K224 PolarHBondContact N-O 2.56Å; D128-K224 PolarHBondContact OD2-N 2.91Å
129	Y	98.8	Very high	84.2	Confident	20 Å²	20	49.8 Å²	49.8	8%	0.078	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.2	-178	-71.8	-80.2	0	0	0	113.5	L158 L159 N160 E167 L219 Y223 K224 Y225 S226	Y129-L158 HydrophobicContact CD1-CD1 3.63Å; Y129-L158 HydrophobicContact CD1-CD2 3.98Å; Y129-L158 HydrophobicContact CD1-CG 3.55Å; Y129-L158 HydrophobicContact CE1-CD1 4.44Å; Y129-L158 HydrophobicContact CE1-CD2 3.96Å; Y129-L158 HydrophobicContact CE1-CG 3.96Å; Y129-L158 HydrophobicContact CG-CD1 3.94Å; Y129-L158 HydrophobicContact CG-CG 4.35Å; Y129-L159 WeakPolarHBondContact CA-O 3.34Å; Y129-N160 HydrophobicContact CD1-CB 4.12Å; Y129-N160 HydrophobicContact CE1-CB 3.69Å; Y129-E167 HydrophobicContact CE1-CG 4.43Å; Y129-E167 WeakPolarHBondContact CE1-OE2 3.25Å; Y129-E167 VanDerWaalsContact CZ-OE2 3.27Å; Y129-E167 PolarHBondContact OH-OE1 2.84Å; Y129-E167 PolarHBondContact OH-OE2 3.4Å; Y129-L219 HydrophobicContact CD2-CD2 3.92Å; Y129-L219 HydrophobicContact CG-CD2 4.05Å; Y129-Y223 HydrophobicContact CD2-CD1 4.46Å; Y129-Y223 HydrophobicContact CD2-CD2 4.3Å; Y129-Y223 AromaticContact CD2-CG 3.92Å; Y129-Y223 HydrophobicContact CD2-CG 3.92Å; Y129-Y223 AromaticContact CE2-CD1 3.96Å; Y129-Y223 HydrophobicContact CE2-CD1 3.96Å; Y129-Y223 AromaticContact CE2-CD2 3.79Å; Y129-Y223 HydrophobicContact CE2-CD2 3.79Å; Y129-Y223 HydrophobicContact CE2-CE1 4.38Å; Y129-Y223 HydrophobicContact CE2-CE2 4.21Å; Y129-Y223 AromaticContact CE2-CG 3.64Å; Y129-Y223 HydrophobicContact CE2-CG 3.64Å; Y129-K224 PolarHBondContact N-O 3.32Å; Y129-K224 VanDerWaalsContact N-O 3.15Å; Y129-Y225 WeakPolarHBondContact O-CA 3.42Å; Y129-Y225 WeakPolarHBondContact O-CB 3.37Å; Y129-S226 PolarHBondContact O-N 2.82Å; Y129-S226 VanDerWaalsContact O-N 3.17Å
130	I	98.9	Very high	86	Confident	0 Å²	0	47 Å²	47	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125.9	165.5	-62.5	175.4	0	0	0	107.9	I132 L159 T161 S226 L228 L310 L316	I130-I132 HydrophobicContact CG2-CD1 4.08Å; I130-I132 HydrophobicContact CG2-CG1 4.22Å; I130-L159 HydrophobicContact CB-CB 4.4Å; I130-L159 PolarHBondContact N-O 3.42Å; I130-L159 PolarHBondContact O-N 2.69Å; I130-T161 HydrophobicContact CD1-CG2 4.02Å; I130-T161 HydrophobicContact CG1-CG2 3.87Å; I130-S226 WeakPolarHBondContact CA-O 3.13Å; I130-L228 HydrophobicContact CG2-CB 3.49Å; I130-L228 VanDerWaalsContact CG2-CB 3.49Å; I130-L228 HydrophobicContact CG2-CD1 3.91Å; I130-L228 HydrophobicContact CG2-CG 4.31Å; I130-L310 HydrophobicContact CD1-CD1 4.49Å; I130-L316 HydrophobicContact CD1-CD1 4.22Å
131	C	98.8	Very high	88.4	Confident	1 Å²	1	49 Å²	49	1%	0.007	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	107.8	172.9	-65.2	0	0	0	0	109	V156 L219 S226 I227 L228	C131-V156 HydrophobicContact CB-CG1 4.33Å; C131-L219 WeakPolarHBondContact SG-CD1 3.13Å; C131-S226 PolarHBondContact N-O 2.93Å; C131-I227 HydrophobicContact CB-CG1 4.4Å; C131-I227 CarbonylContact O-C 3.55Å; C131-I227 VanDerWaalsContact O-CA 3.3Å; C131-I227 WeakPolarHBondContact O-CA 3.48Å; C131-L228 PolarHBondContact O-N 3.16Å
132	I	98.9	Very high	90.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	129.8	176.9	-56.2	89.4	0	0	0	108.8	I130 V156 V157 L159 L228 I302 A303	I130-I132 HydrophobicContact CG2-CD1 4.08Å; I130-I132 HydrophobicContact CG2-CG1 4.22Å; I132-V156 WeakPolarHBondContact O-CA 3.13Å; I132-V157 HydrophobicContact CB-CB 4.22Å; I132-V157 HydrophobicContact CD1-CB 4.46Å; I132-V157 HydrophobicContact CD1-CG1 4.3Å; I132-V157 WeakPolarHBondContact CD1-O 3.25Å; I132-V157 PolarHBondContact N-O 2.6Å; I132-V157 PolarHBondContact O-N 3.33Å; I132-L159 HydrophobicContact CD1-CB 3.72Å; I132-L228 WeakPolarHBondContact CA-O 3.32Å; I132-L228 HydrophobicContact CG1-CB 4.44Å; I132-L228 HydrophobicContact CG1-CD2 4.05Å; I132-L228 HydrophobicContact CG2-CD2 4.2Å; I132-I302 HydrophobicContact CG1-CG2 4.49Å; I132-I302 HydrophobicContact CG2-CB 3.86Å; I132-I302 HydrophobicContact CG2-CD1 4.4Å; I132-I302 HydrophobicContact CG2-CG2 3.56Å; I132-A303 HydrophobicContact CD1-CB 3.88Å; I132-A303 HydrophobicContact CG1-CB 4.31Å
133	I	98.9	Very high	92.9	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.021	25%	0.253	C	S	.	.			trans	-131.9	133.5	178	-58.3	174.2	0	0	0	107.8	F135 F154 V156 I227 L228 T229 M235	I133-F135 HydrophobicContact CG2-CD1 4.1Å; I133-F135 HydrophobicContact CG2-CD2 4.34Å; I133-F135 HydrophobicContact CG2-CE1 3.7Å; I133-F135 HydrophobicContact CG2-CE2 3.96Å; I133-F135 HydrophobicContact CG2-CG 4.4Å; I133-F135 HydrophobicContact CG2-CZ 3.62Å; I133-F154 HydrophobicContact CD1-CE1 4.23Å; I133-F154 HydrophobicContact CG2-CE1 4.1Å; I133-V156 HydrophobicContact CG1-CG1 4.26Å; I133-V156 HydrophobicContact CG1-CG2 4.29Å; I133-I227 HydrophobicContact CD1-CD1 4.39Å; I133-I227 HydrophobicContact CD1-CG1 4.46Å; I133-I227 HydrophobicContact CD1-CG2 4.17Å; I133-L228 PolarHBondContact N-O 3.48Å; I133-T229 WeakPolarHBondContact O-CG2 3.41Å; I133-M235 HydrophobicContact CB-CE 3.95Å; I133-M235 HydrophobicContact CD1-CE 4.04Å; I133-M235 HydrophobicContact CG2-CE 3.92Å
134	D	98.9	Very high	94.9	Very high	20 Å²	20	40.8 Å²	40.8	11%	0.107	23%	0.234	C	C	.	.			trans	-141	105.1	173.9	-159.2	22.5	0	0	0	108.4	P155 D298 S299 I302	D134-P155 WeakPolarHBondContact O-CD 3.23Å; D134-P155 WeakPolarHBondContact O-CG 3.3Å; D134-D298 WeakPolarHBondContact OD2-CB 3.22Å; D134-S299 WeakPolarHBondContact CB-OG 3.49Å; D134-S299 PolarHBondContact N-OG 3.41Å; D134-I302 HydrophobicContact CB-CD1 3.98Å; D134-I302 WeakPolarHBondContact OD2-CD1 2.9Å
135	F	98.9	Very high	96.4	Very high	6 Å²	6	40 Å²	40	3%	0.026	24%	0.236	C	C	.	.			trans	-80.5	139.1	-173.6	-65.3	-61.4	0	0	0	111	I133 I151 F154 D234 M235 F238 L239	I133-F135 HydrophobicContact CG2-CD1 4.1Å; I133-F135 HydrophobicContact CG2-CD2 4.34Å; I133-F135 HydrophobicContact CG2-CE1 3.7Å; I133-F135 HydrophobicContact CG2-CE2 3.96Å; I133-F135 HydrophobicContact CG2-CG 4.4Å; I133-F135 HydrophobicContact CG2-CZ 3.62Å; F135-I151 HydrophobicContact CB-CG1 4.44Å; F135-I151 HydrophobicContact CB-CG2 4.44Å; F135-I151 HydrophobicContact CD1-CD1 3.92Å; F135-I151 HydrophobicContact CD1-CG1 4.41Å; F135-I151 HydrophobicContact CD1-CG2 3.81Å; F135-I151 HydrophobicContact CD2-CD1 4.06Å; F135-I151 HydrophobicContact CE1-CD1 3.99Å; F135-I151 HydrophobicContact CE1-CG2 4.42Å; F135-I151 HydrophobicContact CE2-CD1 4.16Å; F135-I151 HydrophobicContact CG-CD1 3.96Å; F135-I151 HydrophobicContact CG-CG1 4.3Å; F135-I151 HydrophobicContact CG-CG2 4.35Å; F135-I151 HydrophobicContact CZ-CD1 4.12Å; F135-F154 HydrophobicContact CD1-CD1 4.27Å; F135-F154 HydrophobicContact CD1-CD2 4.48Å; F135-F154 HydrophobicContact CD1-CG 4.2Å; F135-F154 HydrophobicContact CE1-CB 4.37Å; F135-F154 AromaticContact CE1-CD1 3.51Å; F135-F154 HydrophobicContact CE1-CD1 3.51Å; F135-F154 AromaticContact CE1-CD2 3.63Å; F135-F154 HydrophobicContact CE1-CD2 3.63Å; F135-F154 AromaticContact CE1-CE1 3.48Å; F135-F154 HydrophobicContact CE1-CE1 3.48Å; F135-F154 VanDerWaalsContact CE1-CE1 3.48Å; F135-F154 AromaticContact CE1-CE2 3.61Å; F135-F154 HydrophobicContact CE1-CE2 3.61Å; F135-F154 AromaticContact CE1-CG 3.58Å; F135-F154 HydrophobicContact CE1-CG 3.58Å; F135-F154 AromaticContact CE1-CZ 3.53Å; F135-F154 HydrophobicContact CE1-CZ 3.53Å; F135-F154 HydrophobicContact CZ-CD1 4.4Å; F135-F154 HydrophobicContact CZ-CD2 4.45Å; F135-F154 AromaticContact CZ-CE1 3.92Å; F135-F154 HydrophobicContact CZ-CE1 3.92Å; F135-F154 AromaticContact CZ-CE2 3.98Å; F135-F154 HydrophobicContact CZ-CE2 3.98Å; F135-F154 AromaticContact CZ-CZ 3.69Å; F135-F154 HydrophobicContact CZ-CZ 3.69Å; F135-D234 HydrophobicContact CD2-CB 3.7Å; F135-D234 HydrophobicContact CE2-CB 4.09Å; F135-D234 PolarHBondContact N-OD1 2.94Å; F135-M235 HydrophobicContact CE2-CE 3.84Å; F135-M235 HydrophobicContact CE2-SD 4.49Å; F135-M235 HydrophobicContact CZ-CE 4.29Å; F135-F238 HydrophobicContact CB-CD2 4.43Å; F135-F238 HydrophobicContact CD2-CB 4.28Å; F135-L239 HydrophobicContact CE2-CB 3.96Å; F135-L239 HydrophobicContact CZ-CB 4.45Å
136	E	98.8	Very high	97.1	Very high	19 Å²	19	44.1 Å²	44.1	9%	0.089	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	143.9	156.6	-58.9	-57.3	149.8	0	0	109.8	I152 E153 T190 I192	E136-I152 HydrophobicContact CB-CG1 4.19Å; E136-I152 PolarHBondContact O-N 3.43Å; E136-E153 HydrophobicContact CB-CB 3.75Å; E136-E153 HydrophobicContact CG-CB 4.11Å; E136-E153 WeakPolarHBondContact CG-OE2 3.49Å; E136-E153 PolarHBondContact N-O 2.93Å; E136-E153 PolarHBondContact O-N 3.27Å; E136-T190 HydrophobicContact CB-CG2 4.3Å; E136-T190 HydrophobicContact CG-CG2 4.47Å; E136-I192 HydrophobicContact CB-CD1 3.89Å; E136-I192 HydrophobicContact CG-CD1 4.31Å
137	A	98.8	Very high	97.2	Very high	8 Å²	8	42.9 Å²	42.9	7%	0.066	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	156	-177.4	0	0	0	0	0	111.8	C139 H149 E150 F238	A137-C139 PolarHBondContact O-N 3.37Å; A137-H149 HydrophobicContact CB-CB 4.3Å; A137-E150 CarbonylContact C-O 3.59Å; A137-E150 WeakPolarHBondContact CA-O 3.44Å; A137-E150 WeakPolarHBondContact CB-O 3.24Å; A137-F238 HydrophobicContact CB-CD1 3.82Å; A137-F238 HydrophobicContact CB-CE1 3.82Å; A137-F238 HydrophobicContact CB-CG 4.37Å; A137-F238 HydrophobicContact CB-CZ 4.36Å
138	T	98.8	Very high	97.2	Very high	4 Å²	4	45.8 Å²	45.8	3%	0.025	26%	0.259	C	S	.	.			trans	-53.7	140.5	168.5	59.3	0	0	0	0	109.9	F147 H149 E150 I152 P176 L182	T138-F147 WeakPolarHBondContact O-CE1 3.49Å; T138-H149 PolarHBondContact O-ND1 3.35Å; T138-E150 HydrophobicContact CG2-CB 4.2Å; T138-E150 PolarHBondContact N-O 3.3Å; T138-E150 PolarHBondContact OG1-N 3.32Å; T138-I152 HydrophobicContact CG2-CG2 3.55Å; T138-P176 HydrophobicContact CG2-CB 4.06Å; T138-P176 HydrophobicContact CG2-CG 4.15Å; T138-L182 HydrophobicContact CG2-CD2 3.87Å
139	C	98.1	Very high	97.2	Very high	17 Å²	17	44.5 Å²	44.5	12%	0.115	25%	0.252	C	S	.	.			trans	-154.9	165.1	179.3	54.6	0	0	0	0	111.8	A137 S183 C186	A137-C139 PolarHBondContact O-N 3.37Å; C139-S183 PolarHBondContact O-OG 2.84Å; C139-C186 WeakPolarHBondContact O-CB 3.44Å
140	E	97.1	Very high	97.2	Very high	90 Å²	90	43.8 Å²	43.8	42%	0.421	25%	0.25	S	C	.	.			trans	-127.5	157	174.3	-78.6	-176.8	-179.7	0	0	110.8	N143 P144 F147	E140-N143 PolarHBondContact O-N 2.75Å; E140-N143 VanDerWaalsContact O-N 3.13Å; E140-P144 HydrophobicContact CB-CG 4.1Å; E140-F147 HydrophobicContact CB-CD2 4.32Å; E140-F147 HydrophobicContact CB-CE2 4.34Å; E140-F147 HydrophobicContact CG-CD2 3.91Å; E140-F147 HydrophobicContact CG-CE2 3.54Å; E140-F147 HydrophobicContact CG-CZ 4.24Å
141	E	96	Very high	97.2	Very high	155 Å²	155	43.8 Å²	43.8	72%	0.724	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	141.5	175.4	-170.6	170.4	-156.2	0	0	110.8	N143 F185	E141-N143 PolarHBondContact O-N 3.25Å; E141-F185 HydrophobicContact CB-CB 4.1Å; E141-F185 HydrophobicContact CB-CD2 3.98Å; E141-F185 HydrophobicContact CB-CG 3.96Å; E141-F185 HydrophobicContact CG-CD2 4.12Å; E141-F185 HydrophobicContact CG-CE2 4.49Å
142	G	93.7	Very high	97.2	Very high	76 Å²	76	43.8 Å²	43.8	78%	0.784	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.4	-5.5	-175.8	0	0	0	0	0	114.9
143	N	93.3	Very high	97.2	Very high	82 Å²	82	43.8 Å²	43.8	44%	0.439	25%	0.25	S	C	.	.			trans	49.7	63.2	177.6	-177.5	60.3	0	0	0	112.7	E140 E141	E140-N143 PolarHBondContact O-N 2.75Å; E140-N143 VanDerWaalsContact O-N 3.13Å; E141-N143 PolarHBondContact O-N 3.25Å
144	P	95.2	Very high	97.2	Very high	46 Å²	46	43.8 Å²	43.8	30%	0.299	25%	0.25	S	C	.	.			trans	-57.7	134.2	-177.9	12.5	-18.4	0	0	0	111.3	E140 E146 F147	E140-P144 HydrophobicContact CB-CG 4.1Å; P144-E146 VanDerWaalsContact C-N 3.3Å; P144-E146 PolarHBondContact O-N 3.07Å; P144-F147 HydrophobicContact CB-CB 4.48Å; P144-F147 HydrophobicContact CG-CB 4.06Å; P144-F147 VanDerWaalsContact O-CB 3.31Å; P144-F147 WeakPolarHBondContact O-CB 3.44Å; P144-F147 PolarHBondContact O-N 3.16Å; P144-F147 VanDerWaalsContact O-N 3.16Å
145	P	90.8	Very high	97.2	Very high	118 Å²	118	42.9 Å²	42.9	77%	0.766	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-29.5	-169	24.2	-33.8	0	0	0	114	F147	P145-F147 VanDerWaalsContact C-N 3.34Å
146	E	94.8	Very high	97.2	Very high	171 Å²	171	42.6 Å²	42.6	80%	0.799	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	3	-179.4	-56	-55	142.1	0	0	113.1	P144 V148	P144-E146 VanDerWaalsContact C-N 3.3Å; P144-E146 PolarHBondContact O-N 3.07Å; E146-V148 PolarHBondContact O-N 3.32Å
147	F	97.1	Very high	97.2	Very high	28 Å²	28	41.7 Å²	41.7	12%	0.123	24%	0.239	C	C	.	.			trans	-66.5	128.2	179.4	-173.4	-90.7	0	0	0	111.1	T138 E140 P144 P145 H149 N179	T138-F147 WeakPolarHBondContact O-CE1 3.49Å; E140-F147 HydrophobicContact CB-CD2 4.32Å; E140-F147 HydrophobicContact CB-CE2 4.34Å; E140-F147 HydrophobicContact CG-CD2 3.91Å; E140-F147 HydrophobicContact CG-CE2 3.54Å; E140-F147 HydrophobicContact CG-CZ 4.24Å; P144-F147 HydrophobicContact CB-CB 4.48Å; P144-F147 HydrophobicContact CG-CB 4.06Å; P144-F147 VanDerWaalsContact O-CB 3.31Å; P144-F147 WeakPolarHBondContact O-CB 3.44Å; P144-F147 PolarHBondContact O-N 3.16Å; P144-F147 VanDerWaalsContact O-N 3.16Å; P145-F147 VanDerWaalsContact C-N 3.34Å; F147-H149 AromaticContact CD1-CE1 3.85Å; F147-H149 AromaticContact CD1-ND1 3.67Å; F147-H149 AromaticContact CE1-ND1 3.98Å; F147-H149 PolarHBondContact O-CD2 2.85Å; F147-H149 PolarHBondContact O-N 3.28Å; F147-N179 VanDerWaalsContact CE2-ND2 3.29Å; F147-N179 WeakPolarHBondContact CE2-ND2 3.01Å; F147-N179 WeakPolarHBondContact CZ-ND2 3.49Å
148	V	97.9	Very high	97.2	Very high	62 Å²	62	41.4 Å²	41.4	38%	0.376	24%	0.236	S	C	.	.			trans	-86.2	99.3	179.7	-177.4	0	0	0	0	108.9	E146 I241 L245	E146-V148 PolarHBondContact O-N 3.32Å; V148-I241 HydrophobicContact CG1-CG2 4.44Å; V148-L245 HydrophobicContact CG1-CD1 3.84Å; V148-L245 HydrophobicContact CG1-CD2 3.99Å; V148-L245 HydrophobicContact CG1-CG 4.48Å
149	H	98.6	Very high	97.2	Very high	8 Å²	8	41.2 Å²	41.2	4%	0.037	24%	0.235	C	C	.	.			trans	-71.9	138.4	177.2	-60.1	-82.4	0	0	0	112	A137 T138 F147 K237 F238 I241	A137-H149 HydrophobicContact CB-CB 4.3Å; T138-H149 PolarHBondContact O-ND1 3.35Å; F147-H149 AromaticContact CD1-CE1 3.85Å; F147-H149 AromaticContact CD1-ND1 3.67Å; F147-H149 AromaticContact CE1-ND1 3.98Å; F147-H149 PolarHBondContact O-CD2 2.85Å; F147-H149 PolarHBondContact O-N 3.28Å; H149-K237 PolarHBondContact CD2-NZ 2.93Å; H149-K237 PolarHBondContact NE2-NZ 2.9Å; H149-F238 HydrophobicContact CB-CD1 4.01Å; H149-F238 HydrophobicContact CB-CE1 4.07Å; H149-F238 AromaticContact CG-CE1 3.91Å; H149-I241 WeakPolarHBondContact O-CG2 3.13Å
150	E	98.8	Very high	97.2	Very high	4 Å²	4	41 Å²	41	2%	0.019	23%	0.233	C	C	.	.			trans	-121.3	137.9	169.4	-69.1	-179.1	95.7	0	0	109.3	A137 T138 I152 P176 E177 I178 N179 Q242 L245	A137-E150 CarbonylContact C-O 3.59Å; A137-E150 WeakPolarHBondContact CA-O 3.44Å; A137-E150 WeakPolarHBondContact CB-O 3.24Å; T138-E150 HydrophobicContact CG2-CB 4.2Å; T138-E150 PolarHBondContact N-O 3.3Å; T138-E150 PolarHBondContact OG1-N 3.32Å; E150-I152 PolarHBondContact O-N 3.49Å; E150-P176 HydrophobicContact CB-CB 3.87Å; E150-P176 HydrophobicContact CG-CB 4.39Å; E150-P176 WeakPolarHBondContact OE2-CB 3.3Å; E150-E177 PolarHBondContact OE1-N 3.04Å; E150-I178 PolarHBondContact OE1-N 2.85Å; E150-I178 VanDerWaalsContact OE1-N 3.09Å; E150-I178 WeakPolarHBondContact OE2-CA 3.42Å; E150-I178 VanDerWaalsContact OE2-CB 3.32Å; E150-I178 WeakPolarHBondContact OE2-CB 3.22Å; E150-I178 PolarHBondContact OE2-N 2.91Å; E150-N179 PolarHBondContact OE2-N 3.01Å; E150-Q242 VanDerWaalsContact CA-OE1 3.25Å; E150-L245 HydrophobicContact CG-CD1 3.64Å
151	I	98.9	Very high	97.3	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	131.6	176.2	-65.2	174	0	0	0	108.4	F135 E153 V174 F203 F238 Q242	F135-I151 HydrophobicContact CB-CG1 4.44Å; F135-I151 HydrophobicContact CB-CG2 4.44Å; F135-I151 HydrophobicContact CD1-CD1 3.92Å; F135-I151 HydrophobicContact CD1-CG1 4.41Å; F135-I151 HydrophobicContact CD1-CG2 3.81Å; F135-I151 HydrophobicContact CD2-CD1 4.06Å; F135-I151 HydrophobicContact CE1-CD1 3.99Å; F135-I151 HydrophobicContact CE1-CG2 4.42Å; F135-I151 HydrophobicContact CE2-CD1 4.16Å; F135-I151 HydrophobicContact CG-CD1 3.96Å; F135-I151 HydrophobicContact CG-CG1 4.3Å; F135-I151 HydrophobicContact CG-CG2 4.35Å; F135-I151 HydrophobicContact CZ-CD1 4.12Å; I151-E153 WeakPolarHBondContact CG2-O 3.09Å; I151-V174 HydrophobicContact CG2-CG2 4.22Å; I151-V174 VanDerWaalsContact O-CB 3.26Å; I151-V174 WeakPolarHBondContact O-CB 3.5Å; I151-V174 VanDerWaalsContact O-CG1 3.26Å; I151-V174 WeakPolarHBondContact O-CG1 3.35Å; I151-F203 HydrophobicContact CD1-CD2 4.44Å; I151-F203 HydrophobicContact CD1-CE2 3.91Å; I151-F238 HydrophobicContact CD1-CB 4.3Å; I151-F238 HydrophobicContact CG1-CB 4.1Å; I151-Q242 HydrophobicContact CB-CG 4.32Å; I151-Q242 HydrophobicContact CD1-CB 3.82Å; I151-Q242 HydrophobicContact CD1-CG 4.03Å; I151-Q242 HydrophobicContact CG1-CB 4.09Å; I151-Q242 HydrophobicContact CG1-CG 4.22Å
152	I	98.9	Very high	97.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	-13.1	179.3	58.5	176	0	0	0	113.3	E136 T138 E150 Y173 V174 P176 L182 I192 V197	E136-I152 HydrophobicContact CB-CG1 4.19Å; E136-I152 PolarHBondContact O-N 3.43Å; T138-I152 HydrophobicContact CG2-CG2 3.55Å; E150-I152 PolarHBondContact O-N 3.49Å; I152-Y173 CarbonylContact O-C 3.18Å; I152-Y173 VanDerWaalsContact O-CA 3.29Å; I152-Y173 WeakPolarHBondContact O-CA 3.43Å; I152-V174 PolarHBondContact O-N 3.16Å; I152-P176 HydrophobicContact CG2-CB 4.34Å; I152-P176 HydrophobicContact CG2-CG 3.98Å; I152-L182 HydrophobicContact CD1-CD2 4.06Å; I152-L182 HydrophobicContact CG2-CD2 4.18Å; I152-I192 HydrophobicContact CD1-CD1 3.93Å; I152-I192 HydrophobicContact CG1-CD1 3.89Å; I152-V197 HydrophobicContact CB-CG1 4.07Å; I152-V197 HydrophobicContact CG2-CG1 4.29Å
153	E	98.9	Very high	97.5	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	134.2	168.5	-164.3	-174.5	163.5	0	0	110.1	E136 I151 Q171 Y173 I192 G295 L296	E136-E153 HydrophobicContact CB-CB 3.75Å; E136-E153 HydrophobicContact CG-CB 4.11Å; E136-E153 WeakPolarHBondContact CG-OE2 3.49Å; E136-E153 PolarHBondContact N-O 2.93Å; E136-E153 PolarHBondContact O-N 3.27Å; I151-E153 WeakPolarHBondContact CG2-O 3.09Å; E153-Q171 HydrophobicContact CG-CG 4.44Å; E153-Q171 PolarHBondContact OE1-NE2 3.13Å; E153-Y173 HydrophobicContact CB-CD1 4.23Å; E153-Y173 HydrophobicContact CB-CE1 4.44Å; E153-Y173 HydrophobicContact CG-CD1 4.03Å; E153-Y173 HydrophobicContact CG-CE1 3.95Å; E153-I192 HydrophobicContact CB-CD1 3.85Å; E153-G295 PolarHBondContact OE1-N 3.18Å; E153-G295 PolarHBondContact OE2-N 3.18Å; E153-L296 PolarHBondContact OE1-N 3.2Å; E153-L296 VanDerWaalsContact OE1-N 3.14Å
154	F	98.9	Very high	97.7	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.018	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	85.1	175.5	-159.1	-33.9	0	0	0	109.8	I133 F135 V156 Q172 V174 F203 V206 L207 V210	I133-F154 HydrophobicContact CD1-CE1 4.23Å; I133-F154 HydrophobicContact CG2-CE1 4.1Å; F135-F154 HydrophobicContact CD1-CD1 4.27Å; F135-F154 HydrophobicContact CD1-CD2 4.48Å; F135-F154 HydrophobicContact CD1-CG 4.2Å; F135-F154 HydrophobicContact CE1-CB 4.37Å; F135-F154 AromaticContact CE1-CD1 3.51Å; F135-F154 HydrophobicContact CE1-CD1 3.51Å; F135-F154 AromaticContact CE1-CD2 3.63Å; F135-F154 HydrophobicContact CE1-CD2 3.63Å; F135-F154 AromaticContact CE1-CE1 3.48Å; F135-F154 HydrophobicContact CE1-CE1 3.48Å; F135-F154 VanDerWaalsContact CE1-CE1 3.48Å; F135-F154 AromaticContact CE1-CE2 3.61Å; F135-F154 HydrophobicContact CE1-CE2 3.61Å; F135-F154 AromaticContact CE1-CG 3.58Å; F135-F154 HydrophobicContact CE1-CG 3.58Å; F135-F154 AromaticContact CE1-CZ 3.53Å; F135-F154 HydrophobicContact CE1-CZ 3.53Å; F135-F154 HydrophobicContact CZ-CD1 4.4Å; F135-F154 HydrophobicContact CZ-CD2 4.45Å; F135-F154 AromaticContact CZ-CE1 3.92Å; F135-F154 HydrophobicContact CZ-CE1 3.92Å; F135-F154 AromaticContact CZ-CE2 3.98Å; F135-F154 HydrophobicContact CZ-CE2 3.98Å; F135-F154 AromaticContact CZ-CZ 3.69Å; F135-F154 HydrophobicContact CZ-CZ 3.69Å; F154-V156 HydrophobicContact CD1-CG2 4.06Å; F154-V156 HydrophobicContact CE1-CG2 3.96Å; F154-Q172 PolarHBondContact N-O 2.89Å; F154-Q172 PolarHBondContact O-N 3.48Å; F154-V174 HydrophobicContact CB-CG2 4.23Å; F154-F203 HydrophobicContact CD2-CE2 4.05Å; F154-F203 AromaticContact CE2-CE2 3.94Å; F154-F203 HydrophobicContact CE2-CE2 3.94Å; F154-V206 HydrophobicContact CB-CG1 3.85Å; F154-V206 HydrophobicContact CD2-CG1 4.19Å; F154-V206 HydrophobicContact CG-CG1 4.29Å; F154-L207 HydrophobicContact CE2-CD1 4.01Å; F154-L207 HydrophobicContact CZ-CD1 4.29Å; F154-V210 HydrophobicContact CD1-CG2 3.84Å; F154-V210 HydrophobicContact CD2-CG2 4.25Å; F154-V210 HydrophobicContact CE1-CG1 4.03Å; F154-V210 HydrophobicContact CE1-CG2 3.93Å; F154-V210 HydrophobicContact CE2-CG2 4.33Å; F154-V210 HydrophobicContact CG-CG2 4.02Å; F154-V210 HydrophobicContact CZ-CG1 4.15Å; F154-V210 HydrophobicContact CZ-CG2 4.19Å
155	P	98.8	Very high	97.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	150.3	173.1	36	-34.3	0	0	0	111.4	D134 F170 G295 L296	D134-P155 WeakPolarHBondContact O-CD 3.23Å; D134-P155 WeakPolarHBondContact O-CG 3.3Å; P155-F170 CarbonylContact C-O 3.56Å; P155-F170 VanDerWaalsContact CA-O 3.31Å; P155-F170 WeakPolarHBondContact CA-O 3.36Å; P155-G295 VanDerWaalsContact CG-C 3.46Å; P155-L296 HydrophobicContact CB-CB 4.11Å; P155-L296 HydrophobicContact CB-CD1 4.32Å
156	V	98.9	Very high	98.3	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	127.4	168.6	-167.9	0	0	0	0	109	C131 I132 I133 F154 T169 F170 V210 W213	C131-V156 HydrophobicContact CB-CG1 4.33Å; I132-V156 WeakPolarHBondContact O-CA 3.13Å; I133-V156 HydrophobicContact CG1-CG1 4.26Å; I133-V156 HydrophobicContact CG1-CG2 4.29Å; F154-V156 HydrophobicContact CD1-CG2 4.06Å; F154-V156 HydrophobicContact CE1-CG2 3.96Å; V156-T169 CarbonylContact O-C 3.55Å; V156-T169 WeakPolarHBondContact O-CA 3.43Å; V156-F170 HydrophobicContact CB-CB 4.26Å; V156-F170 HydrophobicContact CG2-CD1 4.4Å; V156-F170 PolarHBondContact N-O 3.48Å; V156-F170 PolarHBondContact O-N 3.22Å; V156-V210 HydrophobicContact CG2-CG1 3.96Å; V156-V210 HydrophobicContact CG2-CG2 4.38Å; V156-W213 HydrophobicContact CB-CH2 4.3Å; V156-W213 HydrophobicContact CB-CZ3 4.13Å; V156-W213 HydrophobicContact CG1-CH2 3.92Å; V156-W213 HydrophobicContact CG1-CZ3 3.64Å
157	V	98.9	Very high	98.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	126.1	173.9	173.4	0	0	0	0	108.9	I132 I166 T169 L296 K300 A303	I132-V157 HydrophobicContact CB-CB 4.22Å; I132-V157 HydrophobicContact CD1-CB 4.46Å; I132-V157 HydrophobicContact CD1-CG1 4.3Å; I132-V157 WeakPolarHBondContact CD1-O 3.25Å; I132-V157 PolarHBondContact N-O 2.6Å; I132-V157 PolarHBondContact O-N 3.33Å; V157-I166 HydrophobicContact CG1-CB 4.42Å; V157-I166 HydrophobicContact CG1-CD1 3.87Å; V157-I166 HydrophobicContact CG1-CG1 3.9Å; V157-I166 HydrophobicContact CG1-CG2 3.68Å; V157-T169 HydrophobicContact CG1-CG2 4.45Å; V157-T169 HydrophobicContact CG2-CG2 4.1Å; V157-L296 HydrophobicContact CG2-CD1 3.89Å; V157-K300 HydrophobicContact CG2-CG 4.13Å; V157-A303 HydrophobicContact CG1-CB 4.04Å
158	L	98.9	Very high	98.6	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	109.8	-179.8	-169.3	63.3	0	0	0	110.6	Y129 I166 E167 D168 W213 K217 L219	Y129-L158 HydrophobicContact CD1-CD1 3.63Å; Y129-L158 HydrophobicContact CD1-CD2 3.98Å; Y129-L158 HydrophobicContact CD1-CG 3.55Å; Y129-L158 HydrophobicContact CE1-CD1 4.44Å; Y129-L158 HydrophobicContact CE1-CD2 3.96Å; Y129-L158 HydrophobicContact CE1-CG 3.96Å; Y129-L158 HydrophobicContact CG-CD1 3.94Å; Y129-L158 HydrophobicContact CG-CG 4.35Å; L158-I166 CarbonylContact O-C 3.51Å; L158-I166 WeakPolarHBondContact O-CA 3.43Å; L158-E167 PolarHBondContact O-N 2.79Å; L158-D168 HydrophobicContact CB-CB 4.34Å; L158-D168 PolarHBondContact N-O 3.09Å; L158-W213 HydrophobicContact CB-CH2 3.87Å; L158-W213 HydrophobicContact CB-CZ2 4.35Å; L158-W213 HydrophobicContact CD2-CH2 4.45Å; L158-K217 HydrophobicContact CD2-CB 4.26Å; L158-K217 HydrophobicContact CD2-CD 4.28Å; L158-K217 HydrophobicContact CD2-CG 3.99Å; L158-L219 HydrophobicContact CD1-CD1 4.08Å; L158-L219 HydrophobicContact CD1-CD2 4.25Å
159	L	98.9	Very high	98.6	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	120.5	175.9	172.8	63.2	0	0	0	110.1	Y129 I130 I132 A306 V307 L310	Y129-L159 WeakPolarHBondContact CA-O 3.34Å; I130-L159 HydrophobicContact CB-CB 4.4Å; I130-L159 PolarHBondContact N-O 3.42Å; I130-L159 PolarHBondContact O-N 2.69Å; I132-L159 HydrophobicContact CD1-CB 3.72Å; L159-A306 HydrophobicContact CD2-CB 3.97Å; L159-V307 HydrophobicContact CD1-CG2 3.5Å; L159-V307 VanDerWaalsContact CD1-CG2 3.5Å; L159-V307 HydrophobicContact CD2-CG2 3.99Å; L159-V307 HydrophobicContact CG-CG2 4.41Å; L159-L310 HydrophobicContact CD2-CD1 4.3Å
160	N	98.8	Very high	98.6	Very high	14 Å²	14	33 Å²	33	8%	0.075	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	124.5	167.9	-178.8	-37.7	0	0	0	109.1	Y129 H162 T163 L164 E165 E167	Y129-N160 HydrophobicContact CD1-CB 4.12Å; Y129-N160 HydrophobicContact CE1-CB 3.69Å; N160-H162 WeakPolarHBondContact OD1-CA 3.12Å; N160-H162 VanDerWaalsContact OD1-CB 3.29Å; N160-H162 WeakPolarHBondContact OD1-CB 3.39Å; N160-H162 PolarHBondContact OD1-N 3.19Å; N160-T163 WeakPolarHBondContact CB-OG1 3.37Å; N160-T163 PolarHBondContact OD1-N 2.99Å; N160-T163 VanDerWaalsContact OD1-N 3.13Å; N160-L164 WeakPolarHBondContact O-CA 3.14Å; N160-L164 PolarHBondContact O-N 2.91Å; N160-E165 PolarHBondContact N-O 2.84Å; N160-E167 HydrophobicContact CB-CG 3.85Å; N160-E167 WeakPolarHBondContact CB-OE1 3.45Å; N160-E167 PolarHBondContact ND2-OE1 3.44Å
161	T	98.2	Very high	98.6	Very high	19 Å²	19	36 Å²	36	12%	0.117	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-19.1	-175	64	0	0	0	0	113.5	Y126 Y127 D128 I130 L164	Y126-T161 HydrophobicContact CD1-CG2 4.48Å; Y126-T161 HydrophobicContact CE1-CG2 4.07Å; Y127-T161 WeakPolarHBondContact O-CB 3.41Å; Y127-T161 WeakPolarHBondContact O-CG2 3.39Å; Y127-T161 PolarHBondContact O-OG1 3.42Å; D128-T161 PolarHBondContact O-N 3.31Å; D128-T161 PolarHBondContact O-OG1 3.48Å; D128-T161 VanDerWaalsContact O-OG1 3.08Å; I130-T161 HydrophobicContact CD1-CG2 4.02Å; I130-T161 HydrophobicContact CG1-CG2 3.87Å; T161-L164 WeakPolarHBondContact O-CD2 3.39Å
162	H	96.3	Very high	98.6	Very high	109 Å²	109	38.8 Å²	38.8	51%	0.505	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-47.6	177.9	-58.3	-74	0	0	0	110.9	D128 N160	D128-H162 IonicContact OD1-CD2 3.29Å; D128-H162 IonicContact OD1-CE1 3.16Å; D128-H162 IonicContact OD1-NE2 3.82Å; D128-H162 PolarHBondContact OD1-NE2 3.46Å; N160-H162 WeakPolarHBondContact OD1-CA 3.12Å; N160-H162 VanDerWaalsContact OD1-CB 3.29Å; N160-H162 WeakPolarHBondContact OD1-CB 3.39Å; N160-H162 PolarHBondContact OD1-N 3.19Å
163	T	97.9	Very high	98.6	Very high	70 Å²	70	41.6 Å²	41.6	43%	0.429	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-22.6	178.5	64.5	0	0	0	0	112.5	N160 E165	N160-T163 WeakPolarHBondContact CB-OG1 3.37Å; N160-T163 PolarHBondContact OD1-N 2.99Å; N160-T163 VanDerWaalsContact OD1-N 3.13Å; T163-E165 PolarHBondContact O-N 2.85Å; T163-E165 PolarHBondContact OG1-N 3.47Å
164	L	98.3	Very high	98.6	Very high	46 Å²	46	41.6 Å²	41.6	24%	0.241	21%	0.206	C	C	.	.			trans	61.5	28.6	-171.6	-56.8	174.2	0	0	0	113.4	N160 T161 V307 L310 Q311	N160-L164 WeakPolarHBondContact O-CA 3.14Å; N160-L164 PolarHBondContact O-N 2.91Å; T161-L164 WeakPolarHBondContact O-CD2 3.39Å; L164-V307 HydrophobicContact CB-CG1 4.14Å; L164-V307 HydrophobicContact CB-CG2 4.42Å; L164-V307 WeakPolarHBondContact O-CG2 3.39Å; L164-L310 HydrophobicContact CD2-CB 3.9Å; L164-L310 HydrophobicContact CD2-CD1 3.67Å; L164-L310 HydrophobicContact CD2-CG 4.43Å; L164-Q311 HydrophobicContact CD1-CG 3.61Å
165	E	98.6	Very high	98.6	Very high	130 Å²	130	45.6 Å²	45.6	61%	0.607	22%	0.221	S	C	*	.	S	Bend	trans	-112.7	148.8	179	-63.8	-176.6	168	0	0	111.3	N160 T163 E167	N160-E165 PolarHBondContact N-O 2.84Å; T163-E165 PolarHBondContact O-N 2.85Å; T163-E165 PolarHBondContact OG1-N 3.47Å; E165-E167 PolarHBondContact O-N 2.88Å
166	I	98.8	Very high	98.6	Very high	70 Å²	70	45.7 Å²	45.7	36%	0.359	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	112.5	168.8	-63.6	171.1	0	0	0	107.1	V157 L158 T169 K300 A303	V157-I166 HydrophobicContact CG1-CB 4.42Å; V157-I166 HydrophobicContact CG1-CD1 3.87Å; V157-I166 HydrophobicContact CG1-CG1 3.9Å; V157-I166 HydrophobicContact CG1-CG2 3.68Å; L158-I166 CarbonylContact O-C 3.51Å; L158-I166 WeakPolarHBondContact O-CA 3.43Å; I166-T169 HydrophobicContact CG2-CG2 3.76Å; I166-K300 HydrophobicContact CD1-CG 4.41Å; I166-A303 HydrophobicContact CD1-CB 3.96Å; I166-A303 HydrophobicContact CG1-CB 4.22Å
167	E	98.6	Very high	98.6	Very high	94 Å²	94	50.8 Å²	50.8	44%	0.439	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-28.5	-178.3	-74.8	-166.8	176.4	0	0	113.3	Y129 L158 N160 E165	Y129-E167 HydrophobicContact CE1-CG 4.43Å; Y129-E167 WeakPolarHBondContact CE1-OE2 3.25Å; Y129-E167 VanDerWaalsContact CZ-OE2 3.27Å; Y129-E167 PolarHBondContact OH-OE1 2.84Å; Y129-E167 PolarHBondContact OH-OE2 3.4Å; L158-E167 PolarHBondContact O-N 2.79Å; N160-E167 HydrophobicContact CB-CG 3.85Å; N160-E167 WeakPolarHBondContact CB-OE1 3.45Å; N160-E167 PolarHBondContact ND2-OE1 3.44Å; E165-E167 PolarHBondContact O-N 2.88Å
168	D	98.8	Very high	98.6	Very high	42 Å²	42	55.7 Å²	55.7	23%	0.225	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	156.6	179.7	-159.4	3.6	0	0	0	111.4	L158 W213 K217	L158-D168 HydrophobicContact CB-CB 4.34Å; L158-D168 PolarHBondContact N-O 3.09Å; D168-W213 HydrophobicContact CB-CZ2 3.79Å; D168-W213 PolarHBondContact OD2-NE1 3.22Å; D168-K217 WeakPolarHBondContact OD2-CE 3.4Å; D168-K217 IonicContact OD2-NZ 2.61Å; D168-K217 PolarHBondContact OD2-NZ 2.96Å
169	T	98.8	Very high	98.5	Very high	58 Å²	58	58 Å²	58	36%	0.356	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	134.8	176	60.3	0	0	0	0	109.9	V156 V157 I166 L296	V156-T169 CarbonylContact O-C 3.55Å; V156-T169 WeakPolarHBondContact O-CA 3.43Å; V157-T169 HydrophobicContact CG1-CG2 4.45Å; V157-T169 HydrophobicContact CG2-CG2 4.1Å; I166-T169 HydrophobicContact CG2-CG2 3.76Å; T169-L296 HydrophobicContact CG2-CD1 4.42Å
170	F	98.8	Very high	98.5	Very high	30 Å²	30	61.1 Å²	61.1	13%	0.132	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	138.7	176.1	179.5	-86	0	0	0	109.1	P155 V156 Q172 K209 V210 W213	P155-F170 CarbonylContact C-O 3.56Å; P155-F170 VanDerWaalsContact CA-O 3.31Å; P155-F170 WeakPolarHBondContact CA-O 3.36Å; V156-F170 HydrophobicContact CB-CB 4.26Å; V156-F170 HydrophobicContact CG2-CD1 4.4Å; V156-F170 PolarHBondContact N-O 3.48Å; V156-F170 PolarHBondContact O-N 3.22Å; F170-Q172 HydrophobicContact CD1-CG 4.49Å; F170-Q172 HydrophobicContact CE1-CB 4Å; F170-Q172 HydrophobicContact CE1-CG 3.45Å; F170-Q172 VanDerWaalsContact CE1-CG 3.45Å; F170-Q172 HydrophobicContact CE2-CG 4.25Å; F170-Q172 HydrophobicContact CZ-CB 4.33Å; F170-Q172 HydrophobicContact CZ-CG 3.31Å; F170-K209 HydrophobicContact CZ-CB 3.97Å; F170-V210 HydrophobicContact CD1-CG2 3.96Å; F170-V210 HydrophobicContact CE1-CG2 3.44Å; F170-V210 VanDerWaalsContact CE1-CG2 3.44Å; F170-V210 HydrophobicContact CZ-CG2 4.13Å; F170-W213 HydrophobicContact CB-CD2 4.17Å; F170-W213 HydrophobicContact CB-CG 4.48Å; F170-W213 HydrophobicContact CB-CZ2 4.19Å; F170-W213 HydrophobicContact CD2-CB 4.19Å; F170-W213 AromaticContact CD2-CD1 3.92Å; F170-W213 HydrophobicContact CD2-CD2 4.46Å; F170-W213 AromaticContact CD2-CG 3.93Å; F170-W213 HydrophobicContact CD2-CG 3.93Å; F170-W213 HydrophobicContact CE2-CB 4.38Å; F170-W213 HydrophobicContact CG-CG 4.45Å
171	Q	98.8	Very high	98.5	Very high	65 Å²	65	66.6 Å²	66.6	30%	0.304	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	129.9	176.5	-169.2	-175.8	23.8	0	0	109.4	E153 L296	E153-Q171 HydrophobicContact CG-CG 4.44Å; E153-Q171 PolarHBondContact OE1-NE2 3.13Å; Q171-L296 HydrophobicContact CB-CD2 4.13Å; Q171-L296 HydrophobicContact CG-CB 4.19Å; Q171-L296 HydrophobicContact CG-CD2 4.36Å
172	Q	98.9	Very high	98.5	Very high	60 Å²	60	66.4 Å²	66.4	28%	0.28	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	138.9	169.5	-73.4	-70.9	-83.5	0	0	108.8	F154 F170 V206	F154-Q172 PolarHBondContact N-O 2.89Å; F154-Q172 PolarHBondContact O-N 3.48Å; F170-Q172 HydrophobicContact CD1-CG 4.49Å; F170-Q172 HydrophobicContact CE1-CB 4Å; F170-Q172 HydrophobicContact CE1-CG 3.45Å; F170-Q172 VanDerWaalsContact CE1-CG 3.45Å; F170-Q172 HydrophobicContact CE2-CG 4.25Å; F170-Q172 HydrophobicContact CZ-CB 4.33Å; F170-Q172 HydrophobicContact CZ-CG 3.31Å; Q172-V206 HydrophobicContact CB-CG1 3.62Å; Q172-V206 HydrophobicContact CB-CG2 4.28Å; Q172-V206 HydrophobicContact CG-CG1 4.27Å
173	Y	98.9	Very high	98.6	Very high	60 Å²	60	62.9 Å²	62.9	24%	0.235	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	156.8	163.2	-60.5	-65.9	0	0	0	109.9	I152 E153 I192 Q196 A200	I152-Y173 CarbonylContact O-C 3.18Å; I152-Y173 VanDerWaalsContact O-CA 3.29Å; I152-Y173 WeakPolarHBondContact O-CA 3.43Å; E153-Y173 HydrophobicContact CB-CD1 4.23Å; E153-Y173 HydrophobicContact CB-CE1 4.44Å; E153-Y173 HydrophobicContact CG-CD1 4.03Å; E153-Y173 HydrophobicContact CG-CE1 3.95Å; Y173-I192 HydrophobicContact CD1-CD1 4.17Å; Y173-I192 HydrophobicContact CD1-CG1 4.33Å; Y173-I192 HydrophobicContact CD1-CG2 4.04Å; Y173-I192 HydrophobicContact CE1-CD1 4.03Å; Y173-I192 HydrophobicContact CE1-CG1 3.85Å; Y173-I192 HydrophobicContact CE1-CG2 4.18Å; Y173-Q196 HydrophobicContact CD2-CB 4.16Å; Y173-Q196 HydrophobicContact CD2-CG 4.43Å; Y173-Q196 HydrophobicContact CE2-CB 4.44Å; Y173-Q196 HydrophobicContact CE2-CG 4.28Å; Y173-Q196 HydrophobicContact CG-CB 4.37Å; Y173-Q196 PolarHBondContact OH-NE2 2.88Å; Y173-Q196 VanDerWaalsContact OH-NE2 3.11Å; Y173-A200 WeakPolarHBondContact O-CB 3.47Å
174	V	98.9	Very high	98.6	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.5	-179.5	179.8	0	0	0	0	108.2	I151 I152 F154 P176 D201 F203 V206	I151-V174 HydrophobicContact CG2-CG2 4.22Å; I151-V174 VanDerWaalsContact O-CB 3.26Å; I151-V174 WeakPolarHBondContact O-CB 3.5Å; I151-V174 VanDerWaalsContact O-CG1 3.26Å; I151-V174 WeakPolarHBondContact O-CG1 3.35Å; I152-V174 PolarHBondContact O-N 3.16Å; F154-V174 HydrophobicContact CB-CG2 4.23Å; V174-P176 WeakPolarHBondContact O-CD 3.49Å; V174-D201 WeakPolarHBondContact CA-O 3.38Å; V174-F203 HydrophobicContact CG1-CB 3.75Å; V174-F203 HydrophobicContact CG1-CD2 4.45Å; V174-V206 HydrophobicContact CG2-CB 4.01Å; V174-V206 HydrophobicContact CG2-CG1 3.91Å; V174-V206 HydrophobicContact CG2-CG2 3.97Å
175	R	98.9	Very high	98.6	Very high	88 Å²	88	67.8 Å²	67.8	33%	0.332	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	118	175.2	-174.6	168.1	62.4	-118.3	-12.4	109.9	V197 D198 A200 D201	R175-V197 WeakPolarHBondContact CA-O 3.47Å; R175-V197 WeakPolarHBondContact CB-O 3.48Å; R175-V197 VanDerWaalsContact CG-O 3.23Å; R175-V197 WeakPolarHBondContact CG-O 3.33Å; R175-D198 PolarHBondContact NH1-O 3.13Å; R175-A200 HydrophobicContact CB-CB 4.18Å; R175-A200 PolarHBondContact NH1-O 2.9Å; R175-D201 PolarHBondContact N-O 2.94Å
176	P	98.8	Very high	98.6	Very high	3 Å²	3	61.7 Å²	61.7	2%	0.019	31%	0.305	C	S	.	.			trans	-69.7	148.7	170.8	27.4	-27.9	0	0	0	110.5	T138 E150 I152 V174 L182	T138-P176 HydrophobicContact CG2-CB 4.06Å; T138-P176 HydrophobicContact CG2-CG 4.15Å; E150-P176 HydrophobicContact CB-CB 3.87Å; E150-P176 HydrophobicContact CG-CB 4.39Å; E150-P176 WeakPolarHBondContact OE2-CB 3.3Å; I152-P176 HydrophobicContact CG2-CB 4.34Å; I152-P176 HydrophobicContact CG2-CG 3.98Å; V174-P176 WeakPolarHBondContact O-CD 3.49Å; P176-L182 HydrophobicContact CG-CD2 4.5Å
177	E	98.6	Very high	98.6	Very high	108 Å²	108	60.8 Å²	60.8	51%	0.505	30%	0.301	S	S	.	.	S	Bend	trans	-117.9	-16.4	-175.8	-63.7	-175	124.7	0	0	113.2	E150 T202	E150-E177 PolarHBondContact OE1-N 3.04Å; E177-T202 WeakPolarHBondContact OE1-CG2 3.33Å
178	I	98.1	Very high	98.6	Very high	103 Å²	103	60.8 Å²	60.8	53%	0.528	31%	0.311	S	S	.	.	S	Bend	trans	-95.5	-58.1	176.3	-48.7	-59.9	0	0	0	110	E150 L245	E150-I178 PolarHBondContact OE1-N 2.85Å; E150-I178 VanDerWaalsContact OE1-N 3.09Å; E150-I178 WeakPolarHBondContact OE2-CA 3.42Å; E150-I178 VanDerWaalsContact OE2-CB 3.32Å; E150-I178 WeakPolarHBondContact OE2-CB 3.22Å; E150-I178 PolarHBondContact OE2-N 2.91Å; I178-L245 HydrophobicContact CG1-CD1 4.45Å; I178-L245 HydrophobicContact CG1-CD2 4.29Å
179	N	97.5	Very high	98.6	Very high	50 Å²	50	61.4 Å²	61.4	27%	0.267	31%	0.314	S	S	.	.	S	Bend	trans	-107	70.9	179.3	-66.4	28.7	0	0	0	108.3	F147 E150 Q181	F147-N179 VanDerWaalsContact CE2-ND2 3.29Å; F147-N179 WeakPolarHBondContact CE2-ND2 3.01Å; F147-N179 WeakPolarHBondContact CZ-ND2 3.49Å; E150-N179 PolarHBondContact OE2-N 3.01Å; N179-Q181 VanDerWaalsContact C-N 3.27Å; N179-Q181 PolarHBondContact O-N 3.04Å
180	T	98.4	Very high	98.5	Very high	64 Å²	64	58.8 Å²	58.8	39%	0.393	30%	0.298	S	S	.	.			trans	-63.7	-31.2	-170.5	64.9	0	0	0	0	113.4	Q194	T180-Q194 PolarHBondContact O-NE2 3.16Å
181	Q	98.7	Very high	98.5	Very high	130 Å²	130	58.9 Å²	58.9	61%	0.607	31%	0.307	S	S	*	.	S	Bend	trans	-88.9	120.5	176.7	-56.7	-51.2	110.2	0	0	110	N179	N179-Q181 VanDerWaalsContact C-N 3.27Å; N179-Q181 PolarHBondContact O-N 3.04Å
182	L	98.8	Very high	98.5	Very high	15 Å²	15	55.9 Å²	55.9	8%	0.079	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-69	138.7	172.9	-55.9	-176.8	0	0	0	109.8	T138 I152 P176 I187 I192 V197	T138-L182 HydrophobicContact CG2-CD2 3.87Å; I152-L182 HydrophobicContact CD1-CD2 4.06Å; I152-L182 HydrophobicContact CG2-CD2 4.18Å; P176-L182 HydrophobicContact CG-CD2 4.5Å; L182-I187 HydrophobicContact CB-CD1 4.05Å; L182-I187 HydrophobicContact CB-CG1 3.72Å; L182-I187 HydrophobicContact CD1-CG1 4.15Å; L182-I192 HydrophobicContact CD1-CG2 4.28Å; L182-V197 HydrophobicContact CD1-CG1 4.02Å; L182-V197 HydrophobicContact CD1-CG2 3.83Å; L182-V197 HydrophobicContact CD2-CG2 4.33Å; L182-V197 HydrophobicContact CG-CG2 3.92Å
183	S	98.6	Very high	98.5	Very high	34 Å²	34	55.9 Å²	55.9	24%	0.238	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-69.7	154.4	171.6	73.9	0	0	0	0	110.8	C139 F185 C186 I187	C139-S183 PolarHBondContact O-OG 2.84Å; S183-F185 PolarHBondContact O-N 3.33Å; S183-C186 WeakPolarHBondContact O-CB 3.49Å; S183-C186 PolarHBondContact O-N 3.05Å; S183-C186 VanDerWaalsContact OG-CB 3.31Å; S183-C186 WeakPolarHBondContact OG-CB 3.3Å; S183-C186 PolarHBondContact OG-N 3.26Å; S183-I187 WeakPolarHBondContact O-CG1 3.41Å; S183-I187 PolarHBondContact O-N 3.33Å
184	D	98.4	Very high	98.5	Very high	142 Å²	142	54.7 Å²	54.7	76%	0.759	29%	0.294	S	S	*	.	H	α-helix	trans	-56.9	-37.2	174.4	-66.4	-31.9	0	0	0	111.7	I187 S188	D184-I187 PolarHBondContact O-N 3.44Å; D184-S188 VanDerWaalsContact O-CB 3.31Å; D184-S188 WeakPolarHBondContact O-CB 3.39Å; D184-S188 PolarHBondContact O-N 2.89Å
185	F	98.5	Very high	98.5	Very high	78 Å²	78	58.7 Å²	58.7	34%	0.342	32%	0.316	S	S	.	.	H	α-helix	trans	-61.5	-46.5	174.5	176.9	-95.9	0	0	0	111.6	E141 S183 S188 L189	E141-F185 HydrophobicContact CB-CB 4.1Å; E141-F185 HydrophobicContact CB-CD2 3.98Å; E141-F185 HydrophobicContact CB-CG 3.96Å; E141-F185 HydrophobicContact CG-CD2 4.12Å; E141-F185 HydrophobicContact CG-CE2 4.49Å; S183-F185 PolarHBondContact O-N 3.33Å; F185-S188 PolarHBondContact O-N 2.97Å; F185-L189 HydrophobicContact CE1-CD2 3.84Å; F185-L189 HydrophobicContact CZ-CD2 4.1Å; F185-L189 WeakPolarHBondContact O-CB 3.47Å; F185-L189 PolarHBondContact O-N 3.39Å
186	C	98.6	Very high	98.5	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.007	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-44.3	179.2	-177.9	0	0	0	0	111.7	C139 S183 L189 T190	C139-C186 WeakPolarHBondContact O-CB 3.44Å; S183-C186 WeakPolarHBondContact O-CB 3.49Å; S183-C186 PolarHBondContact O-N 3.05Å; S183-C186 VanDerWaalsContact OG-CB 3.31Å; S183-C186 WeakPolarHBondContact OG-CB 3.3Å; S183-C186 PolarHBondContact OG-N 3.26Å; C186-L189 PolarHBondContact O-N 3.46Å; C186-T190 WeakPolarHBondContact O-CB 3.24Å; C186-T190 WeakPolarHBondContact O-CG2 3.3Å; C186-T190 PolarHBondContact O-N 3.36Å; C186-T190 PolarHBondContact O-OG1 3.28Å
187	I	98.5	Very high	98.5	Very high	52 Å²	52	56.7 Å²	56.7	27%	0.267	31%	0.309	S	S	.	.	H	α-helix	trans	-62.9	-46.4	176.7	-63.1	169.8	0	0	0	110.1	L182 S183 D184 L189 G191	L182-I187 HydrophobicContact CB-CD1 4.05Å; L182-I187 HydrophobicContact CB-CG1 3.72Å; L182-I187 HydrophobicContact CD1-CG1 4.15Å; S183-I187 WeakPolarHBondContact O-CG1 3.41Å; S183-I187 PolarHBondContact O-N 3.33Å; D184-I187 PolarHBondContact O-N 3.44Å; I187-L189 PolarHBondContact O-N 3.04Å; I187-G191 WeakPolarHBondContact O-CA 3.23Å; I187-G191 PolarHBondContact O-N 3.16Å
188	S	98.3	Very high	98.5	Very high	93 Å²	93	55.1 Å²	55.1	65%	0.65	31%	0.305	S	S	*	.	H	α-helix	trans	-63.8	-41.4	178.7	-176.1	0	0	0	0	112.1	D184 F185 R291	D184-S188 VanDerWaalsContact O-CB 3.31Å; D184-S188 WeakPolarHBondContact O-CB 3.39Å; D184-S188 PolarHBondContact O-N 2.89Å; F185-S188 PolarHBondContact O-N 2.97Å; S188-R291 PolarHBondContact O-NH2 3.5Å
189	L	98	Very high	98.5	Very high	55 Å²	55	58.4 Å²	58.4	29%	0.288	31%	0.31	S	S	.	.	H	α-helix	trans	-68.1	-59.1	-179.2	-177.1	67	0	0	0	110.2	F185 C186 I187 R291 H293	F185-L189 HydrophobicContact CE1-CD2 3.84Å; F185-L189 HydrophobicContact CZ-CD2 4.1Å; F185-L189 WeakPolarHBondContact O-CB 3.47Å; F185-L189 PolarHBondContact O-N 3.39Å; C186-L189 PolarHBondContact O-N 3.46Å; I187-L189 PolarHBondContact O-N 3.04Å; L189-R291 PolarHBondContact O-NH1 3.34Å; L189-R291 PolarHBondContact O-NH2 3.11Å; L189-H293 HydrophobicContact CD1-CB 4.47Å; L189-H293 VanDerWaalsContact CD1-CD2 3.45Å; L189-H293 WeakPolarHBondContact CD1-CD2 3.17Å; L189-H293 HydrophobicContact CG-CB 4.25Å; L189-H293 WeakPolarHBondContact O-CB 3.39Å
190	T	98.3	Very high	98.6	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.018	30%	0.302	C	S	.	.	H	α-helix	trans	-83.5	-23	-170.6	66.7	0	0	0	0	113.9	E136 C186 I192 R291 H293	E136-T190 HydrophobicContact CB-CG2 4.3Å; E136-T190 HydrophobicContact CG-CG2 4.47Å; C186-T190 WeakPolarHBondContact O-CB 3.24Å; C186-T190 WeakPolarHBondContact O-CG2 3.3Å; C186-T190 PolarHBondContact O-N 3.36Å; C186-T190 PolarHBondContact O-OG1 3.28Å; T190-I192 PolarHBondContact O-N 3.02Å; T190-I192 WeakPolarHBondContact OG1-CB 3.32Å; T190-I192 PolarHBondContact OG1-N 2.89Å; T190-R291 VanDerWaalsContact C-CZ 3.45Å; T190-R291 PolarHBondContact O-NH1 3.45Å; T190-H293 CarbonylContact C-O 3.51Å; T190-H293 WeakPolarHBondContact CA-O 3.48Å; T190-H293 VanDerWaalsContact O-O 3.11Å
191	G	98.4	Very high	98.6	Very high	32 Å²	32	55.7 Å²	55.7	33%	0.33	30%	0.295	S	S	.	.			trans	74.5	1.6	-173.4	0	0	0	0	0	113.6	I187 R291	I187-G191 WeakPolarHBondContact O-CA 3.23Å; I187-G191 PolarHBondContact O-N 3.16Å; G191-R291 VanDerWaalsContact CA-CZ 3.4Å; G191-R291 VanDerWaalsContact CA-NH2 3.3Å; G191-R291 VanDerWaalsContact N-CZ 3.32Å
192	I	98.8	Very high	98.6	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.01	27%	0.272	C	S	.	.			trans	-78.5	124.5	176.4	-56	172.5	0	0	0	108	E136 I152 E153 Y173 L182 T190 Q196 V197	E136-I192 HydrophobicContact CB-CD1 3.89Å; E136-I192 HydrophobicContact CG-CD1 4.31Å; I152-I192 HydrophobicContact CD1-CD1 3.93Å; I152-I192 HydrophobicContact CG1-CD1 3.89Å; E153-I192 HydrophobicContact CB-CD1 3.85Å; Y173-I192 HydrophobicContact CD1-CD1 4.17Å; Y173-I192 HydrophobicContact CD1-CG1 4.33Å; Y173-I192 HydrophobicContact CD1-CG2 4.04Å; Y173-I192 HydrophobicContact CE1-CD1 4.03Å; Y173-I192 HydrophobicContact CE1-CG1 3.85Å; Y173-I192 HydrophobicContact CE1-CG2 4.18Å; L182-I192 HydrophobicContact CD1-CG2 4.28Å; T190-I192 PolarHBondContact O-N 3.02Å; T190-I192 WeakPolarHBondContact OG1-CB 3.32Å; T190-I192 PolarHBondContact OG1-N 2.89Å; I192-Q196 HydrophobicContact CG2-CB 4.25Å; I192-V197 HydrophobicContact CG2-CG1 3.75Å
193	T	98.8	Very high	98.6	Very high	60 Å²	60	49.8 Å²	49.8	37%	0.368	27%	0.268	S	S	.	.			trans	-86.7	155.7	179.7	63.6	0	0	0	0	111.3	D195 Q196 V197	T193-D195 VanDerWaalsContact C-N 3.26Å; T193-D195 PolarHBondContact O-N 3.21Å; T193-Q196 WeakPolarHBondContact O-CB 3.33Å; T193-Q196 PolarHBondContact O-N 2.95Å; T193-Q196 VanDerWaalsContact O-N 3.13Å; T193-Q196 WeakPolarHBondContact OG1-CG 3.29Å; T193-Q196 PolarHBondContact OG1-N 2.68Å; T193-Q196 PolarHBondContact OG1-OE1 3.41Å; T193-V197 PolarHBondContact O-N 3.25Å
194	Q	98.8	Very high	98.6	Very high	35 Å²	35	49.1 Å²	49.1	16%	0.164	26%	0.263	C	S	.	.	H	α-helix	trans	-55.6	-43.2	175.5	-172.6	61.6	50.1	0	0	112	T180 Q196 V197 D198	T180-Q194 PolarHBondContact O-NE2 3.16Å; Q194-Q196 VanDerWaalsContact C-N 3.26Å; Q194-Q196 PolarHBondContact O-N 2.82Å; Q194-V197 WeakPolarHBondContact O-CG2 3.32Å; Q194-V197 PolarHBondContact O-N 3.12Å; Q194-V197 VanDerWaalsContact O-N 3.11Å; Q194-D198 PolarHBondContact NE2-OD1 2.81Å; Q194-D198 PolarHBondContact O-N 3.19Å
195	D	98.8	Very high	98.6	Very high	85 Å²	85	46.8 Å²	46.8	46%	0.455	25%	0.248	S	C	.	.	H	α-helix	trans	-63.8	-28.9	-179.3	-179.7	41.1	0	0	0	113	T193 R199	T193-D195 VanDerWaalsContact C-N 3.26Å; T193-D195 PolarHBondContact O-N 3.21Å; D195-R199 VanDerWaalsContact CG-NE 3.34Å; D195-R199 VanDerWaalsContact CG-NH2 3.29Å; D195-R199 WeakPolarHBondContact O-CG 3.16Å; D195-R199 PolarHBondContact O-N 3.49Å; D195-R199 PolarHBondContact O-NE 3.19Å; D195-R199 IonicContact OD1-CZ 3.61Å; D195-R199 IonicContact OD1-NE 2.81Å; D195-R199 PolarHBondContact OD1-NE 3.02Å; D195-R199 IonicContact OD1-NH2 3.61Å; D195-R199 IonicContact OD2-CZ 3.39Å; D195-R199 IonicContact OD2-NE 3.4Å; D195-R199 PolarHBondContact OD2-NE 3.44Å; D195-R199 IonicContact OD2-NH2 2.63Å; D195-R199 PolarHBondContact OD2-NH2 3.07Å
196	Q	98.8	Very high	98.7	Very high	48 Å²	48	43 Å²	43	22%	0.224	23%	0.231	C	C	.	.	H	α-helix	trans	-68.1	-43.6	172.6	-75.7	166.8	-68	0	0	112.1	Y173 I192 T193 Q194 A200	Y173-Q196 HydrophobicContact CD2-CB 4.16Å; Y173-Q196 HydrophobicContact CD2-CG 4.43Å; Y173-Q196 HydrophobicContact CE2-CB 4.44Å; Y173-Q196 HydrophobicContact CE2-CG 4.28Å; Y173-Q196 HydrophobicContact CG-CB 4.37Å; Y173-Q196 PolarHBondContact OH-NE2 2.88Å; Y173-Q196 VanDerWaalsContact OH-NE2 3.11Å; I192-Q196 HydrophobicContact CG2-CB 4.25Å; T193-Q196 WeakPolarHBondContact O-CB 3.33Å; T193-Q196 PolarHBondContact O-N 2.95Å; T193-Q196 VanDerWaalsContact O-N 3.13Å; T193-Q196 WeakPolarHBondContact OG1-CG 3.29Å; T193-Q196 PolarHBondContact OG1-N 2.68Å; T193-Q196 PolarHBondContact OG1-OE1 3.41Å; Q194-Q196 VanDerWaalsContact C-N 3.26Å; Q194-Q196 PolarHBondContact O-N 2.82Å; Q196-A200 WeakPolarHBondContact O-CB 3.42Å; Q196-A200 PolarHBondContact O-N 3.35Å
197	V	98.7	Very high	98.7	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-76.3	-31.1	179.4	-63	0	0	0	0	112.3	I152 R175 L182 I192 T193 Q194 R199 A200	I152-V197 HydrophobicContact CB-CG1 4.07Å; I152-V197 HydrophobicContact CG2-CG1 4.29Å; R175-V197 WeakPolarHBondContact CA-O 3.47Å; R175-V197 WeakPolarHBondContact CB-O 3.48Å; R175-V197 VanDerWaalsContact CG-O 3.23Å; R175-V197 WeakPolarHBondContact CG-O 3.33Å; L182-V197 HydrophobicContact CD1-CG1 4.02Å; L182-V197 HydrophobicContact CD1-CG2 3.83Å; L182-V197 HydrophobicContact CD2-CG2 4.33Å; L182-V197 HydrophobicContact CG-CG2 3.92Å; I192-V197 HydrophobicContact CG2-CG1 3.75Å; T193-V197 PolarHBondContact O-N 3.25Å; Q194-V197 WeakPolarHBondContact O-CG2 3.32Å; Q194-V197 PolarHBondContact O-N 3.12Å; Q194-V197 VanDerWaalsContact O-N 3.11Å; V197-R199 VanDerWaalsContact C-N 3.32Å; V197-R199 PolarHBondContact O-N 2.82Å; V197-A200 WeakPolarHBondContact O-CB 3.33Å; V197-A200 PolarHBondContact O-N 3.43Å
198	D	98.7	Very high	98.7	Very high	76 Å²	76	44.7 Å²	44.7	41%	0.406	24%	0.237	S	C	.	.	H	α-helix	trans	-61.3	-42.7	176.3	-70	-14.7	0	0	0	111.4	R175 Q194 A200	R175-D198 PolarHBondContact NH1-O 3.13Å; Q194-D198 PolarHBondContact NE2-OD1 2.81Å; Q194-D198 PolarHBondContact O-N 3.19Å; D198-A200 VanDerWaalsContact C-N 3.34Å
199	R	98.6	Very high	98.7	Very high	171 Å²	171	44.4 Å²	44.4	65%	0.645	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-6.1	-180	-64.8	-173.4	-82.3	122.2	-6.9	113.8	D195 V197	D195-R199 VanDerWaalsContact CG-NE 3.34Å; D195-R199 VanDerWaalsContact CG-NH2 3.29Å; D195-R199 WeakPolarHBondContact O-CG 3.16Å; D195-R199 PolarHBondContact O-N 3.49Å; D195-R199 PolarHBondContact O-NE 3.19Å; D195-R199 IonicContact OD1-CZ 3.61Å; D195-R199 IonicContact OD1-NE 2.81Å; D195-R199 PolarHBondContact OD1-NE 3.02Å; D195-R199 IonicContact OD1-NH2 3.61Å; D195-R199 IonicContact OD2-CZ 3.39Å; D195-R199 IonicContact OD2-NE 3.4Å; D195-R199 PolarHBondContact OD2-NE 3.44Å; D195-R199 IonicContact OD2-NH2 2.63Å; D195-R199 PolarHBondContact OD2-NH2 3.07Å; V197-R199 VanDerWaalsContact C-N 3.32Å; V197-R199 PolarHBondContact O-N 2.82Å
200	A	98.8	Very high	98.7	Very high	10 Å²	10	41.8 Å²	41.8	8%	0.083	21%	0.21	C	C	.	.	S	Bend	trans	-74.8	162	-178.1	0	0	0	0	0	112.9	Y173 R175 Q196 V197 D198	Y173-A200 WeakPolarHBondContact O-CB 3.47Å; R175-A200 HydrophobicContact CB-CB 4.18Å; R175-A200 PolarHBondContact NH1-O 2.9Å; Q196-A200 WeakPolarHBondContact O-CB 3.42Å; Q196-A200 PolarHBondContact O-N 3.35Å; V197-A200 WeakPolarHBondContact O-CB 3.33Å; V197-A200 PolarHBondContact O-N 3.43Å; D198-A200 VanDerWaalsContact C-N 3.34Å
201	D	98.9	Very high	98.8	Very high	48 Å²	48	41.7 Å²	41.7	26%	0.257	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	160.5	170.8	-80.5	-17.8	0	0	0	111.2	V174 R175 Q205 V206 K209	V174-D201 WeakPolarHBondContact CA-O 3.38Å; R175-D201 PolarHBondContact N-O 2.94Å; D201-Q205 HydrophobicContact CB-CB 3.89Å; D201-V206 HydrophobicContact CB-CG2 3.71Å; D201-K209 VanDerWaalsContact OD2-CE 3.28Å; D201-K209 WeakPolarHBondContact OD2-CE 2.99Å; D201-K209 IonicContact OD2-NZ 2.61Å; D201-K209 PolarHBondContact OD2-NZ 3.08Å
202	T	98.9	Very high	98.8	Very high	20 Å²	20	43.2 Å²	43.2	12%	0.123	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	158.1	172	62.9	0	0	0	0	111.2	E177 Q205 V206	E177-T202 WeakPolarHBondContact OE1-CG2 3.33Å; T202-Q205 WeakPolarHBondContact O-CB 3.47Å; T202-Q205 PolarHBondContact O-N 2.9Å; T202-Q205 WeakPolarHBondContact OG1-CG 3.21Å; T202-Q205 PolarHBondContact OG1-OE1 2.8Å; T202-V206 PolarHBondContact O-N 3.08Å
203	F	98.9	Very high	98.8	Very high	1 Å²	1	44.5 Å²	44.5	0%	0.004	22%	0.215	C	C	.	.	H	α-helix	trans	-52.5	-45.3	-179.7	175.3	-99.2	0	0	0	114.4	I151 F154 V174 Q205 V206 L207 L239 Q242 L248	I151-F203 HydrophobicContact CD1-CD2 4.44Å; I151-F203 HydrophobicContact CD1-CE2 3.91Å; F154-F203 HydrophobicContact CD2-CE2 4.05Å; F154-F203 AromaticContact CE2-CE2 3.94Å; F154-F203 HydrophobicContact CE2-CE2 3.94Å; V174-F203 HydrophobicContact CG1-CB 3.75Å; V174-F203 HydrophobicContact CG1-CD2 4.45Å; F203-Q205 VanDerWaalsContact C-N 3.29Å; F203-Q205 PolarHBondContact O-N 3.15Å; F203-V206 PolarHBondContact O-N 3.17Å; F203-L207 HydrophobicContact CE1-CB 4.38Å; F203-L207 HydrophobicContact CE1-CD2 3.95Å; F203-L207 HydrophobicContact CZ-CB 4.27Å; F203-L207 HydrophobicContact CZ-CD2 4.07Å; F203-L207 WeakPolarHBondContact O-CB 3.42Å; F203-L207 PolarHBondContact O-N 3.23Å; F203-L239 HydrophobicContact CE1-CD1 4.5Å; F203-L239 HydrophobicContact CE2-CD1 4.21Å; F203-L239 HydrophobicContact CZ-CD1 3.54Å; F203-Q242 HydrophobicContact CB-CG 3.94Å; F203-Q242 HydrophobicContact CD1-CG 3.5Å; F203-Q242 VanDerWaalsContact CD1-CG 3.5Å; F203-Q242 HydrophobicContact CD2-CG 3.38Å; F203-Q242 HydrophobicContact CE1-CG 3.77Å; F203-Q242 HydrophobicContact CE2-CB 4.47Å; F203-Q242 HydrophobicContact CE2-CG 3.66Å; F203-Q242 HydrophobicContact CG-CG 3.29Å; F203-Q242 HydrophobicContact CZ-CB 4.45Å; F203-Q242 HydrophobicContact CZ-CG 3.85Å; F203-L248 HydrophobicContact CD1-CD1 4.2Å; F203-L248 HydrophobicContact CE1-CD1 4.06Å
204	P	98.8	Very high	98.8	Very high	20 Å²	20	41.7 Å²	41.7	13%	0.13	20%	0.197	C	C	.	.	H	α-helix	trans	-59.3	-37.4	177.3	-26.2	36.1	0	0	0	113.8	K208 L248 M344 F347	P204-K208 WeakPolarHBondContact O-CB 3.34Å; P204-K208 PolarHBondContact O-N 3.39Å; P204-L248 HydrophobicContact CB-CD1 4.16Å; P204-L248 HydrophobicContact CG-CD1 4.07Å; P204-M344 HydrophobicContact CB-CE 4.28Å; P204-M344 VanDerWaalsContact O-CE 3.29Å; P204-M344 WeakPolarHBondContact O-CE 3.15Å; P204-F347 HydrophobicContact CB-CZ 4.4Å
205	Q	98.8	Very high	98.8	Very high	92 Å²	92	45.2 Å²	45.2	43%	0.43	21%	0.212	S	C	.	.	H	α-helix	trans	-69.2	-44.7	178.4	-68	168.8	-60.9	0	0	110.8	D201 T202 F203 K208 K209	D201-Q205 HydrophobicContact CB-CB 3.89Å; T202-Q205 WeakPolarHBondContact O-CB 3.47Å; T202-Q205 PolarHBondContact O-N 2.9Å; T202-Q205 WeakPolarHBondContact OG1-CG 3.21Å; T202-Q205 PolarHBondContact OG1-OE1 2.8Å; F203-Q205 VanDerWaalsContact C-N 3.29Å; F203-Q205 PolarHBondContact O-N 3.15Å; Q205-K208 WeakPolarHBondContact O-CB 3.39Å; Q205-K208 PolarHBondContact O-N 2.93Å; Q205-K209 PolarHBondContact O-N 3.35Å
206	V	98.9	Very high	98.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.1	-44.1	176.9	176.5	0	0	0	0	111.5	F154 Q172 V174 D201 T202 F203 K208 K209 V210	F154-V206 HydrophobicContact CB-CG1 3.85Å; F154-V206 HydrophobicContact CD2-CG1 4.19Å; F154-V206 HydrophobicContact CG-CG1 4.29Å; Q172-V206 HydrophobicContact CB-CG1 3.62Å; Q172-V206 HydrophobicContact CB-CG2 4.28Å; Q172-V206 HydrophobicContact CG-CG1 4.27Å; V174-V206 HydrophobicContact CG2-CB 4.01Å; V174-V206 HydrophobicContact CG2-CG1 3.91Å; V174-V206 HydrophobicContact CG2-CG2 3.97Å; D201-V206 HydrophobicContact CB-CG2 3.71Å; T202-V206 PolarHBondContact O-N 3.08Å; F203-V206 PolarHBondContact O-N 3.17Å; V206-K208 VanDerWaalsContact C-N 3.26Å; V206-K208 PolarHBondContact O-N 2.74Å; V206-K209 WeakPolarHBondContact O-CB 3.43Å; V206-K209 PolarHBondContact O-N 3.22Å; V206-K209 VanDerWaalsContact O-N 3.09Å; V206-V210 HydrophobicContact CG1-CG2 4.46Å; V206-V210 WeakPolarHBondContact O-CG2 3.21Å; V206-V210 PolarHBondContact O-N 3.18Å
207	L	98.9	Very high	98.8	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-58.9	-39.3	175.3	179.2	62.2	0	0	0	111.6	F154 F203 V210 I211 L248 F253 M344 P345	F154-L207 HydrophobicContact CE2-CD1 4.01Å; F154-L207 HydrophobicContact CZ-CD1 4.29Å; F203-L207 HydrophobicContact CE1-CB 4.38Å; F203-L207 HydrophobicContact CE1-CD2 3.95Å; F203-L207 HydrophobicContact CZ-CB 4.27Å; F203-L207 HydrophobicContact CZ-CD2 4.07Å; F203-L207 WeakPolarHBondContact O-CB 3.42Å; F203-L207 PolarHBondContact O-N 3.23Å; L207-V210 PolarHBondContact O-N 2.88Å; L207-I211 HydrophobicContact CD1-CD1 4.02Å; L207-I211 HydrophobicContact CD1-CG1 4.33Å; L207-I211 HydrophobicContact CG-CD1 3.91Å; L207-I211 VanDerWaalsContact O-CG1 3.26Å; L207-I211 WeakPolarHBondContact O-CG1 3.46Å; L207-I211 PolarHBondContact O-N 2.83Å; L207-L248 HydrophobicContact CD2-CD1 4.15Å; L207-F253 HydrophobicContact CD1-CZ 4.46Å; L207-M344 HydrophobicContact CD2-CE 4.35Å; L207-M344 HydrophobicContact CD2-SD 4.3Å; L207-M344 HydrophobicContact CG-SD 4.18Å; L207-P345 HydrophobicContact CD2-CG 3.91Å
208	K	98.8	Very high	98.8	Very high	87 Å²	87	52.1 Å²	52.1	38%	0.378	24%	0.244	S	C	.	.	H	α-helix	trans	-61.4	-46.1	174.4	-178.9	61	168.5	74.5	0	111.5	P204 Q205 V206 I211 D212 M344	P204-K208 WeakPolarHBondContact O-CB 3.34Å; P204-K208 PolarHBondContact O-N 3.39Å; Q205-K208 WeakPolarHBondContact O-CB 3.39Å; Q205-K208 PolarHBondContact O-N 2.93Å; V206-K208 VanDerWaalsContact C-N 3.26Å; V206-K208 PolarHBondContact O-N 2.74Å; K208-I211 PolarHBondContact O-N 3.5Å; K208-D212 IonicContact NZ-OD1 2.71Å; K208-D212 PolarHBondContact NZ-OD1 2.84Å; K208-D212 IonicContact NZ-OD2 3.74Å; K208-D212 PolarHBondContact NZ-OD2 3.33Å; K208-D212 VanDerWaalsContact O-CG 3.23Å; K208-D212 PolarHBondContact O-N 2.86Å; K208-M344 HydrophobicContact CB-CE 4.43Å; K208-M344 HydrophobicContact CB-SD 3.97Å; K208-M344 HydrophobicContact CD-CB 4.14Å; K208-M344 HydrophobicContact CD-CG 4.1Å; K208-M344 HydrophobicContact CD-SD 4.16Å
209	K	98.9	Very high	98.8	Very high	86 Å²	86	48.6 Å²	48.6	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-60.4	-43.1	176.4	-71	173.8	168	177.9	0	112.2	F170 D201 Q205 V206 I211 D212 W213	F170-K209 HydrophobicContact CZ-CB 3.97Å; D201-K209 VanDerWaalsContact OD2-CE 3.28Å; D201-K209 WeakPolarHBondContact OD2-CE 2.99Å; D201-K209 IonicContact OD2-NZ 2.61Å; D201-K209 PolarHBondContact OD2-NZ 3.08Å; Q205-K209 PolarHBondContact O-N 3.35Å; V206-K209 WeakPolarHBondContact O-CB 3.43Å; V206-K209 PolarHBondContact O-N 3.22Å; V206-K209 VanDerWaalsContact O-N 3.09Å; K209-I211 PolarHBondContact O-N 2.94Å; K209-D212 PolarHBondContact O-N 3.39Å; K209-W213 WeakPolarHBondContact O-CB 3.3Å; K209-W213 PolarHBondContact O-N 3.23Å
210	V	98.8	Very high	98.7	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-58.9	-48.2	175	169.5	0	0	0	0	110.7	F154 V156 F170 V206 L207 D212 W213 M214	F154-V210 HydrophobicContact CD1-CG2 3.84Å; F154-V210 HydrophobicContact CD2-CG2 4.25Å; F154-V210 HydrophobicContact CE1-CG1 4.03Å; F154-V210 HydrophobicContact CE1-CG2 3.93Å; F154-V210 HydrophobicContact CE2-CG2 4.33Å; F154-V210 HydrophobicContact CG-CG2 4.02Å; F154-V210 HydrophobicContact CZ-CG1 4.15Å; F154-V210 HydrophobicContact CZ-CG2 4.19Å; V156-V210 HydrophobicContact CG2-CG1 3.96Å; V156-V210 HydrophobicContact CG2-CG2 4.38Å; F170-V210 HydrophobicContact CD1-CG2 3.96Å; F170-V210 HydrophobicContact CE1-CG2 3.44Å; F170-V210 VanDerWaalsContact CE1-CG2 3.44Å; F170-V210 HydrophobicContact CZ-CG2 4.13Å; V206-V210 HydrophobicContact CG1-CG2 4.46Å; V206-V210 WeakPolarHBondContact O-CG2 3.21Å; V206-V210 PolarHBondContact O-N 3.18Å; L207-V210 PolarHBondContact O-N 2.88Å; V210-D212 VanDerWaalsContact C-N 3.35Å; V210-D212 PolarHBondContact O-N 3.26Å; V210-W213 PolarHBondContact O-N 3.1Å; V210-M214 HydrophobicContact CG1-CG 4.41Å; V210-M214 HydrophobicContact CG1-SD 4.09Å; V210-M214 VanDerWaalsContact O-CG 3.3Å; V210-M214 WeakPolarHBondContact O-CG 3.41Å; V210-M214 PolarHBondContact O-N 3.15Å
211	I	98.8	Very high	98.6	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-64.5	-40.6	-179.3	-69.8	167.3	0	0	0	111.4	L207 K208 K209 M214 K215 F253 P342 M344	L207-I211 HydrophobicContact CD1-CD1 4.02Å; L207-I211 HydrophobicContact CD1-CG1 4.33Å; L207-I211 HydrophobicContact CG-CD1 3.91Å; L207-I211 VanDerWaalsContact O-CG1 3.26Å; L207-I211 WeakPolarHBondContact O-CG1 3.46Å; L207-I211 PolarHBondContact O-N 2.83Å; K208-I211 PolarHBondContact O-N 3.5Å; K209-I211 PolarHBondContact O-N 2.94Å; I211-M214 PolarHBondContact O-N 3.29Å; I211-K215 HydrophobicContact CG2-CD 4.27Å; I211-K215 WeakPolarHBondContact O-CB 3.49Å; I211-K215 VanDerWaalsContact O-CG 3.31Å; I211-K215 WeakPolarHBondContact O-CG 3.34Å; I211-K215 PolarHBondContact O-N 3.42Å; I211-F253 HydrophobicContact CD1-CE1 3.9Å; I211-F253 HydrophobicContact CD1-CZ 4.33Å; I211-F253 HydrophobicContact CG1-CE1 3.96Å; I211-F253 HydrophobicContact CG1-CZ 4.05Å; I211-P342 HydrophobicContact CG1-CB 4.31Å; I211-P342 HydrophobicContact CG2-CB 4.13Å; I211-M344 HydrophobicContact CD1-CB 4.3Å; I211-M344 HydrophobicContact CD1-SD 3.96Å
212	D	98.8	Very high	98.5	Very high	64 Å²	64	49.5 Å²	49.5	34%	0.342	25%	0.246	S	C	.	.	H	α-helix	trans	-64.8	-42	176.7	-68.2	-21.6	0	0	0	111.5	K208 K209 V210 K215 L216	K208-D212 IonicContact NZ-OD1 2.71Å; K208-D212 PolarHBondContact NZ-OD1 2.84Å; K208-D212 IonicContact NZ-OD2 3.74Å; K208-D212 PolarHBondContact NZ-OD2 3.33Å; K208-D212 VanDerWaalsContact O-CG 3.23Å; K208-D212 PolarHBondContact O-N 2.86Å; K209-D212 PolarHBondContact O-N 3.39Å; V210-D212 VanDerWaalsContact C-N 3.35Å; V210-D212 PolarHBondContact O-N 3.26Å; D212-K215 PolarHBondContact O-N 3.04Å; D212-L216 PolarHBondContact O-N 3.08Å
213	W	98.8	Very high	98.5	Very high	29 Å²	29	51.9 Å²	51.9	11%	0.11	25%	0.253	C	S	.	.	H	α-helix	trans	-60.6	-45.3	172.8	176	91.8	0	0	0	111.4	V156 L158 D168 F170 K209 V210 K215 L216 K217	V156-W213 HydrophobicContact CB-CH2 4.3Å; V156-W213 HydrophobicContact CB-CZ3 4.13Å; V156-W213 HydrophobicContact CG1-CH2 3.92Å; V156-W213 HydrophobicContact CG1-CZ3 3.64Å; L158-W213 HydrophobicContact CB-CH2 3.87Å; L158-W213 HydrophobicContact CB-CZ2 4.35Å; L158-W213 HydrophobicContact CD2-CH2 4.45Å; D168-W213 HydrophobicContact CB-CZ2 3.79Å; D168-W213 PolarHBondContact OD2-NE1 3.22Å; F170-W213 HydrophobicContact CB-CD2 4.17Å; F170-W213 HydrophobicContact CB-CG 4.48Å; F170-W213 HydrophobicContact CB-CZ2 4.19Å; F170-W213 HydrophobicContact CD2-CB 4.19Å; F170-W213 AromaticContact CD2-CD1 3.92Å; F170-W213 HydrophobicContact CD2-CD2 4.46Å; F170-W213 AromaticContact CD2-CG 3.93Å; F170-W213 HydrophobicContact CD2-CG 3.93Å; F170-W213 HydrophobicContact CE2-CB 4.38Å; F170-W213 HydrophobicContact CG-CG 4.45Å; K209-W213 WeakPolarHBondContact O-CB 3.3Å; K209-W213 PolarHBondContact O-N 3.23Å; V210-W213 PolarHBondContact O-N 3.1Å; W213-K215 VanDerWaalsContact C-N 3.32Å; W213-K215 PolarHBondContact O-N 2.89Å; W213-L216 WeakPolarHBondContact O-CB 3.45Å; W213-L216 PolarHBondContact O-N 2.98Å; W213-K217 WeakPolarHBondContact O-CG 3.42Å; W213-K217 PolarHBondContact O-N 2.7Å
214	M	98.8	Very high	98.5	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-36.3	176.9	-68.2	176.5	76.3	0	0	112.6	V210 I211 K217 E218 L219 Y225 F253 P342	V210-M214 HydrophobicContact CG1-CG 4.41Å; V210-M214 HydrophobicContact CG1-SD 4.09Å; V210-M214 VanDerWaalsContact O-CG 3.3Å; V210-M214 WeakPolarHBondContact O-CG 3.41Å; V210-M214 PolarHBondContact O-N 3.15Å; I211-M214 PolarHBondContact O-N 3.29Å; M214-K217 PolarHBondContact O-N 3.05Å; M214-E218 PolarHBondContact O-N 2.9Å; M214-L219 HydrophobicContact CB-CD1 4.03Å; M214-L219 HydrophobicContact CE-CD1 4.05Å; M214-L219 HydrophobicContact CG-CD1 4.15Å; M214-L219 PolarHBondContact O-N 2.87Å; M214-Y225 HydrophobicContact CE-CD2 4.25Å; M214-Y225 HydrophobicContact CE-CE2 3.4Å; M214-Y225 VanDerWaalsContact CE-CE2 3.4Å; M214-F253 HydrophobicContact CE-CD2 4.34Å; M214-F253 HydrophobicContact CE-CE2 4.32Å; M214-F253 HydrophobicContact SD-CE2 4.11Å; M214-P342 HydrophobicContact CB-CB 4.48Å; M214-P342 HydrophobicContact CB-CG 3.63Å; M214-P342 HydrophobicContact CE-CB 4.21Å; M214-P342 HydrophobicContact CE-CG 4.09Å; M214-P342 HydrophobicContact SD-CB 4.1Å; M214-P342 HydrophobicContact SD-CG 4.16Å
215	K	98.6	Very high	98.5	Very high	109 Å²	109	53.5 Å²	53.5	47%	0.474	26%	0.258	S	S	.	.	H	α-helix	trans	-67.2	-38.2	174.9	-77	177.1	177.3	-174.7	0	112.2	I211 D212 W213 K217 E218 P342	I211-K215 HydrophobicContact CG2-CD 4.27Å; I211-K215 WeakPolarHBondContact O-CB 3.49Å; I211-K215 VanDerWaalsContact O-CG 3.31Å; I211-K215 WeakPolarHBondContact O-CG 3.34Å; I211-K215 PolarHBondContact O-N 3.42Å; D212-K215 PolarHBondContact O-N 3.04Å; W213-K215 VanDerWaalsContact C-N 3.32Å; W213-K215 PolarHBondContact O-N 2.89Å; K215-K217 PolarHBondContact O-N 3.08Å; K215-E218 WeakPolarHBondContact O-CA 3.39Å; K215-E218 PolarHBondContact O-N 3.36Å; K215-P342 WeakPolarHBondContact CE-O 3.27Å; K215-P342 HydrophobicContact CG-CG 4.35Å
216	L	98.6	Very high	98.5	Very high	134 Å²	134	49.1 Å²	49.1	70%	0.702	24%	0.238	S	C	*	.	H	α-helix	trans	-60.3	-29.1	174.9	-175.6	65.1	0	0	0	111.6	D212 W213 E218	D212-L216 PolarHBondContact O-N 3.08Å; W213-L216 WeakPolarHBondContact O-CB 3.45Å; W213-L216 PolarHBondContact O-N 2.98Å; L216-E218 VanDerWaalsContact C-N 3.3Å
217	K	98.6	Very high	98.5	Very high	64 Å²	64	49.2 Å²	49.2	28%	0.278	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	6.8	173.7	-53.6	-58.8	178.9	170.7	0	113.9	L158 D168 W213 M214 K215 L219 Y223	L158-K217 HydrophobicContact CD2-CB 4.26Å; L158-K217 HydrophobicContact CD2-CD 4.28Å; L158-K217 HydrophobicContact CD2-CG 3.99Å; D168-K217 WeakPolarHBondContact OD2-CE 3.4Å; D168-K217 IonicContact OD2-NZ 2.61Å; D168-K217 PolarHBondContact OD2-NZ 2.96Å; W213-K217 WeakPolarHBondContact O-CG 3.42Å; W213-K217 PolarHBondContact O-N 2.7Å; M214-K217 PolarHBondContact O-N 3.05Å; K215-K217 PolarHBondContact O-N 3.08Å; K217-L219 HydrophobicContact CB-CD1 4.43Å; K217-L219 HydrophobicContact CB-CD2 4.34Å; K217-L219 HydrophobicContact CB-CG 3.96Å; K217-L219 PolarHBondContact O-N 2.95Å; K217-Y223 WeakPolarHBondContact O-CD2 3.4Å
218	E	98.4	Very high	98.5	Very high	81 Å²	81	49.1 Å²	49.1	38%	0.379	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	30.5	177.1	-48.3	-175.5	79.9	0	0	114.3	M214 K215 L216 G220 T221 K222 Y223	M214-E218 PolarHBondContact O-N 2.9Å; K215-E218 WeakPolarHBondContact O-CA 3.39Å; K215-E218 PolarHBondContact O-N 3.36Å; L216-E218 VanDerWaalsContact C-N 3.3Å; E218-G220 PolarHBondContact O-N 3.04Å; E218-T221 PolarHBondContact O-N 2.76Å; E218-T221 PolarHBondContact O-OG1 3.21Å; E218-T221 VanDerWaalsContact O-OG1 3.07Å; E218-K222 HydrophobicContact CB-CB 3.68Å; E218-K222 HydrophobicContact CB-CD 4.32Å; E218-K222 VanDerWaalsContact CD-CD 3.42Å; E218-K222 HydrophobicContact CG-CD 4.5Å; E218-K222 PolarHBondContact O-N 2.88Å; E218-K222 WeakPolarHBondContact OE1-CD 3.08Å; E218-K222 WeakPolarHBondContact OE2-CD 3.26Å; E218-K222 IonicContact OE2-NZ 2.77Å; E218-K222 PolarHBondContact OE2-NZ 3.21Å; E218-Y223 HydrophobicContact CB-CD2 4.15Å; E218-Y223 HydrophobicContact CB-CE2 4.34Å; E218-Y223 PolarHBondContact O-N 2.84Å
219	L	98.6	Very high	98.5	Very high	2 Å²	2	45 Å²	45	1%	0.01	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-72	124.6	-176.9	-60.3	-178.8	0	0	0	112	Y129 C131 L158 M214 K217 T221 Y225 P342	Y129-L219 HydrophobicContact CD2-CD2 3.92Å; Y129-L219 HydrophobicContact CG-CD2 4.05Å; C131-L219 WeakPolarHBondContact SG-CD1 3.13Å; L158-L219 HydrophobicContact CD1-CD1 4.08Å; L158-L219 HydrophobicContact CD1-CD2 4.25Å; M214-L219 HydrophobicContact CB-CD1 4.03Å; M214-L219 HydrophobicContact CE-CD1 4.05Å; M214-L219 HydrophobicContact CG-CD1 4.15Å; M214-L219 PolarHBondContact O-N 2.87Å; K217-L219 HydrophobicContact CB-CD1 4.43Å; K217-L219 HydrophobicContact CB-CD2 4.34Å; K217-L219 HydrophobicContact CB-CG 3.96Å; K217-L219 PolarHBondContact O-N 2.95Å; L219-T221 PolarHBondContact O-N 3.2Å; L219-Y225 HydrophobicContact CB-CD1 3.8Å; L219-Y225 HydrophobicContact CB-CD2 4.42Å; L219-Y225 HydrophobicContact CB-CE1 4.01Å; L219-Y225 HydrophobicContact CB-CG 4.01Å; L219-Y225 HydrophobicContact CD1-CD2 4.38Å; L219-Y225 HydrophobicContact CD2-CG 4.46Å; L219-P342 VanDerWaalsContact O-CD 3.25Å; L219-P342 WeakPolarHBondContact O-CD 3.42Å
220	G	97.4	Very high	98.5	Very high	25 Å²	25	41.6 Å²	41.6	26%	0.258	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.1	-10.5	-178.3	0	0	0	0	0	114	E218 Y223 Y225 P341	E218-G220 PolarHBondContact O-N 3.04Å; G220-Y223 WeakPolarHBondContact CA-O 3.33Å; G220-Y223 PolarHBondContact N-O 2.76Å; G220-Y225 VanDerWaalsContact N-CD1 3.33Å; G220-P341 WeakPolarHBondContact O-CG 3.33Å
221	T	97.1	Very high	98.4	Very high	104 Å²	104	41.9 Å²	41.9	64%	0.638	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-62.2	173.7	51.6	0	0	0	0	110.9	E218 L219 P341	E218-T221 PolarHBondContact O-N 2.76Å; E218-T221 PolarHBondContact O-OG1 3.21Å; E218-T221 VanDerWaalsContact O-OG1 3.07Å; L219-T221 PolarHBondContact O-N 3.2Å; T221-P341 HydrophobicContact CG2-CB 4.09Å; T221-P341 HydrophobicContact CG2-CG 3.92Å
222	K	97.4	Very high	98.4	Very high	119 Å²	119	42.4 Å²	42.4	52%	0.517	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-42	178.6	-177.9	179.4	172.6	-175.3	0	111.5	E218	E218-K222 HydrophobicContact CB-CB 3.68Å; E218-K222 HydrophobicContact CB-CD 4.32Å; E218-K222 VanDerWaalsContact CD-CD 3.42Å; E218-K222 HydrophobicContact CG-CD 4.5Å; E218-K222 PolarHBondContact O-N 2.88Å; E218-K222 WeakPolarHBondContact OE1-CD 3.08Å; E218-K222 WeakPolarHBondContact OE2-CD 3.26Å; E218-K222 IonicContact OE2-NZ 2.77Å; E218-K222 PolarHBondContact OE2-NZ 3.21Å
223	Y	97.9	Very high	98.3	Very high	70 Å²	70	45.8 Å²	45.8	28%	0.275	22%	0.22	S	C	.	.	B	Isolated β-bridge	trans	-110.4	134.3	-176	-57.5	-67.4	0	0	0	111.8	D128 Y129 K217 E218 G220	D128-Y223 HydrophobicContact CB-CD1 4.19Å; D128-Y223 WeakPolarHBondContact OD2-CA 3.28Å; Y129-Y223 HydrophobicContact CD2-CD1 4.46Å; Y129-Y223 HydrophobicContact CD2-CD2 4.3Å; Y129-Y223 AromaticContact CD2-CG 3.92Å; Y129-Y223 HydrophobicContact CD2-CG 3.92Å; Y129-Y223 AromaticContact CE2-CD1 3.96Å; Y129-Y223 HydrophobicContact CE2-CD1 3.96Å; Y129-Y223 AromaticContact CE2-CD2 3.79Å; Y129-Y223 HydrophobicContact CE2-CD2 3.79Å; Y129-Y223 HydrophobicContact CE2-CE1 4.38Å; Y129-Y223 HydrophobicContact CE2-CE2 4.21Å; Y129-Y223 AromaticContact CE2-CG 3.64Å; Y129-Y223 HydrophobicContact CE2-CG 3.64Å; K217-Y223 WeakPolarHBondContact O-CD2 3.4Å; E218-Y223 HydrophobicContact CB-CD2 4.15Å; E218-Y223 HydrophobicContact CB-CE2 4.34Å; E218-Y223 PolarHBondContact O-N 2.84Å; G220-Y223 WeakPolarHBondContact CA-O 3.33Å; G220-Y223 PolarHBondContact N-O 2.76Å
224	K	98.1	Very high	98.3	Very high	55 Å²	55	44.6 Å²	44.6	24%	0.239	22%	0.217	C	C	.	.			trans	-74.9	129.6	173.5	-165.2	-179.5	-176.2	172.9	0	108.9	S125 Y127 D128 Y129 I336	S125-K224 PolarHBondContact O-NZ 2.78Å; Y127-K224 CarbonylContact C-O 3.58Å; Y127-K224 HydrophobicContact CD1-CD 4.45Å; Y127-K224 HydrophobicContact CD1-CG 4.13Å; D128-K224 PolarHBondContact N-O 2.56Å; D128-K224 PolarHBondContact OD2-N 2.91Å; Y129-K224 PolarHBondContact N-O 3.32Å; Y129-K224 VanDerWaalsContact N-O 3.15Å; K224-I336 PolarHBondContact NZ-O 3.3Å
225	Y	98.8	Very high	98.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	166.4	-178.2	82.9	-72	0	0	0	113.3	Y129 M214 L219 G220 I227 T339 P340	Y129-Y225 WeakPolarHBondContact O-CA 3.42Å; Y129-Y225 WeakPolarHBondContact O-CB 3.37Å; M214-Y225 HydrophobicContact CE-CD2 4.25Å; M214-Y225 HydrophobicContact CE-CE2 3.4Å; M214-Y225 VanDerWaalsContact CE-CE2 3.4Å; L219-Y225 HydrophobicContact CB-CD1 3.8Å; L219-Y225 HydrophobicContact CB-CD2 4.42Å; L219-Y225 HydrophobicContact CB-CE1 4.01Å; L219-Y225 HydrophobicContact CB-CG 4.01Å; L219-Y225 HydrophobicContact CD1-CD2 4.38Å; L219-Y225 HydrophobicContact CD2-CG 4.46Å; G220-Y225 VanDerWaalsContact N-CD1 3.33Å; Y225-I227 HydrophobicContact CE2-CG1 4.45Å; Y225-T339 HydrophobicContact CE1-CG2 4.01Å; Y225-T339 WeakPolarHBondContact CE1-O 3.45Å; Y225-T339 HydrophobicContact CE2-CG2 3.82Å; Y225-T339 VanDerWaalsContact CZ-CG2 3.43Å; Y225-T339 WeakPolarHBondContact O-CB 3.44Å; Y225-T339 PolarHBondContact O-N 3Å; Y225-T339 PolarHBondContact O-OG1 3.04Å; Y225-T339 WeakPolarHBondContact OH-CG2 3.1Å; Y225-P340 WeakPolarHBondContact CE1-O 3.45Å; Y225-P340 PolarHBondContact OH-O 3.02Å
226	S	98.8	Very high	98.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	151.8	168.2	-177.7	0	0	0	0	111.3	Y129 I130 C131 I258 I318	Y129-S226 PolarHBondContact O-N 2.82Å; Y129-S226 VanDerWaalsContact O-N 3.17Å; I130-S226 WeakPolarHBondContact CA-O 3.13Å; C131-S226 PolarHBondContact N-O 2.93Å; S226-I258 WeakPolarHBondContact OG-CG1 3.23Å; S226-I318 WeakPolarHBondContact OG-CG1 3.38Å
227	I	98.9	Very high	98.2	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	145.2	167.2	-68.4	170	0	0	0	109.5	C131 I133 Y225 T229 M235 F253 A254 W257 I258	C131-I227 HydrophobicContact CB-CG1 4.4Å; C131-I227 CarbonylContact O-C 3.55Å; C131-I227 VanDerWaalsContact O-CA 3.3Å; C131-I227 WeakPolarHBondContact O-CA 3.48Å; I133-I227 HydrophobicContact CD1-CD1 4.39Å; I133-I227 HydrophobicContact CD1-CG1 4.46Å; I133-I227 HydrophobicContact CD1-CG2 4.17Å; Y225-I227 HydrophobicContact CE2-CG1 4.45Å; I227-T229 HydrophobicContact CG2-CG2 4.16Å; I227-M235 HydrophobicContact CG2-CE 3.91Å; I227-F253 HydrophobicContact CD1-CD2 3.75Å; I227-F253 HydrophobicContact CD1-CE2 3.97Å; I227-A254 HydrophobicContact CD1-CB 4.24Å; I227-W257 HydrophobicContact CB-CB 4.14Å; I227-W257 HydrophobicContact CG2-CB 4.01Å; I227-W257 WeakPolarHBondContact O-CA 3.29Å; I227-I258 PolarHBondContact O-N 3Å
228	L	98.9	Very high	98.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	139.3	174.5	-177.7	156.4	0	0	0	110.6	I130 C131 I132 I133 I258 I260 I302 A306 L316	I130-L228 HydrophobicContact CG2-CB 3.49Å; I130-L228 VanDerWaalsContact CG2-CB 3.49Å; I130-L228 HydrophobicContact CG2-CD1 3.91Å; I130-L228 HydrophobicContact CG2-CG 4.31Å; C131-L228 PolarHBondContact O-N 3.16Å; I132-L228 WeakPolarHBondContact CA-O 3.32Å; I132-L228 HydrophobicContact CG1-CB 4.44Å; I132-L228 HydrophobicContact CG1-CD2 4.05Å; I132-L228 HydrophobicContact CG2-CD2 4.2Å; I133-L228 PolarHBondContact N-O 3.48Å; L228-I258 VanDerWaalsContact CA-O 3.27Å; L228-I258 WeakPolarHBondContact CA-O 2.94Å; L228-I258 HydrophobicContact CB-CB 4.02Å; L228-I258 HydrophobicContact CD1-CB 4.16Å; L228-I258 HydrophobicContact CD1-CD1 4.45Å; L228-I258 HydrophobicContact CD1-CG2 3.92Å; L228-I258 HydrophobicContact CG-CB 4Å; L228-I258 HydrophobicContact CG-CG2 4.13Å; L228-I260 HydrophobicContact CD1-CB 4.27Å; L228-I260 HydrophobicContact CD1-CD1 4.15Å; L228-I260 HydrophobicContact CD1-CG1 4.36Å; L228-I260 HydrophobicContact CD2-CB 3.87Å; L228-I260 HydrophobicContact CD2-CD1 4.12Å; L228-I260 HydrophobicContact CD2-CG1 4.49Å; L228-I260 HydrophobicContact CD2-CG2 4.21Å; L228-I260 HydrophobicContact CG-CB 4.16Å; L228-I302 HydrophobicContact CD2-CG2 3.28Å; L228-A306 HydrophobicContact CD1-CB 4.29Å; L228-L316 HydrophobicContact CD1-CD1 4.09Å
229	T	98.9	Very high	98.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	157.4	-177.9	57.7	0	0	0	0	111.7	I133 I227 G231 D234 M235 I258 I260	I133-T229 WeakPolarHBondContact O-CG2 3.41Å; I227-T229 HydrophobicContact CG2-CG2 4.16Å; T229-G231 VanDerWaalsContact C-N 3.26Å; T229-G231 PolarHBondContact O-N 2.88Å; T229-G231 PolarHBondContact OG1-O 3.25Å; T229-D234 HydrophobicContact CG2-CB 3.87Å; T229-M235 HydrophobicContact CG2-CE 3.49Å; T229-M235 VanDerWaalsContact CG2-CE 3.49Å; T229-M235 HydrophobicContact CG2-CG 4.01Å; T229-I258 PolarHBondContact N-O 3.14Å; T229-I260 PolarHBondContact O-N 2.93Å; T229-I260 VanDerWaalsContact O-N 3.08Å
230	D	98.7	Very high	98.2	Very high	14 Å²	14	32.9 Å²	32.9	8%	0.075	16%	0.164	C	C	.	.	S	Bend	trans	-83.9	62.3	175.8	-171.5	32.4	0	0	0	113.4	R261 M280 I302	D230-R261 PolarHBondContact O-NE 3.47Å; D230-R261 WeakPolarHBondContact OD1-CD 3.37Å; D230-R261 WeakPolarHBondContact OD1-CG 3.43Å; D230-R261 IonicContact OD1-CZ 2.79Å; D230-R261 IonicContact OD1-NE 2.68Å; D230-R261 PolarHBondContact OD1-NE 3.16Å; D230-R261 IonicContact OD1-NH2 3.44Å; D230-R261 IonicContact OD2-CZ 3.26Å; D230-R261 VanDerWaalsContact OD2-CZ 3.29Å; D230-R261 IonicContact OD2-NE 3.73Å; D230-R261 PolarHBondContact OD2-NE 3.2Å; D230-R261 VanDerWaalsContact OD2-NE 3.16Å; D230-R261 IonicContact OD2-NH2 2.84Å; D230-R261 PolarHBondContact OD2-NH2 2.71Å; D230-M280 WeakPolarHBondContact OD1-CE 3.4Å; D230-I302 HydrophobicContact CB-CD1 3.52Å; D230-I302 HydrophobicContact CB-CG1 3.95Å
231	G	98	Very high	98.2	Very high	7 Å²	7	33.7 Å²	33.7	7%	0.072	16%	0.162	C	C	.	.	S	Bend	trans	120	-163.9	-175.1	0	0	0	0	0	111.1	T229 N259	T229-G231 VanDerWaalsContact C-N 3.26Å; T229-G231 PolarHBondContact O-N 2.88Å; T229-G231 PolarHBondContact OG1-O 3.25Å; G231-N259 WeakPolarHBondContact CA-OD1 3.48Å
232	S	97.9	Very high	98.3	Very high	13 Å²	13	29 Å²	29	9%	0.091	13%	0.132	C	C	.	.	S	Bend	trans	-102.2	-15.2	-176.2	69.7	0	0	0	0	113.2	D234 S236 E320 L327	S232-D234 PolarHBondContact O-N 3.22Å; S232-S236 VanDerWaalsContact O-CB 3.23Å; S232-S236 WeakPolarHBondContact O-CB 3.23Å; S232-S236 PolarHBondContact O-N 3.49Å; S232-S236 PolarHBondContact O-OG 2.94Å; S232-E320 WeakPolarHBondContact CA-OE2 3.4Å; S232-E320 WeakPolarHBondContact CB-OE2 3.49Å; S232-L327 WeakPolarHBondContact OG-CD2 3.09Å
233	W	98.3	Very high	98.4	Very high	134 Å²	134	23.3 Å²	23.3	51%	0.508	11%	0.108	S	C	.	.	H	α-helix	trans	-69.1	-35.8	-166	-80.1	14.2	0	0	0	113.3	M235 K237 F238	W233-M235 VanDerWaalsContact C-N 3.34Å; W233-M235 PolarHBondContact O-N 3.37Å; W233-K237 HydrophobicContact CB-CB 4.36Å; W233-K237 HydrophobicContact CD2-CD 4.35Å; W233-K237 HydrophobicContact CE3-CD 4.47Å; W233-K237 CarbonylContact O-C 3.45Å; W233-K237 VanDerWaalsContact O-CA 3.3Å; W233-K237 WeakPolarHBondContact O-CA 3.46Å; W233-K237 VanDerWaalsContact O-CB 3.24Å; W233-K237 WeakPolarHBondContact O-CB 3.5Å; W233-K237 PolarHBondContact O-N 3.31Å; W233-F238 HydrophobicContact CB-CE2 4.2Å; W233-F238 HydrophobicContact CE3-CZ 4.29Å; W233-F238 PolarHBondContact O-N 3.38Å
234	D	98.7	Very high	98.4	Very high	5 Å²	5	24.9 Å²	24.9	3%	0.027	12%	0.117	C	C	.	.	I	π-helix	trans	-51.7	-53.4	178.4	-61.5	-73.2	0	0	0	112.5	F135 T229 S232 L239	F135-D234 HydrophobicContact CD2-CB 3.7Å; F135-D234 HydrophobicContact CE2-CB 4.09Å; F135-D234 PolarHBondContact N-OD1 2.94Å; T229-D234 HydrophobicContact CG2-CB 3.87Å; S232-D234 PolarHBondContact O-N 3.22Å; D234-L239 VanDerWaalsContact O-CB 3.3Å; D234-L239 WeakPolarHBondContact O-CB 3.38Å; D234-L239 PolarHBondContact O-N 3.32Å
235	M	98.4	Very high	98.4	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	12%	0.121	C	C	.	.	I	π-helix	trans	-85.2	-44.3	-176.2	-58	-59.1	143.5	0	0	111.1	I133 F135 I227 T229 W233 L239 Y250 A254 W257 I322	I133-M235 HydrophobicContact CB-CE 3.95Å; I133-M235 HydrophobicContact CD1-CE 4.04Å; I133-M235 HydrophobicContact CG2-CE 3.92Å; F135-M235 HydrophobicContact CE2-CE 3.84Å; F135-M235 HydrophobicContact CE2-SD 4.49Å; F135-M235 HydrophobicContact CZ-CE 4.29Å; I227-M235 HydrophobicContact CG2-CE 3.91Å; T229-M235 HydrophobicContact CG2-CE 3.49Å; T229-M235 VanDerWaalsContact CG2-CE 3.49Å; T229-M235 HydrophobicContact CG2-CG 4.01Å; W233-M235 VanDerWaalsContact C-N 3.34Å; W233-M235 PolarHBondContact O-N 3.37Å; M235-L239 HydrophobicContact SD-CD2 3.71Å; M235-Y250 PolarHBondContact O-OH 2.89Å; M235-A254 HydrophobicContact SD-CB 4.12Å; M235-W257 HydrophobicContact CB-CD2 3.71Å; M235-W257 HydrophobicContact CB-CE3 3.5Å; M235-W257 VanDerWaalsContact CB-CE3 3.5Å; M235-W257 HydrophobicContact CB-CH2 3.57Å; M235-W257 HydrophobicContact CB-CZ2 3.77Å; M235-W257 HydrophobicContact CB-CZ3 3.43Å; M235-W257 VanDerWaalsContact CB-CZ3 3.43Å; M235-W257 HydrophobicContact CG-CD2 3.71Å; M235-W257 HydrophobicContact CG-CE3 3.77Å; M235-W257 HydrophobicContact CG-CG 4.03Å; M235-W257 HydrophobicContact CG-CZ3 4.23Å; M235-I322 WeakPolarHBondContact O-CD1 3.5Å
236	S	97.8	Very high	98.3	Very high	26 Å²	26	25.6 Å²	25.6	18%	0.182	12%	0.124	C	C	.	.	I	π-helix	trans	-79.2	-27.1	-173.1	82.3	0	0	0	0	114.7	S232 N240	S232-S236 VanDerWaalsContact O-CB 3.23Å; S232-S236 WeakPolarHBondContact O-CB 3.23Å; S232-S236 PolarHBondContact O-N 3.49Å; S232-S236 PolarHBondContact O-OG 2.94Å; S236-N240 VanDerWaalsContact O-CB 3.32Å; S236-N240 WeakPolarHBondContact O-CB 3.48Å; S236-N240 PolarHBondContact O-ND2 2.94Å
237	K	97.7	Very high	98.3	Very high	52 Å²	52	34.4 Å²	34.4	23%	0.226	16%	0.158	C	C	.	.	I	π-helix	trans	-112	-68.4	-177.1	-169.6	-177.8	-177.8	-168	0	110.6	H149 W233 N240 I241	H149-K237 PolarHBondContact CD2-NZ 2.93Å; H149-K237 PolarHBondContact NE2-NZ 2.9Å; W233-K237 HydrophobicContact CB-CB 4.36Å; W233-K237 HydrophobicContact CD2-CD 4.35Å; W233-K237 HydrophobicContact CE3-CD 4.47Å; W233-K237 CarbonylContact O-C 3.45Å; W233-K237 VanDerWaalsContact O-CA 3.3Å; W233-K237 WeakPolarHBondContact O-CA 3.46Å; W233-K237 VanDerWaalsContact O-CB 3.24Å; W233-K237 WeakPolarHBondContact O-CB 3.5Å; W233-K237 PolarHBondContact O-N 3.31Å; K237-N240 PolarHBondContact O-N 2.94Å; K237-I241 HydrophobicContact CG-CD1 3.8Å; K237-I241 WeakPolarHBondContact O-CB 3.35Å; K237-I241 VanDerWaalsContact O-CG1 3.23Å; K237-I241 WeakPolarHBondContact O-CG1 3.29Å; K237-I241 PolarHBondContact O-N 2.85Å
238	F	98.5	Very high	98.3	Very high	31 Å²	31	34.3 Å²	34.3	14%	0.136	16%	0.157	C	C	.	.	I	π-helix	trans	-66	-57	-169.3	-60.1	-49.9	0	0	0	112.6	F135 A137 H149 I151 W233 N240 I241 Q242	F135-F238 HydrophobicContact CB-CD2 4.43Å; F135-F238 HydrophobicContact CD2-CB 4.28Å; A137-F238 HydrophobicContact CB-CD1 3.82Å; A137-F238 HydrophobicContact CB-CE1 3.82Å; A137-F238 HydrophobicContact CB-CG 4.37Å; A137-F238 HydrophobicContact CB-CZ 4.36Å; H149-F238 HydrophobicContact CB-CD1 4.01Å; H149-F238 HydrophobicContact CB-CE1 4.07Å; H149-F238 AromaticContact CG-CE1 3.91Å; I151-F238 HydrophobicContact CD1-CB 4.3Å; I151-F238 HydrophobicContact CG1-CB 4.1Å; W233-F238 HydrophobicContact CB-CE2 4.2Å; W233-F238 HydrophobicContact CE3-CZ 4.29Å; W233-F238 PolarHBondContact O-N 3.38Å; F238-N240 PolarHBondContact O-N 2.91Å; F238-I241 PolarHBondContact O-N 3.3Å; F238-Q242 VanDerWaalsContact O-CB 3.23Å; F238-Q242 WeakPolarHBondContact O-CB 3.31Å; F238-Q242 PolarHBondContact O-N 2.86Å
239	L	98.7	Very high	98.2	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.026	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-34.8	178	-177.4	59.1	0	0	0	112.2	F135 F203 D234 M235 C243 Y250 P251 A254	F135-L239 HydrophobicContact CE2-CB 3.96Å; F135-L239 HydrophobicContact CZ-CB 4.45Å; F203-L239 HydrophobicContact CE1-CD1 4.5Å; F203-L239 HydrophobicContact CE2-CD1 4.21Å; F203-L239 HydrophobicContact CZ-CD1 3.54Å; D234-L239 VanDerWaalsContact O-CB 3.3Å; D234-L239 WeakPolarHBondContact O-CB 3.38Å; D234-L239 PolarHBondContact O-N 3.32Å; M235-L239 HydrophobicContact SD-CD2 3.71Å; L239-C243 VanDerWaalsContact O-CB 3.3Å; L239-C243 WeakPolarHBondContact O-CB 3.29Å; L239-C243 PolarHBondContact O-N 2.71Å; L239-C243 PolarHBondContact O-SG 2.85Å; L239-Y250 HydrophobicContact CB-CE2 4.29Å; L239-Y250 HydrophobicContact CD2-CE2 4.04Å; L239-Y250 HydrophobicContact CG-CE2 3.87Å; L239-P251 HydrophobicContact CD2-CG 4.22Å; L239-A254 HydrophobicContact CD2-CB 3.63Å
240	N	97.8	Very high	98.2	Very high	29 Å²	29	41 Å²	41	16%	0.155	19%	0.186	C	C	.	.	H	α-helix	trans	-65.9	-48.3	178.2	-173.9	24.2	0	0	0	112.3	S236 K237 F238 Q244 Y250	S236-N240 VanDerWaalsContact O-CB 3.32Å; S236-N240 WeakPolarHBondContact O-CB 3.48Å; S236-N240 PolarHBondContact O-ND2 2.94Å; K237-N240 PolarHBondContact O-N 2.94Å; F238-N240 PolarHBondContact O-N 2.91Å; N240-Q244 WeakPolarHBondContact O-CG 3.31Å; N240-Q244 PolarHBondContact O-N 3.19Å; N240-Q244 PolarHBondContact O-NE2 3.49Å; N240-Q244 PolarHBondContact OD1-NE2 3.36Å; N240-Q244 VanDerWaalsContact OD1-NE2 3.12Å; N240-Y250 HydrophobicContact CB-CD2 4.45Å; N240-Y250 HydrophobicContact CB-CE2 4.24Å
241	I	98	Very high	98.1	Very high	42 Å²	42	40.3 Å²	40.3	22%	0.215	18%	0.182	C	C	.	.	H	α-helix	trans	-64.4	-49.3	175.5	-68.5	166.4	0	0	0	109.5	V148 H149 K237 F238 C243 Q244 L245	V148-I241 HydrophobicContact CG1-CG2 4.44Å; H149-I241 WeakPolarHBondContact O-CG2 3.13Å; K237-I241 HydrophobicContact CG-CD1 3.8Å; K237-I241 WeakPolarHBondContact O-CB 3.35Å; K237-I241 VanDerWaalsContact O-CG1 3.23Å; K237-I241 WeakPolarHBondContact O-CG1 3.29Å; K237-I241 PolarHBondContact O-N 2.85Å; F238-I241 PolarHBondContact O-N 3.3Å; I241-C243 VanDerWaalsContact C-N 3.33Å; I241-C243 PolarHBondContact O-N 2.62Å; I241-Q244 WeakPolarHBondContact O-CA 3.4Å; I241-Q244 WeakPolarHBondContact O-CB 3.31Å; I241-Q244 PolarHBondContact O-N 2.75Å; I241-L245 HydrophobicContact CG2-CD1 3.82Å; I241-L245 HydrophobicContact CG2-CG 4.1Å; I241-L245 WeakPolarHBondContact O-CG 3.34Å; I241-L245 PolarHBondContact O-N 2.93Å
242	Q	98.8	Very high	98.1	Very high	5 Å²	5	43.6 Å²	43.6	2%	0.023	20%	0.202	C	C	.	.	H	α-helix	trans	-59.2	-41.8	-177.8	-171.5	63.7	54.6	0	0	112.6	E150 I151 F203 F238 Q244 L245 S246	E150-Q242 VanDerWaalsContact CA-OE1 3.25Å; I151-Q242 HydrophobicContact CB-CG 4.32Å; I151-Q242 HydrophobicContact CD1-CB 3.82Å; I151-Q242 HydrophobicContact CD1-CG 4.03Å; I151-Q242 HydrophobicContact CG1-CB 4.09Å; I151-Q242 HydrophobicContact CG1-CG 4.22Å; F203-Q242 HydrophobicContact CB-CG 3.94Å; F203-Q242 HydrophobicContact CD1-CG 3.5Å; F203-Q242 VanDerWaalsContact CD1-CG 3.5Å; F203-Q242 HydrophobicContact CD2-CG 3.38Å; F203-Q242 HydrophobicContact CE1-CG 3.77Å; F203-Q242 HydrophobicContact CE2-CB 4.47Å; F203-Q242 HydrophobicContact CE2-CG 3.66Å; F203-Q242 HydrophobicContact CG-CG 3.29Å; F203-Q242 HydrophobicContact CZ-CB 4.45Å; F203-Q242 HydrophobicContact CZ-CG 3.85Å; F238-Q242 VanDerWaalsContact O-CB 3.23Å; F238-Q242 WeakPolarHBondContact O-CB 3.31Å; F238-Q242 PolarHBondContact O-N 2.86Å; Q242-Q244 VanDerWaalsContact C-N 3.27Å; Q242-Q244 PolarHBondContact O-N 3.22Å; Q242-L245 PolarHBondContact O-N 3Å; Q242-S246 PolarHBondContact NE2-OG 3.5Å; Q242-S246 WeakPolarHBondContact O-CB 3.42Å; Q242-S246 PolarHBondContact O-N 3.09Å; Q242-S246 PolarHBondContact O-OG 2.75Å
243	C	98.3	Very high	98.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.9	-33.5	174	-73.6	0	0	0	0	112.3	L239 I241 R247 L248	L239-C243 VanDerWaalsContact O-CB 3.3Å; L239-C243 WeakPolarHBondContact O-CB 3.29Å; L239-C243 PolarHBondContact O-N 2.71Å; L239-C243 PolarHBondContact O-SG 2.85Å; I241-C243 VanDerWaalsContact C-N 3.33Å; I241-C243 PolarHBondContact O-N 2.62Å; C243-R247 PolarHBondContact O-N 2.98Å; C243-L248 HydrophobicContact CB-CB 4.43Å; C243-L248 PolarHBondContact O-N 3.17Å; C243-L248 VanDerWaalsContact O-O 3.09Å
244	Q	97.6	Very high	98.1	Very high	103 Å²	103	37 Å²	37	48%	0.481	18%	0.176	S	C	.	.	H	α-helix	trans	-70.3	-46.5	176	-68.1	170.9	55.4	0	0	111.2	N240 I241 Q242 S246 R247	N240-Q244 WeakPolarHBondContact O-CG 3.31Å; N240-Q244 PolarHBondContact O-N 3.19Å; N240-Q244 PolarHBondContact O-NE2 3.49Å; N240-Q244 PolarHBondContact OD1-NE2 3.36Å; N240-Q244 VanDerWaalsContact OD1-NE2 3.12Å; I241-Q244 WeakPolarHBondContact O-CA 3.4Å; I241-Q244 WeakPolarHBondContact O-CB 3.31Å; I241-Q244 PolarHBondContact O-N 2.75Å; Q242-Q244 VanDerWaalsContact C-N 3.27Å; Q242-Q244 PolarHBondContact O-N 3.22Å; Q244-S246 PolarHBondContact O-N 3.25Å; Q244-R247 PolarHBondContact O-N 3.4Å
245	L	98.2	Very high	98.1	Very high	59 Å²	59	41.2 Å²	41.2	31%	0.309	19%	0.194	S	C	.	.	H	α-helix	trans	-59.1	-48.3	177.7	-64	177.2	0	0	0	111.5	V148 E150 I178 I241 Q242 R247	V148-L245 HydrophobicContact CG1-CD1 3.84Å; V148-L245 HydrophobicContact CG1-CD2 3.99Å; V148-L245 HydrophobicContact CG1-CG 4.48Å; E150-L245 HydrophobicContact CG-CD1 3.64Å; I178-L245 HydrophobicContact CG1-CD1 4.45Å; I178-L245 HydrophobicContact CG1-CD2 4.29Å; I241-L245 HydrophobicContact CG2-CD1 3.82Å; I241-L245 HydrophobicContact CG2-CG 4.1Å; I241-L245 WeakPolarHBondContact O-CG 3.34Å; I241-L245 PolarHBondContact O-N 2.93Å; Q242-L245 PolarHBondContact O-N 3Å; L245-R247 PolarHBondContact O-N 3.21Å; L245-R247 VanDerWaalsContact O-N 3.16Å
246	S	98.3	Very high	98.1	Very high	11 Å²	11	44.9 Å²	44.9	8%	0.077	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	7.1	177.5	-55.5	0	0	0	0	114.1	Q242 Q244 L248	Q242-S246 PolarHBondContact NE2-OG 3.5Å; Q242-S246 WeakPolarHBondContact O-CB 3.42Å; Q242-S246 PolarHBondContact O-N 3.09Å; Q242-S246 PolarHBondContact O-OG 2.75Å; Q244-S246 PolarHBondContact O-N 3.25Å; S246-L248 PolarHBondContact O-N 3.03Å
247	R	97.9	Very high	98.2	Very high	184 Å²	184	43.7 Å²	43.7	69%	0.694	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	37	-179.2	-54.5	179.4	-175.8	172	1.6	113.3	C243 Q244 L245 F347 R348	C243-R247 PolarHBondContact O-N 2.98Å; Q244-R247 PolarHBondContact O-N 3.4Å; L245-R247 PolarHBondContact O-N 3.21Å; L245-R247 VanDerWaalsContact O-N 3.16Å; R247-F347 CarbonylContact O-C 3.53Å; R247-F347 VanDerWaalsContact O-CA 3.24Å; R247-F347 WeakPolarHBondContact O-CA 3.49Å; R247-R348 PolarHBondContact O-N 2.77Å
248	L	98.1	Very high	98.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-98.8	146.5	176.4	-69.5	173.1	0	0	0	111.6	F203 P204 L207 C243 S246 M344 P345 F347 R348	F203-L248 HydrophobicContact CD1-CD1 4.2Å; F203-L248 HydrophobicContact CE1-CD1 4.06Å; P204-L248 HydrophobicContact CB-CD1 4.16Å; P204-L248 HydrophobicContact CG-CD1 4.07Å; L207-L248 HydrophobicContact CD2-CD1 4.15Å; C243-L248 HydrophobicContact CB-CB 4.43Å; C243-L248 PolarHBondContact O-N 3.17Å; C243-L248 VanDerWaalsContact O-O 3.09Å; S246-L248 PolarHBondContact O-N 3.03Å; L248-M344 HydrophobicContact CD1-CE 4.31Å; L248-M344 HydrophobicContact CD2-CE 4.44Å; L248-P345 HydrophobicContact CB-CG 4.37Å; L248-P345 HydrophobicContact CD1-CG 4.48Å; L248-P345 HydrophobicContact CD2-CG 4.47Å; L248-F347 HydrophobicContact CD2-CD1 3.68Å; L248-F347 HydrophobicContact CD2-CD2 4.34Å; L248-F347 HydrophobicContact CD2-CE1 3.71Å; L248-F347 HydrophobicContact CD2-CE2 4.36Å; L248-F347 HydrophobicContact CD2-CG 4.01Å; L248-F347 HydrophobicContact CD2-CZ 4.06Å; L248-F347 HydrophobicContact CG-CD1 4.36Å; L248-F347 HydrophobicContact CG-CE1 4.29Å; L248-R348 PolarHBondContact O-NE 3.19Å; L248-R348 PolarHBondContact O-NH2 2.96Å
249	K	97.8	Very high	98.3	Very high	117 Å²	117	40 Å²	40	51%	0.509	19%	0.185	S	C	.	.	P	Polyproline II helix	trans	-64.4	143.5	162.5	-70.4	-175.9	-178.8	-179.6	0	108.8	P345 H346 R348	K249-P345 HydrophobicContact CB-CB 4.25Å; K249-P345 WeakPolarHBondContact O-CB 3.26Å; K249-P345 WeakPolarHBondContact O-CG 3.4Å; K249-H346 PolarHBondContact N-O 2.83Å; K249-R348 HydrophobicContact CG-CG 3.87Å
250	Y	97.9	Very high	98.3	Very high	23 Å²	23	39.7 Å²	39.7	9%	0.09	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-65	126.8	176.6	-171.2	-79.6	0	0	0	109.8	M235 L239 N240 A254 K255 I322	M235-Y250 PolarHBondContact O-OH 2.89Å; L239-Y250 HydrophobicContact CB-CE2 4.29Å; L239-Y250 HydrophobicContact CD2-CE2 4.04Å; L239-Y250 HydrophobicContact CG-CE2 3.87Å; N240-Y250 HydrophobicContact CB-CD2 4.45Å; N240-Y250 HydrophobicContact CB-CE2 4.24Å; Y250-A254 HydrophobicContact CE1-CB 3.9Å; Y250-A254 WeakPolarHBondContact CE1-O 3.43Å; Y250-A254 PolarHBondContact OH-O 3.3Å; Y250-K255 HydrophobicContact CD1-CG 3.71Å; Y250-K255 HydrophobicContact CE1-CB 4.5Å; Y250-K255 HydrophobicContact CE1-CG 3.76Å; Y250-I322 HydrophobicContact CE1-CD1 4.43Å; Y250-I322 HydrophobicContact CE2-CD1 3.84Å
251	P	97.9	Very high	98.3	Very high	0 Å²	0	42 Å²	42	0%	0	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-63	127.2	-173	20	-28.8	0	0	0	111.7	L239 F253 A254 P345	L239-P251 HydrophobicContact CD2-CG 4.22Å; P251-F253 VanDerWaalsContact C-N 3.26Å; P251-F253 HydrophobicContact CB-CD1 3.72Å; P251-F253 HydrophobicContact CB-CE1 3.42Å; P251-F253 VanDerWaalsContact CB-CE1 3.42Å; P251-F253 HydrophobicContact CB-CZ 4.11Å; P251-F253 HydrophobicContact CG-CE1 4.23Å; P251-F253 HydrophobicContact CG-CZ 4.46Å; P251-F253 PolarHBondContact O-N 3.37Å; P251-A254 HydrophobicContact CG-CB 3.97Å; P251-A254 PolarHBondContact O-N 2.84Å; P251-A254 VanDerWaalsContact O-N 3.1Å; P251-P345 HydrophobicContact CB-CG 4.37Å
252	P	97.9	Very high	98.3	Very high	75 Å²	75	42.9 Å²	42.9	49%	0.487	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-57.1	-35.7	-177.6	-28.2	36	0	0	0	114.6	A254 K255	P252-A254 PolarHBondContact O-N 2.96Å; P252-K255 WeakPolarHBondContact O-CB 3.3Å; P252-K255 PolarHBondContact O-N 2.85Å
253	F	98.4	Very high	98.3	Very high	8 Å²	8	43.2 Å²	43.2	4%	0.035	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-66.7	-23.4	-179.8	75.6	-94.3	0	0	0	113.1	L207 I211 M214 I227 P251 T339 P340 P342	L207-F253 HydrophobicContact CD1-CZ 4.46Å; I211-F253 HydrophobicContact CD1-CE1 3.9Å; I211-F253 HydrophobicContact CD1-CZ 4.33Å; I211-F253 HydrophobicContact CG1-CE1 3.96Å; I211-F253 HydrophobicContact CG1-CZ 4.05Å; M214-F253 HydrophobicContact CE-CD2 4.34Å; M214-F253 HydrophobicContact CE-CE2 4.32Å; M214-F253 HydrophobicContact SD-CE2 4.11Å; I227-F253 HydrophobicContact CD1-CD2 3.75Å; I227-F253 HydrophobicContact CD1-CE2 3.97Å; P251-F253 VanDerWaalsContact C-N 3.26Å; P251-F253 HydrophobicContact CB-CD1 3.72Å; P251-F253 HydrophobicContact CB-CE1 3.42Å; P251-F253 VanDerWaalsContact CB-CE1 3.42Å; P251-F253 HydrophobicContact CB-CZ 4.11Å; P251-F253 HydrophobicContact CG-CE1 4.23Å; P251-F253 HydrophobicContact CG-CZ 4.46Å; P251-F253 PolarHBondContact O-N 3.37Å; F253-T339 HydrophobicContact CB-CG2 3.82Å; F253-T339 WeakPolarHBondContact O-CG2 3.4Å; F253-P340 HydrophobicContact CB-CG 4.3Å; F253-P342 HydrophobicContact CB-CB 4.49Å; F253-P342 HydrophobicContact CD1-CB 3.78Å; F253-P342 HydrophobicContact CD2-CB 4.23Å; F253-P342 HydrophobicContact CE1-CB 3.99Å; F253-P342 HydrophobicContact CE2-CB 4.45Å; F253-P342 HydrophobicContact CG-CB 3.92Å; F253-P342 HydrophobicContact CZ-CB 4.34Å
254	A	98.4	Very high	98.3	Very high	2 Å²	2	43.2 Å²	43.2	2%	0.017	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-94.1	9	178.6	0	0	0	0	0	113.6	I227 M235 L239 Y250 P251 P252 K256	I227-A254 HydrophobicContact CD1-CB 4.24Å; M235-A254 HydrophobicContact SD-CB 4.12Å; L239-A254 HydrophobicContact CD2-CB 3.63Å; Y250-A254 HydrophobicContact CE1-CB 3.9Å; Y250-A254 WeakPolarHBondContact CE1-O 3.43Å; Y250-A254 PolarHBondContact OH-O 3.3Å; P251-A254 HydrophobicContact CG-CB 3.97Å; P251-A254 PolarHBondContact O-N 2.84Å; P251-A254 VanDerWaalsContact O-N 3.1Å; P252-A254 PolarHBondContact O-N 2.96Å; A254-K256 VanDerWaalsContact C-N 3.34Å
255	K	98.3	Very high	98.3	Very high	92 Å²	92	38.9 Å²	38.9	40%	0.4	18%	0.178	S	C	.	.	S	Bend	trans	-79.9	-14.8	-175.6	-73.4	-175	178.4	-179.6	0	114.1	Y250 P252 K321 I322	Y250-K255 HydrophobicContact CD1-CG 3.71Å; Y250-K255 HydrophobicContact CE1-CB 4.5Å; Y250-K255 HydrophobicContact CE1-CG 3.76Å; P252-K255 WeakPolarHBondContact O-CB 3.3Å; P252-K255 PolarHBondContact O-N 2.85Å; K255-K321 CarbonylContact O-C 3.43Å; K255-K321 WeakPolarHBondContact O-CA 3.28Å; K255-K321 VanDerWaalsContact O-CB 3.26Å; K255-K321 WeakPolarHBondContact O-CB 3.23Å; K255-I322 PolarHBondContact O-N 3.28Å
256	K	98.5	Very high	98.3	Very high	79 Å²	79	40.7 Å²	40.7	34%	0.343	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	135.1	-179.6	-69.1	-177	-177.3	177.2	0	107.5	A254 I318 E320 K321 E337	A254-K256 VanDerWaalsContact C-N 3.34Å; K256-I318 HydrophobicContact CB-CD1 4.15Å; K256-I318 HydrophobicContact CB-CG2 3.78Å; K256-I318 HydrophobicContact CD-CG2 4.4Å; K256-I318 HydrophobicContact CG-CG2 4.4Å; K256-E320 WeakPolarHBondContact CA-O 3.49Å; K256-K321 HydrophobicContact CG-CB 3.93Å; K256-E337 IonicContact NZ-OE2 2.82Å; K256-E337 PolarHBondContact NZ-OE2 2.99Å
257	W	98.8	Very high	98.3	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	170.2	179.6	64.3	95	0	0	0	111.9	I227 M235 N319 E320 I322 L327	I227-W257 HydrophobicContact CB-CB 4.14Å; I227-W257 HydrophobicContact CG2-CB 4.01Å; I227-W257 WeakPolarHBondContact O-CA 3.29Å; M235-W257 HydrophobicContact CB-CD2 3.71Å; M235-W257 HydrophobicContact CB-CE3 3.5Å; M235-W257 VanDerWaalsContact CB-CE3 3.5Å; M235-W257 HydrophobicContact CB-CH2 3.57Å; M235-W257 HydrophobicContact CB-CZ2 3.77Å; M235-W257 HydrophobicContact CB-CZ3 3.43Å; M235-W257 VanDerWaalsContact CB-CZ3 3.43Å; M235-W257 HydrophobicContact CG-CD2 3.71Å; M235-W257 HydrophobicContact CG-CE3 3.77Å; M235-W257 HydrophobicContact CG-CG 4.03Å; M235-W257 HydrophobicContact CG-CZ3 4.23Å; W257-N319 PolarHBondContact O-N 3.07Å; W257-N319 VanDerWaalsContact O-N 3.09Å; W257-E320 HydrophobicContact CD2-CB 4.29Å; W257-E320 HydrophobicContact CZ2-CB 3.9Å; W257-E320 PolarHBondContact N-O 2.84Å; W257-E320 PolarHBondContact NE1-OE2 3Å; W257-E320 VanDerWaalsContact NE1-OE2 3.08Å; W257-E320 PolarHBondContact O-N 2.87Å; W257-I322 HydrophobicContact CH2-CD1 4.1Å; W257-I322 HydrophobicContact CH2-CG1 3.68Å; W257-I322 HydrophobicContact CZ3-CD1 4.13Å; W257-I322 HydrophobicContact CZ3-CG1 3.79Å; W257-L327 HydrophobicContact CH2-CD1 3.75Å; W257-L327 HydrophobicContact CZ2-CD1 3.55Å
258	I	98.9	Very high	98.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	110.5	171.1	-53.3	171.3	0	0	0	107.5	Y127 S226 I227 L228 T229 I260 L316 I318	Y127-I258 HydrophobicContact CD2-CD1 4.5Å; Y127-I258 HydrophobicContact CE2-CD1 4.1Å; S226-I258 WeakPolarHBondContact OG-CG1 3.23Å; I227-I258 PolarHBondContact O-N 3Å; L228-I258 VanDerWaalsContact CA-O 3.27Å; L228-I258 WeakPolarHBondContact CA-O 2.94Å; L228-I258 HydrophobicContact CB-CB 4.02Å; L228-I258 HydrophobicContact CD1-CB 4.16Å; L228-I258 HydrophobicContact CD1-CD1 4.45Å; L228-I258 HydrophobicContact CD1-CG2 3.92Å; L228-I258 HydrophobicContact CG-CB 4Å; L228-I258 HydrophobicContact CG-CG2 4.13Å; T229-I258 PolarHBondContact N-O 3.14Å; I258-I260 PolarHBondContact O-N 3.33Å; I258-L316 HydrophobicContact CD1-CB 4.19Å; I258-L316 HydrophobicContact CG2-CB 4.37Å; I258-I318 HydrophobicContact CG1-CG1 4.35Å
259	N	98.8	Very high	98.1	Very high	5 Å²	5	40.2 Å²	40.2	3%	0.027	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	107.6	163.5	175.7	-21.8	0	0	0	108.4	G231 R261 K262 S263 N319 E320	G231-N259 WeakPolarHBondContact CA-OD1 3.48Å; N259-R261 VanDerWaalsContact C-N 3.31Å; N259-R261 PolarHBondContact O-N 2.9Å; N259-R261 VanDerWaalsContact OD1-CB 3.32Å; N259-R261 WeakPolarHBondContact OD1-CB 3.16Å; N259-R261 PolarHBondContact OD1-N 3.1Å; N259-K262 HydrophobicContact CB-CB 4.27Å; N259-K262 PolarHBondContact O-N 3.36Å; N259-K262 PolarHBondContact OD1-N 2.88Å; N259-S263 PolarHBondContact O-N 2.75Å; N259-S263 VanDerWaalsContact O-N 3.17Å; N259-S263 PolarHBondContact O-OG 2.93Å; N259-N319 WeakPolarHBondContact CB-OD1 3.49Å; N259-N319 PolarHBondContact N-OD1 3.3Å; N259-N319 PolarHBondContact O-ND2 3.32Å; N259-E320 VanDerWaalsContact CB-CD 3.48Å; N259-E320 HydrophobicContact CB-CG 4.06Å; N259-E320 VanDerWaalsContact CB-OE2 3.26Å; N259-E320 WeakPolarHBondContact CB-OE2 3.46Å; N259-E320 PolarHBondContact ND2-OE1 2.97Å; N259-E320 PolarHBondContact ND2-OE2 3.1Å; N259-E320 VanDerWaalsContact ND2-OE2 3.1Å
260	I	98.8	Very high	98	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-68.1	-30.4	-175.1	-161.1	172.7	0	0	0	112.1	L228 T229 I258 K262 S263 Y264 M280 I302 I305 A306 M309	L228-I260 HydrophobicContact CD1-CB 4.27Å; L228-I260 HydrophobicContact CD1-CD1 4.15Å; L228-I260 HydrophobicContact CD1-CG1 4.36Å; L228-I260 HydrophobicContact CD2-CB 3.87Å; L228-I260 HydrophobicContact CD2-CD1 4.12Å; L228-I260 HydrophobicContact CD2-CG1 4.49Å; L228-I260 HydrophobicContact CD2-CG2 4.21Å; L228-I260 HydrophobicContact CG-CB 4.16Å; T229-I260 PolarHBondContact O-N 2.93Å; T229-I260 VanDerWaalsContact O-N 3.08Å; I258-I260 PolarHBondContact O-N 3.33Å; I260-K262 VanDerWaalsContact C-N 3.3Å; I260-K262 PolarHBondContact O-N 3.13Å; I260-S263 PolarHBondContact O-N 3.32Å; I260-Y264 VanDerWaalsContact O-CB 3.23Å; I260-Y264 WeakPolarHBondContact O-CB 3.3Å; I260-Y264 PolarHBondContact O-N 3.41Å; I260-M280 HydrophobicContact CG2-CE 4.39Å; I260-I302 HydrophobicContact CD1-CG2 4.21Å; I260-I302 HydrophobicContact CG2-CG2 4.22Å; I260-I305 HydrophobicContact CD1-CB 4.12Å; I260-I305 HydrophobicContact CD1-CG2 3.75Å; I260-I305 HydrophobicContact CG1-CG2 4.48Å; I260-A306 HydrophobicContact CD1-CB 4.01Å; I260-M309 HydrophobicContact CD1-SD 4.29Å; I260-M309 HydrophobicContact CG1-SD 4.02Å
261	R	98.7	Very high	97.9	Very high	77 Å²	77	37.8 Å²	37.8	29%	0.291	19%	0.189	S	C	.	.	H	α-helix	trans	-59.2	-43.4	175.5	-61.4	-170.3	167.7	176.9	-0.2	111.5	D230 N259 Y264 G265 T275 M280	D230-R261 PolarHBondContact O-NE 3.47Å; D230-R261 WeakPolarHBondContact OD1-CD 3.37Å; D230-R261 WeakPolarHBondContact OD1-CG 3.43Å; D230-R261 IonicContact OD1-CZ 2.79Å; D230-R261 IonicContact OD1-NE 2.68Å; D230-R261 PolarHBondContact OD1-NE 3.16Å; D230-R261 IonicContact OD1-NH2 3.44Å; D230-R261 IonicContact OD2-CZ 3.26Å; D230-R261 VanDerWaalsContact OD2-CZ 3.29Å; D230-R261 IonicContact OD2-NE 3.73Å; D230-R261 PolarHBondContact OD2-NE 3.2Å; D230-R261 VanDerWaalsContact OD2-NE 3.16Å; D230-R261 IonicContact OD2-NH2 2.84Å; D230-R261 PolarHBondContact OD2-NH2 2.71Å; N259-R261 VanDerWaalsContact C-N 3.31Å; N259-R261 PolarHBondContact O-N 2.9Å; N259-R261 VanDerWaalsContact OD1-CB 3.32Å; N259-R261 WeakPolarHBondContact OD1-CB 3.16Å; N259-R261 PolarHBondContact OD1-N 3.1Å; R261-Y264 PolarHBondContact O-N 3.32Å; R261-G265 PolarHBondContact O-N 3.09Å; R261-T275 WeakPolarHBondContact CD-O 3.26Å; R261-T275 VanDerWaalsContact CG-O 3.23Å; R261-T275 WeakPolarHBondContact CG-O 3.38Å; R261-T275 PolarHBondContact NE-O 2.74Å; R261-M280 HydrophobicContact CG-CE 4.17Å
262	K	98.4	Very high	97.6	Very high	60 Å²	60	47 Å²	47	26%	0.261	22%	0.223	S	C	.	.	H	α-helix	trans	-66.8	-44.2	177	-173.1	176.8	-178	-178.7	0	111.2	N259 I260 N266 N319 S329	N259-K262 HydrophobicContact CB-CB 4.27Å; N259-K262 PolarHBondContact O-N 3.36Å; N259-K262 PolarHBondContact OD1-N 2.88Å; I260-K262 VanDerWaalsContact C-N 3.3Å; I260-K262 PolarHBondContact O-N 3.13Å; K262-N266 WeakPolarHBondContact O-CB 3.47Å; K262-N266 PolarHBondContact O-N 2.89Å; K262-N266 PolarHBondContact O-ND2 3.43Å; K262-N266 VanDerWaalsContact O-ND2 3.13Å; K262-N319 HydrophobicContact CD-CB 4.34Å; K262-N319 PolarHBondContact NZ-O 2.96Å; K262-S329 PolarHBondContact NZ-OG 2.91Å
263	S	98.6	Very high	97.5	Very high	12 Å²	12	47.6 Å²	47.6	8%	0.084	23%	0.229	C	C	.	.	H	α-helix	trans	-60.3	-46.7	175.3	-64.2	0	0	0	0	111.6	N259 I260 N266 F267 N319	N259-S263 PolarHBondContact O-N 2.75Å; N259-S263 VanDerWaalsContact O-N 3.17Å; N259-S263 PolarHBondContact O-OG 2.93Å; I260-S263 PolarHBondContact O-N 3.32Å; S263-N266 PolarHBondContact O-N 3.4Å; S263-F267 VanDerWaalsContact O-CB 3.22Å; S263-F267 WeakPolarHBondContact O-CB 3.41Å; S263-F267 PolarHBondContact O-N 3.36Å; S263-N319 PolarHBondContact OG-ND2 3.27Å
264	Y	98.7	Very high	97.3	Very high	1 Å²	1	50.2 Å²	50.2	0%	0.004	24%	0.241	C	C	.	.	H	α-helix	trans	-61	-52.2	-179.8	-174.5	-85	0	0	0	111.5	I260 R261 N266 F267 Y268 V270 T275 M280 K283 L284 I305 M309	I260-Y264 VanDerWaalsContact O-CB 3.23Å; I260-Y264 WeakPolarHBondContact O-CB 3.3Å; I260-Y264 PolarHBondContact O-N 3.41Å; R261-Y264 PolarHBondContact O-N 3.32Å; Y264-N266 VanDerWaalsContact C-N 3.31Å; Y264-N266 PolarHBondContact O-N 2.61Å; Y264-F267 PolarHBondContact O-N 2.88Å; Y264-Y268 HydrophobicContact CD1-CD2 4.21Å; Y264-Y268 AromaticContact CD2-CD2 3.5Å; Y264-Y268 HydrophobicContact CD2-CD2 3.5Å; Y264-Y268 VanDerWaalsContact CD2-CD2 3.5Å; Y264-Y268 AromaticContact CD2-CE2 3.61Å; Y264-Y268 HydrophobicContact CD2-CE2 3.61Å; Y264-Y268 HydrophobicContact CE1-CD2 4.11Å; Y264-Y268 AromaticContact CE2-CD2 3.34Å; Y264-Y268 HydrophobicContact CE2-CD2 3.34Å; Y264-Y268 AromaticContact CE2-CE2 3.43Å; Y264-Y268 HydrophobicContact CE2-CE2 3.43Å; Y264-Y268 VanDerWaalsContact CE2-CE2 3.43Å; Y264-Y268 HydrophobicContact CE2-CG 4.45Å; Y264-Y268 AromaticContact CG-CD2 3.92Å; Y264-Y268 HydrophobicContact CG-CD2 3.92Å; Y264-Y268 HydrophobicContact CG-CE2 4.44Å; Y264-Y268 AromaticContact CZ-CD2 3.66Å; Y264-Y268 PolarHBondContact O-N 2.92Å; Y264-V270 HydrophobicContact CD1-CG2 3.74Å; Y264-V270 HydrophobicContact CE1-CG2 3.66Å; Y264-T275 HydrophobicContact CD1-CG2 4.21Å; Y264-M280 HydrophobicContact CD1-CG 3.8Å; Y264-M280 HydrophobicContact CD1-SD 3.84Å; Y264-M280 HydrophobicContact CD2-CB 4.28Å; Y264-M280 HydrophobicContact CD2-CG 4.09Å; Y264-M280 HydrophobicContact CD2-SD 3.84Å; Y264-M280 HydrophobicContact CE1-CB 4.38Å; Y264-M280 HydrophobicContact CE1-CG 3.83Å; Y264-M280 HydrophobicContact CE1-SD 4.46Å; Y264-M280 HydrophobicContact CE2-CB 4Å; Y264-M280 HydrophobicContact CE2-CG 4.14Å; Y264-M280 HydrophobicContact CE2-SD 4.47Å; Y264-M280 HydrophobicContact CG-CG 3.94Å; Y264-M280 HydrophobicContact CG-SD 3.5Å; Y264-K283 VanDerWaalsContact OH-CB 3.28Å; Y264-K283 WeakPolarHBondContact OH-CB 3.08Å; Y264-L284 HydrophobicContact CE2-CD1 3.88Å; Y264-L284 HydrophobicContact CE2-CD2 4.22Å; Y264-L284 HydrophobicContact CE2-CG 3.98Å; Y264-I305 HydrophobicContact CD2-CG2 4.16Å; Y264-M309 HydrophobicContact CD2-SD 3.95Å
265	G	97.9	Very high	97.3	Very high	11 Å²	11	50.3 Å²	50.3	11%	0.113	24%	0.242	C	C	.	.	H	α-helix	trans	-56.8	-44.6	177.5	0	0	0	0	0	112.4	R261 K269 V270	R261-G265 PolarHBondContact O-N 3.09Å; G265-K269 WeakPolarHBondContact O-CA 3.26Å; G265-K269 PolarHBondContact O-N 3.46Å; G265-V270 WeakPolarHBondContact CA-O 3.41Å; G265-V270 PolarHBondContact O-N 3.01Å; G265-V270 VanDerWaalsContact O-N 3.11Å
266	N	97.3	Very high	97.3	Very high	97 Å²	97	51.9 Å²	51.9	52%	0.519	25%	0.249	S	C	.	.	H	α-helix	trans	-68	-37.9	178.8	-73	-23.8	0	0	0	113.2	K262 S263 Y264 K269	K262-N266 WeakPolarHBondContact O-CB 3.47Å; K262-N266 PolarHBondContact O-N 2.89Å; K262-N266 PolarHBondContact O-ND2 3.43Å; K262-N266 VanDerWaalsContact O-ND2 3.13Å; S263-N266 PolarHBondContact O-N 3.4Å; Y264-N266 VanDerWaalsContact C-N 3.31Å; Y264-N266 PolarHBondContact O-N 2.61Å; N266-K269 WeakPolarHBondContact O-CD 3.42Å; N266-K269 VanDerWaalsContact O-CE 3.23Å; N266-K269 WeakPolarHBondContact O-CE 3.23Å; N266-K269 PolarHBondContact O-NZ 2.95Å
267	F	97.8	Very high	97.2	Very high	19 Å²	19	48.8 Å²	48.8	8%	0.083	24%	0.236	C	C	.	.	H	α-helix	trans	-78.7	-49.4	-174.3	-176.6	-104.4	0	0	0	112.2	K104 N108 S263 Y264 M309 D312 C314	K104-F267 HydrophobicContact CD-CE1 4.49Å; K104-F267 HydrophobicContact CD-CE2 4.39Å; K104-F267 HydrophobicContact CD-CZ 4.29Å; K104-F267 VanDerWaalsContact CE-CD2 3.46Å; K104-F267 VanDerWaalsContact CE-O 3.29Å; K104-F267 WeakPolarHBondContact CE-O 3.49Å; K104-F267 HydrophobicContact CG-CD1 3.98Å; K104-F267 HydrophobicContact CG-CE1 3.54Å; K104-F267 HydrophobicContact CG-CE2 4.26Å; K104-F267 HydrophobicContact CG-CZ 3.71Å; N108-F267 VanDerWaalsContact ND2-CE2 3.34Å; N108-F267 WeakPolarHBondContact ND2-CE2 3.45Å; N108-F267 WeakPolarHBondContact ND2-CZ 3.38Å; S263-F267 VanDerWaalsContact O-CB 3.22Å; S263-F267 WeakPolarHBondContact O-CB 3.41Å; S263-F267 PolarHBondContact O-N 3.36Å; Y264-F267 PolarHBondContact O-N 2.88Å; F267-M309 HydrophobicContact CB-CE 4.06Å; F267-M309 HydrophobicContact CD1-CE 4.46Å; F267-M309 HydrophobicContact CG-CE 4.44Å; F267-D312 HydrophobicContact CE1-CB 3.84Å; F267-D312 HydrophobicContact CZ-CB 4.05Å; F267-C314 HydrophobicContact CD1-CB 4.09Å; F267-C314 HydrophobicContact CD2-CB 3.54Å; F267-C314 VanDerWaalsContact CD2-SG 3.52Å; F267-C314 HydrophobicContact CE1-CB 4.01Å; F267-C314 VanDerWaalsContact CE2-CA 3.45Å; F267-C314 HydrophobicContact CE2-CB 3.44Å; F267-C314 VanDerWaalsContact CE2-CB 3.44Å; F267-C314 HydrophobicContact CG-CB 3.85Å; F267-C314 HydrophobicContact CZ-CB 3.69Å
268	Y	97.3	Very high	97.2	Very high	3 Å²	3	52.8 Å²	52.8	1%	0.012	26%	0.26	C	S	.	.	H	α-helix	trans	-89.7	-1.1	179.9	-62.9	-65.4	0	0	0	113.9	V101 K104 Y264 L284 M309 D312	V101-Y268 HydrophobicContact CB-CD1 4.29Å; V101-Y268 HydrophobicContact CB-CE1 4.3Å; V101-Y268 HydrophobicContact CG1-CE1 4.06Å; V101-Y268 HydrophobicContact CG2-CD1 3.84Å; V101-Y268 HydrophobicContact CG2-CE1 4.08Å; V101-Y268 HydrophobicContact CG2-CG 4.24Å; K104-Y268 HydrophobicContact CB-CD1 4.03Å; K104-Y268 HydrophobicContact CB-CE1 4.35Å; K104-Y268 HydrophobicContact CG-CD1 4.13Å; K104-Y268 HydrophobicContact CG-CE1 4.36Å; Y264-Y268 HydrophobicContact CD1-CD2 4.21Å; Y264-Y268 AromaticContact CD2-CD2 3.5Å; Y264-Y268 HydrophobicContact CD2-CD2 3.5Å; Y264-Y268 VanDerWaalsContact CD2-CD2 3.5Å; Y264-Y268 AromaticContact CD2-CE2 3.61Å; Y264-Y268 HydrophobicContact CD2-CE2 3.61Å; Y264-Y268 HydrophobicContact CE1-CD2 4.11Å; Y264-Y268 AromaticContact CE2-CD2 3.34Å; Y264-Y268 HydrophobicContact CE2-CD2 3.34Å; Y264-Y268 AromaticContact CE2-CE2 3.43Å; Y264-Y268 HydrophobicContact CE2-CE2 3.43Å; Y264-Y268 VanDerWaalsContact CE2-CE2 3.43Å; Y264-Y268 HydrophobicContact CE2-CG 4.45Å; Y264-Y268 AromaticContact CG-CD2 3.92Å; Y264-Y268 HydrophobicContact CG-CD2 3.92Å; Y264-Y268 HydrophobicContact CG-CE2 4.44Å; Y264-Y268 AromaticContact CZ-CD2 3.66Å; Y264-Y268 PolarHBondContact O-N 2.92Å; Y268-L284 HydrophobicContact CE1-CD2 4.4Å; Y268-L284 HydrophobicContact CE2-CD2 3.96Å; Y268-M309 HydrophobicContact CE2-CG 3.8Å; Y268-M309 HydrophobicContact CE2-SD 4.43Å; Y268-D312 WeakPolarHBondContact CE1-OD2 3.32Å; Y268-D312 PolarHBondContact OH-OD2 3.04Å
269	K	95.8	Very high	97.2	Very high	163 Å²	163	54.7 Å²	54.7	71%	0.709	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	46.9	176.2	-53.6	-59	179.7	-163.5	0	113.3	G265 N266	G265-K269 WeakPolarHBondContact O-CA 3.26Å; G265-K269 PolarHBondContact O-N 3.46Å; N266-K269 WeakPolarHBondContact O-CD 3.42Å; N266-K269 VanDerWaalsContact O-CE 3.23Å; N266-K269 WeakPolarHBondContact O-CE 3.23Å; N266-K269 PolarHBondContact O-NZ 2.95Å
270	V	94.4	Very high	97.2	Very high	19 Å²	19	54.4 Å²	54.4	12%	0.115	27%	0.269	C	S	.	.			trans	-113.3	149.6	176.8	-58.3	0	0	0	0	111.5	Y264 G265 Q274 T275	Y264-V270 HydrophobicContact CD1-CG2 3.74Å; Y264-V270 HydrophobicContact CE1-CG2 3.66Å; G265-V270 WeakPolarHBondContact CA-O 3.41Å; G265-V270 PolarHBondContact O-N 3.01Å; G265-V270 VanDerWaalsContact O-N 3.11Å; V270-Q274 HydrophobicContact CB-CB 4.15Å; V270-Q274 HydrophobicContact CG2-CB 4.26Å; V270-T275 HydrophobicContact CG2-CG2 4.17Å
271	P	95.8	Very high	97.2	Very high	71 Å²	71	54.5 Å²	54.5	46%	0.461	27%	0.269	S	S	.	.			trans	-70.6	160.2	176.6	30.5	-36	0	0	0	111.7	S273 Q274	P271-S273 PolarHBondContact O-N 3.47Å; P271-S273 VanDerWaalsContact O-N 3.1Å; P271-Q274 HydrophobicContact CG-CG 4.12Å; P271-Q274 PolarHBondContact O-N 3.48Å
272	R	93.1	Very high	97.1	Very high	194 Å²	194	57.1 Å²	57.1	73%	0.732	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-54.6	-30.1	179.3	-175.9	-179.9	173	120.6	-0.6	113.9	Q274 T275	R272-Q274 PolarHBondContact O-N 3.31Å; R272-T275 PolarHBondContact O-N 2.93Å; R272-T275 PolarHBondContact O-OG1 3.03Å
273	S	94.6	Very high	97.1	Very high	86 Å²	86	56.7 Å²	56.7	60%	0.601	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-63.4	-20.7	176.1	53.2	0	0	0	0	113.4	P271	P271-S273 PolarHBondContact O-N 3.47Å; P271-S273 VanDerWaalsContact O-N 3.1Å
274	Q	95.1	Very high	97.1	Very high	63 Å²	63	56.1 Å²	56.1	29%	0.294	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-100	15.8	178.6	-63.6	-170.2	39.5	0	0	113.4	V270 P271 R272 I279	V270-Q274 HydrophobicContact CB-CB 4.15Å; V270-Q274 HydrophobicContact CG2-CB 4.26Å; P271-Q274 HydrophobicContact CG-CG 4.12Å; P271-Q274 PolarHBondContact O-N 3.48Å; R272-Q274 PolarHBondContact O-N 3.31Å; Q274-I279 HydrophobicContact CB-CG2 4.24Å; Q274-I279 WeakPolarHBondContact O-CG2 3.37Å
275	T	97.5	Very high	97	Very high	5 Å²	5	57.3 Å²	57.3	3%	0.031	29%	0.291	C	S	.	.			trans	-112.3	23.3	-178.5	70	0	0	0	0	112.6	R261 Y264 V270 R272	R261-T275 WeakPolarHBondContact CD-O 3.26Å; R261-T275 VanDerWaalsContact CG-O 3.23Å; R261-T275 WeakPolarHBondContact CG-O 3.38Å; R261-T275 PolarHBondContact NE-O 2.74Å; Y264-T275 HydrophobicContact CD1-CG2 4.21Å; V270-T275 HydrophobicContact CG2-CG2 4.17Å; R272-T275 PolarHBondContact O-N 2.93Å; R272-T275 PolarHBondContact O-OG1 3.03Å
276	K	98	Very high	97	Very high	125 Å²	125	57.7 Å²	57.7	54%	0.543	29%	0.29	S	S	.	.	S	Bend	trans	-72.2	146.2	166.5	-62.8	-176.6	178.7	-176.3	0	108.8	T278 I279 M280	K276-T278 PolarHBondContact O-N 3.28Å; K276-I279 HydrophobicContact CB-CB 4.47Å; K276-I279 HydrophobicContact CB-CD1 4.04Å; K276-I279 HydrophobicContact CB-CG1 4.18Å; K276-I279 HydrophobicContact CD-CD1 4.14Å; K276-I279 HydrophobicContact CG-CD1 4.26Å; K276-I279 PolarHBondContact O-N 3.01Å; K276-M280 WeakPolarHBondContact O-CG 3.07Å; K276-M280 PolarHBondContact O-N 3.44Å
277	L	98.1	Very high	97.1	Very high	14 Å²	14	59.5 Å²	59.5	7%	0.073	30%	0.3	C	S	.	.	H	α-helix	trans	-47.3	-54.4	-175.8	-178.9	54.2	0	0	0	113.4	I279 M280 L281 Y288 D298 N301 I302 I305	L277-I279 VanDerWaalsContact C-N 3.34Å; L277-I279 PolarHBondContact O-N 3.47Å; L277-M280 PolarHBondContact O-N 3.27Å; L277-M280 VanDerWaalsContact O-N 3.16Å; L277-L281 PolarHBondContact O-N 3.49Å; L277-Y288 HydrophobicContact CD2-CE2 3.98Å; L277-Y288 HydrophobicContact CG-CE2 4.5Å; L277-D298 HydrophobicContact CD2-CB 4.03Å; L277-D298 WeakPolarHBondContact CD2-OD1 3.32Å; L277-N301 HydrophobicContact CD1-CB 4.35Å; L277-N301 HydrophobicContact CD2-CB 4.49Å; L277-I302 HydrophobicContact CD1-CG1 3.82Å; L277-I302 HydrophobicContact CD2-CG1 4.35Å; L277-I305 HydrophobicContact CD1-CD1 3.54Å
278	T	97.9	Very high	97.1	Very high	84 Å²	84	60.9 Å²	60.9	52%	0.515	31%	0.305	S	S	.	.	H	α-helix	trans	-59.7	-40.4	179.3	52.3	0	0	0	0	112.9	K276 L281 E282	K276-T278 PolarHBondContact O-N 3.28Å; T278-L281 PolarHBondContact O-N 3.13Å; T278-E282 WeakPolarHBondContact O-CB 3.03Å; T278-E282 PolarHBondContact O-N 2.93Å
279	I	98.2	Very high	97.1	Very high	39 Å²	39	64.9 Å²	64.9	20%	0.2	33%	0.326	C	S	.	.	H	α-helix	trans	-68.4	-40.2	177.3	-58.4	175.6	0	0	0	110.7	Q274 K276 L277 E282 K283	Q274-I279 HydrophobicContact CB-CG2 4.24Å; Q274-I279 WeakPolarHBondContact O-CG2 3.37Å; K276-I279 HydrophobicContact CB-CB 4.47Å; K276-I279 HydrophobicContact CB-CD1 4.04Å; K276-I279 HydrophobicContact CB-CG1 4.18Å; K276-I279 HydrophobicContact CD-CD1 4.14Å; K276-I279 HydrophobicContact CG-CD1 4.26Å; K276-I279 PolarHBondContact O-N 3.01Å; L277-I279 VanDerWaalsContact C-N 3.34Å; L277-I279 PolarHBondContact O-N 3.47Å; I279-E282 PolarHBondContact O-N 3.47Å; I279-K283 HydrophobicContact CG2-CG 3.95Å; I279-K283 WeakPolarHBondContact O-CB 3.44Å; I279-K283 WeakPolarHBondContact O-CG 3.26Å; I279-K283 PolarHBondContact O-N 3.48Å
280	M	98.6	Very high	97.2	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.8	-44.6	177.3	-67.6	-169	-67.5	0	0	111	D230 I260 R261 Y264 K276 L277 L284 I305	D230-M280 WeakPolarHBondContact OD1-CE 3.4Å; I260-M280 HydrophobicContact CG2-CE 4.39Å; R261-M280 HydrophobicContact CG-CE 4.17Å; Y264-M280 HydrophobicContact CD1-CG 3.8Å; Y264-M280 HydrophobicContact CD1-SD 3.84Å; Y264-M280 HydrophobicContact CD2-CB 4.28Å; Y264-M280 HydrophobicContact CD2-CG 4.09Å; Y264-M280 HydrophobicContact CD2-SD 3.84Å; Y264-M280 HydrophobicContact CE1-CB 4.38Å; Y264-M280 HydrophobicContact CE1-CG 3.83Å; Y264-M280 HydrophobicContact CE1-SD 4.46Å; Y264-M280 HydrophobicContact CE2-CB 4Å; Y264-M280 HydrophobicContact CE2-CG 4.14Å; Y264-M280 HydrophobicContact CE2-SD 4.47Å; Y264-M280 HydrophobicContact CG-CG 3.94Å; Y264-M280 HydrophobicContact CG-SD 3.5Å; K276-M280 WeakPolarHBondContact O-CG 3.07Å; K276-M280 PolarHBondContact O-N 3.44Å; L277-M280 PolarHBondContact O-N 3.27Å; L277-M280 VanDerWaalsContact O-N 3.16Å; M280-L284 VanDerWaalsContact O-CG 3.26Å; M280-L284 WeakPolarHBondContact O-CG 3.4Å; M280-L284 PolarHBondContact O-N 3.36Å; M280-L284 VanDerWaalsContact O-N 3.15Å; M280-I305 HydrophobicContact CB-CD1 3.72Å; M280-I305 HydrophobicContact CE-CD1 4.04Å
281	L	98.6	Very high	97.4	Very high	2 Å²	2	63.2 Å²	63.2	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-58.5	-53.1	173.7	-69.1	170.3	0	0	0	111.4	L277 T278 K283 L284 G285 M286 Y288 N301 I305	L277-L281 PolarHBondContact O-N 3.49Å; T278-L281 PolarHBondContact O-N 3.13Å; L281-K283 VanDerWaalsContact C-N 3.34Å; L281-K283 PolarHBondContact O-N 3.1Å; L281-L284 CarbonylContact O-C 3.59Å; L281-L284 WeakPolarHBondContact O-CA 3.5Å; L281-L284 WeakPolarHBondContact O-CB 3.46Å; L281-L284 PolarHBondContact O-N 3.45Å; L281-G285 PolarHBondContact O-N 3.18Å; L281-M286 CarbonylContact C-O 3.53Å; L281-M286 HydrophobicContact CB-CB 4.39Å; L281-M286 WeakPolarHBondContact CB-O 3.18Å; L281-M286 HydrophobicContact CD2-CB 4.12Å; L281-M286 HydrophobicContact CD2-CE 3.89Å; L281-M286 PolarHBondContact O-N 2.94Å; L281-Y288 HydrophobicContact CD1-CD2 3.74Å; L281-Y288 HydrophobicContact CD1-CG 4.31Å; L281-N301 HydrophobicContact CD1-CB 4.22Å; L281-I305 HydrophobicContact CD2-CD1 4.01Å; L281-I305 HydrophobicContact CD2-CG1 3.73Å; L281-I305 HydrophobicContact CG-CD1 4.08Å; L281-I305 HydrophobicContact CG-CG1 4.33Å
282	E	98.1	Very high	97.5	Very high	131 Å²	131	62.8 Å²	62.8	61%	0.612	33%	0.328	S	S	*	.	H	α-helix	trans	-55.9	-47.2	-179.4	-173.9	-157.6	163.8	0	0	111.6	T278 I279 L284 G285	T278-E282 WeakPolarHBondContact O-CB 3.03Å; T278-E282 PolarHBondContact O-N 2.93Å; I279-E282 PolarHBondContact O-N 3.47Å; E282-L284 PolarHBondContact O-N 3.13Å; E282-G285 WeakPolarHBondContact O-CA 3.47Å; E282-G285 PolarHBondContact O-N 3.05Å
283	K	97.6	Very high	97.7	Very high	52 Å²	52	57.7 Å²	57.7	23%	0.226	31%	0.313	C	S	.	.	H	α-helix	trans	-65.9	-26.8	-179.7	-68.7	-68.5	-178.4	-168.8	0	112.8	G97 V98 Y264 I279 L281 G285	G97-K283 CarbonylContact C-O 3.46Å; G97-K283 WeakPolarHBondContact CA-O 3.43Å; V98-K283 HydrophobicContact CB-CD 4.32Å; V98-K283 HydrophobicContact CG1-CD 3.51Å; V98-K283 HydrophobicContact CG2-CB 4.22Å; V98-K283 HydrophobicContact CG2-CD 3.9Å; V98-K283 PolarHBondContact N-O 2.93Å; Y264-K283 VanDerWaalsContact OH-CB 3.28Å; Y264-K283 WeakPolarHBondContact OH-CB 3.08Å; I279-K283 HydrophobicContact CG2-CG 3.95Å; I279-K283 WeakPolarHBondContact O-CB 3.44Å; I279-K283 WeakPolarHBondContact O-CG 3.26Å; I279-K283 PolarHBondContact O-N 3.48Å; L281-K283 VanDerWaalsContact C-N 3.34Å; L281-K283 PolarHBondContact O-N 3.1Å; K283-G285 VanDerWaalsContact C-N 3.3Å
284	L	98.2	Very high	97.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-83.2	-7.6	171.7	-67.5	172.4	0	0	0	113	V101 Y264 Y268 M280 L281 E282 M286 I305 R308	V101-L284 HydrophobicContact CG1-CD2 3.87Å; V101-L284 HydrophobicContact CG2-CD2 4.05Å; Y264-L284 HydrophobicContact CE2-CD1 3.88Å; Y264-L284 HydrophobicContact CE2-CD2 4.22Å; Y264-L284 HydrophobicContact CE2-CG 3.98Å; Y268-L284 HydrophobicContact CE1-CD2 4.4Å; Y268-L284 HydrophobicContact CE2-CD2 3.96Å; M280-L284 VanDerWaalsContact O-CG 3.26Å; M280-L284 WeakPolarHBondContact O-CG 3.4Å; M280-L284 PolarHBondContact O-N 3.36Å; M280-L284 VanDerWaalsContact O-N 3.15Å; L281-L284 CarbonylContact O-C 3.59Å; L281-L284 WeakPolarHBondContact O-CA 3.5Å; L281-L284 WeakPolarHBondContact O-CB 3.46Å; L281-L284 PolarHBondContact O-N 3.45Å; E282-L284 PolarHBondContact O-N 3.13Å; L284-M286 HydrophobicContact CB-CE 3.65Å; L284-M286 HydrophobicContact CB-CG 4.43Å; L284-M286 HydrophobicContact CD1-CE 3.44Å; L284-M286 VanDerWaalsContact CD1-CE 3.44Å; L284-M286 HydrophobicContact CG-CE 4.19Å; L284-I305 HydrophobicContact CD1-CB 4.45Å; L284-I305 HydrophobicContact CD1-CG1 4.2Å; L284-I305 HydrophobicContact CD1-CG2 4.03Å; L284-R308 HydrophobicContact CD1-CB 4.38Å; L284-R308 HydrophobicContact CD1-CG 3.81Å; L284-R308 HydrophobicContact CD2-CG 3.75Å; L284-R308 HydrophobicContact CG-CG 4.26Å
285	G	97.4	Very high	98	Very high	26 Å²	26	51.6 Å²	51.6	27%	0.268	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	36.7	-176.2	0	0	0	0	0	112.8	R96 L281 E282 K283	R96-G285 WeakPolarHBondContact CD-O 3.31Å; R96-G285 PolarHBondContact NH1-O 3.47Å; L281-G285 PolarHBondContact O-N 3.18Å; E282-G285 WeakPolarHBondContact O-CA 3.47Å; E282-G285 PolarHBondContact O-N 3.05Å; K283-G285 VanDerWaalsContact C-N 3.3Å
286	M	98.3	Very high	98.1	Very high	19 Å²	19	52 Å²	52	9%	0.094	28%	0.279	C	S	.	.			trans	-116	146.3	174.8	-61.1	-173.8	-71.5	0	0	109.5	L281 L284 I305 R308	L281-M286 CarbonylContact C-O 3.53Å; L281-M286 HydrophobicContact CB-CB 4.39Å; L281-M286 WeakPolarHBondContact CB-O 3.18Å; L281-M286 HydrophobicContact CD2-CB 4.12Å; L281-M286 HydrophobicContact CD2-CE 3.89Å; L281-M286 PolarHBondContact O-N 2.94Å; L284-M286 HydrophobicContact CB-CE 3.65Å; L284-M286 HydrophobicContact CB-CG 4.43Å; L284-M286 HydrophobicContact CD1-CE 3.44Å; L284-M286 VanDerWaalsContact CD1-CE 3.44Å; L284-M286 HydrophobicContact CG-CE 4.19Å; M286-I305 HydrophobicContact CE-CG1 4.21Å; M286-R308 HydrophobicContact CE-CB 4.33Å
287	D	97.9	Very high	98.1	Very high	134 Å²	134	47.7 Å²	47.7	72%	0.717	26%	0.261	S	S	*	.			trans	-91.8	159.6	170.3	-61.1	-53.7	0	0	0	110.4	R304	D287-R304 PolarHBondContact O-NH1 3.25Å; D287-R304 PolarHBondContact O-NH2 3.31Å
288	Y	98.6	Very high	98.1	Very high	48 Å²	48	47.4 Å²	47.4	19%	0.188	26%	0.26	C	S	.	.			trans	-73.9	130.4	174	-170.2	-77.2	0	0	0	110.1	L277 L281 R291 P292 D298 N301	L277-Y288 HydrophobicContact CD2-CE2 3.98Å; L277-Y288 HydrophobicContact CG-CE2 4.5Å; L281-Y288 HydrophobicContact CD1-CD2 3.74Å; L281-Y288 HydrophobicContact CD1-CG 4.31Å; Y288-R291 PolarHBondContact OH-O 2.99Å; Y288-P292 HydrophobicContact CD1-CG 4.11Å; Y288-P292 HydrophobicContact CE1-CG 3.98Å; Y288-P292 WeakPolarHBondContact OH-CA 3.46Å; Y288-D298 WeakPolarHBondContact CE2-OD1 3.34Å; Y288-D298 PolarHBondContact OH-N 3.22Å; Y288-D298 PolarHBondContact OH-OD1 2.9Å; Y288-N301 WeakPolarHBondContact CE1-ND2 3.23Å; Y288-N301 HydrophobicContact CE2-CB 4.21Å; Y288-N301 VanDerWaalsContact CZ-ND2 3.3Å
289	D	98.3	Very high	98.2	Very high	87 Å²	87	43.4 Å²	43.4	47%	0.465	24%	0.235	S	C	.	.			trans	-105.9	123.6	176.7	-67.8	-19.7	0	0	0	110.2	N301 R304	D289-N301 PolarHBondContact N-OD1 2.79Å; D289-N301 VanDerWaalsContact N-OD1 3.11Å; D289-N301 PolarHBondContact O-ND2 3.38Å; D289-R304 VanDerWaalsContact CG-NH2 3.31Å; D289-R304 IonicContact OD1-NH2 2.68Å; D289-R304 PolarHBondContact OD1-NH2 2.68Å; D289-R304 IonicContact OD2-CZ 2.66Å; D289-R304 IonicContact OD2-NE 2.96Å; D289-R304 PolarHBondContact OD2-NE 3.28Å; D289-R304 VanDerWaalsContact OD2-NE 3.15Å; D289-R304 IonicContact OD2-NH1 3.45Å; D289-R304 IonicContact OD2-NH2 3.79Å; D289-R304 PolarHBondContact OD2-NH2 2.78Å
290	G	98.1	Very high	98.2	Very high	55 Å²	55	45 Å²	45	57%	0.567	24%	0.241	S	C	*	.	S	Bend	trans	98.7	-155.4	179.1	0	0	0	0	0	113.6	D297	G290-D297 WeakPolarHBondContact CA-OD2 3.29Å
291	R	98.1	Very high	98.2	Very high	92 Å²	92	45 Å²	45	35%	0.347	24%	0.241	S	C	.	.			trans	-100	120.1	-178.1	-173.9	-169.6	-178.7	-68.6	-4.2	110.8	S188 L189 T190 G191 Y288 C294 D297	S188-R291 PolarHBondContact O-NH2 3.5Å; L189-R291 PolarHBondContact O-NH1 3.34Å; L189-R291 PolarHBondContact O-NH2 3.11Å; T190-R291 VanDerWaalsContact C-CZ 3.45Å; T190-R291 PolarHBondContact O-NH1 3.45Å; G191-R291 VanDerWaalsContact CA-CZ 3.4Å; G191-R291 VanDerWaalsContact CA-NH2 3.3Å; G191-R291 VanDerWaalsContact N-CZ 3.32Å; Y288-R291 PolarHBondContact OH-O 2.99Å; R291-C294 HydrophobicContact CB-CB 4.05Å; R291-C294 HydrophobicContact CG-CB 4.5Å; R291-C294 VanDerWaalsContact O-CB 3.24Å; R291-C294 WeakPolarHBondContact O-CB 3.35Å; R291-C294 PolarHBondContact O-N 3Å; R291-C294 VanDerWaalsContact O-N 3.15Å; R291-D297 PolarHBondContact N-OD2 3.45Å
292	P	97.4	Very high	98.3	Very high	63 Å²	63	44.9 Å²	44.9	41%	0.409	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	141.3	171.3	-25.3	34.9	0	0	0	112.1	Y288 C294	Y288-P292 HydrophobicContact CD1-CG 4.11Å; Y288-P292 HydrophobicContact CE1-CG 3.98Å; Y288-P292 WeakPolarHBondContact OH-CA 3.46Å; P292-C294 PolarHBondContact O-N 3.13Å
293	H	96.5	Very high	98.3	Very high	87 Å²	87	38.7 Å²	38.7	40%	0.403	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	18	-176.9	-50.3	-67.6	0	0	0	114.2	L189 T190 D298	L189-H293 HydrophobicContact CD1-CB 4.47Å; L189-H293 VanDerWaalsContact CD1-CD2 3.45Å; L189-H293 WeakPolarHBondContact CD1-CD2 3.17Å; L189-H293 HydrophobicContact CG-CB 4.25Å; L189-H293 WeakPolarHBondContact O-CB 3.39Å; T190-H293 CarbonylContact C-O 3.51Å; T190-H293 WeakPolarHBondContact CA-O 3.48Å; T190-H293 VanDerWaalsContact O-O 3.11Å; H293-D298 WeakPolarHBondContact CA-OD2 3.41Å; H293-D298 PolarHBondContact N-OD2 2.93Å
294	C	98.5	Very high	98.4	Very high	20 Å²	20	39.3 Å²	39.3	14%	0.135	21%	0.212	C	C	.	.			trans	-94.6	114.8	157.2	171.6	0	0	0	0	106.1	R291 P292 L296 D297 D298	R291-C294 HydrophobicContact CB-CB 4.05Å; R291-C294 HydrophobicContact CG-CB 4.5Å; R291-C294 VanDerWaalsContact O-CB 3.24Å; R291-C294 WeakPolarHBondContact O-CB 3.35Å; R291-C294 PolarHBondContact O-N 3Å; R291-C294 VanDerWaalsContact O-N 3.15Å; P292-C294 PolarHBondContact O-N 3.13Å; C294-L296 PolarHBondContact O-N 3.07Å; C294-L296 VanDerWaalsContact O-N 3.13Å; C294-D297 HydrophobicContact CB-CB 4.17Å; C294-D297 PolarHBondContact O-N 3.09Å; C294-D298 PolarHBondContact O-N 2.77Å
295	G	98.5	Very high	98.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.8	-34.9	-167.2	0	0	0	0	0	112.8	E153 P155 S299	E153-G295 PolarHBondContact OE1-N 3.18Å; E153-G295 PolarHBondContact OE2-N 3.18Å; P155-G295 VanDerWaalsContact CG-C 3.46Å; G295-S299 VanDerWaalsContact O-CB 3.25Å; G295-S299 WeakPolarHBondContact O-CB 3.08Å; G295-S299 PolarHBondContact O-N 2.88Å; G295-S299 PolarHBondContact O-OG 2.94Å
296	L	98.8	Very high	98.5	Very high	15 Å²	15	38 Å²	38	8%	0.079	20%	0.2	C	C	.	.	H	α-helix	trans	-66.5	-42.7	175.2	-179.4	62.9	0	0	0	113	E153 P155 V157 T169 Q171 C294 S299 K300	E153-L296 PolarHBondContact OE1-N 3.2Å; E153-L296 VanDerWaalsContact OE1-N 3.14Å; P155-L296 HydrophobicContact CB-CB 4.11Å; P155-L296 HydrophobicContact CB-CD1 4.32Å; V157-L296 HydrophobicContact CG2-CD1 3.89Å; T169-L296 HydrophobicContact CG2-CD1 4.42Å; Q171-L296 HydrophobicContact CB-CD2 4.13Å; Q171-L296 HydrophobicContact CG-CB 4.19Å; Q171-L296 HydrophobicContact CG-CD2 4.36Å; C294-L296 PolarHBondContact O-N 3.07Å; C294-L296 VanDerWaalsContact O-N 3.13Å; L296-S299 PolarHBondContact O-N 3.16Å; L296-K300 WeakPolarHBondContact O-CG 3.38Å; L296-K300 PolarHBondContact O-N 3.36Å
297	D	98.8	Very high	98.5	Very high	33 Å²	33	38.3 Å²	38.3	18%	0.176	20%	0.202	C	C	.	.	H	α-helix	trans	-70.3	-40.2	179.6	-73.3	-15.9	0	0	0	110.5	G290 R291 C294 S299 K300 N301	G290-D297 WeakPolarHBondContact CA-OD2 3.29Å; R291-D297 PolarHBondContact N-OD2 3.45Å; C294-D297 HydrophobicContact CB-CB 4.17Å; C294-D297 PolarHBondContact O-N 3.09Å; D297-S299 PolarHBondContact O-N 3.35Å; D297-K300 PolarHBondContact O-N 3.48Å; D297-K300 IonicContact OD1-NZ 2.61Å; D297-N301 PolarHBondContact O-N 2.93Å; D297-N301 PolarHBondContact O-ND2 3Å
298	D	98.8	Very high	98.5	Very high	9 Å²	9	32.6 Å²	32.6	5%	0.048	17%	0.171	C	C	.	.	H	α-helix	trans	-60.3	-45.7	172.3	-78.3	-38.4	0	0	0	111.1	D134 L277 Y288 H293 C294 K300 N301 I302	D134-D298 WeakPolarHBondContact OD2-CB 3.22Å; L277-D298 HydrophobicContact CD2-CB 4.03Å; L277-D298 WeakPolarHBondContact CD2-OD1 3.32Å; Y288-D298 WeakPolarHBondContact CE2-OD1 3.34Å; Y288-D298 PolarHBondContact OH-N 3.22Å; Y288-D298 PolarHBondContact OH-OD1 2.9Å; H293-D298 WeakPolarHBondContact CA-OD2 3.41Å; H293-D298 PolarHBondContact N-OD2 2.93Å; C294-D298 PolarHBondContact O-N 2.77Å; D298-K300 VanDerWaalsContact C-N 3.32Å; D298-K300 PolarHBondContact O-N 3.09Å; D298-N301 WeakPolarHBondContact O-CB 3.42Å; D298-N301 PolarHBondContact O-N 2.88Å; D298-N301 VanDerWaalsContact O-N 3.07Å; D298-I302 WeakPolarHBondContact O-CD1 3.34Å; D298-I302 WeakPolarHBondContact O-CG1 3.23Å; D298-I302 PolarHBondContact O-N 2.94Å
299	S	98.9	Very high	98.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57	-40.5	174.9	-65.5	0	0	0	0	113	D134 G295 L296 D297 I302 A303	D134-S299 WeakPolarHBondContact CB-OG 3.49Å; D134-S299 PolarHBondContact N-OG 3.41Å; G295-S299 VanDerWaalsContact O-CB 3.25Å; G295-S299 WeakPolarHBondContact O-CB 3.08Å; G295-S299 PolarHBondContact O-N 2.88Å; G295-S299 PolarHBondContact O-OG 2.94Å; L296-S299 PolarHBondContact O-N 3.16Å; D297-S299 PolarHBondContact O-N 3.35Å; S299-I302 PolarHBondContact O-N 3.41Å; S299-A303 WeakPolarHBondContact O-CB 3.17Å; S299-A303 PolarHBondContact O-N 2.71Å
300	K	98.9	Very high	98.5	Very high	71 Å²	71	27.5 Å²	27.5	31%	0.309	15%	0.147	S	C	.	.	H	α-helix	trans	-67.1	-40.2	175	-72.1	169.7	-175	163.8	0	111.9	V157 I166 L296 D297 D298 A303 R304	V157-K300 HydrophobicContact CG2-CG 4.13Å; I166-K300 HydrophobicContact CD1-CG 4.41Å; L296-K300 WeakPolarHBondContact O-CG 3.38Å; L296-K300 PolarHBondContact O-N 3.36Å; D297-K300 PolarHBondContact O-N 3.48Å; D297-K300 IonicContact OD1-NZ 2.61Å; D298-K300 VanDerWaalsContact C-N 3.32Å; D298-K300 PolarHBondContact O-N 3.09Å; K300-A303 WeakPolarHBondContact O-CB 3.26Å; K300-A303 PolarHBondContact O-N 3.18Å; K300-R304 WeakPolarHBondContact O-CG 3.31Å; K300-R304 PolarHBondContact O-N 3.38Å
301	N	98.9	Very high	98.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.3	-39.9	175.5	-78.2	-73.8	0	0	0	112.1	L277 L281 Y288 D289 D297 D298 A303 R304 I305	L277-N301 HydrophobicContact CD1-CB 4.35Å; L277-N301 HydrophobicContact CD2-CB 4.49Å; L281-N301 HydrophobicContact CD1-CB 4.22Å; Y288-N301 WeakPolarHBondContact CE1-ND2 3.23Å; Y288-N301 HydrophobicContact CE2-CB 4.21Å; Y288-N301 VanDerWaalsContact CZ-ND2 3.3Å; D289-N301 PolarHBondContact N-OD1 2.79Å; D289-N301 VanDerWaalsContact N-OD1 3.11Å; D289-N301 PolarHBondContact O-ND2 3.38Å; D297-N301 PolarHBondContact O-N 2.93Å; D297-N301 PolarHBondContact O-ND2 3Å; D298-N301 WeakPolarHBondContact O-CB 3.42Å; D298-N301 PolarHBondContact O-N 2.88Å; D298-N301 VanDerWaalsContact O-N 3.07Å; N301-A303 VanDerWaalsContact C-N 3.31Å; N301-A303 PolarHBondContact O-N 3.5Å; N301-R304 WeakPolarHBondContact O-CB 3.39Å; N301-R304 PolarHBondContact O-N 2.7Å; N301-R304 PolarHBondContact OD1-NH1 3.31Å; N301-I305 WeakPolarHBondContact O-CG1 3.17Å; N301-I305 PolarHBondContact O-N 3.13Å; N301-I305 VanDerWaalsContact O-N 3.09Å
302	I	98.9	Very high	98.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-61.5	-41.9	172.5	-66.5	159.1	0	0	0	110.4	I132 D134 L228 D230 I260 L277 D298 S299 R304 I305 A306	I132-I302 HydrophobicContact CG1-CG2 4.49Å; I132-I302 HydrophobicContact CG2-CB 3.86Å; I132-I302 HydrophobicContact CG2-CD1 4.4Å; I132-I302 HydrophobicContact CG2-CG2 3.56Å; D134-I302 HydrophobicContact CB-CD1 3.98Å; D134-I302 WeakPolarHBondContact OD2-CD1 2.9Å; L228-I302 HydrophobicContact CD2-CG2 3.28Å; D230-I302 HydrophobicContact CB-CD1 3.52Å; D230-I302 HydrophobicContact CB-CG1 3.95Å; I260-I302 HydrophobicContact CD1-CG2 4.21Å; I260-I302 HydrophobicContact CG2-CG2 4.22Å; L277-I302 HydrophobicContact CD1-CG1 3.82Å; L277-I302 HydrophobicContact CD2-CG1 4.35Å; D298-I302 WeakPolarHBondContact O-CD1 3.34Å; D298-I302 WeakPolarHBondContact O-CG1 3.23Å; D298-I302 PolarHBondContact O-N 2.94Å; S299-I302 PolarHBondContact O-N 3.41Å; I302-R304 PolarHBondContact O-N 3.36Å; I302-I305 WeakPolarHBondContact O-CB 3.37Å; I302-I305 PolarHBondContact O-N 2.93Å; I302-A306 PolarHBondContact O-N 3.47Å
303	A	98.9	Very high	98.3	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-61.6	-40.8	174.4	0	0	0	0	0	112.3	I132 V157 I166 S299 K300 N301 I305 A306 V307	I132-A303 HydrophobicContact CD1-CB 3.88Å; I132-A303 HydrophobicContact CG1-CB 4.31Å; V157-A303 HydrophobicContact CG1-CB 4.04Å; I166-A303 HydrophobicContact CD1-CB 3.96Å; I166-A303 HydrophobicContact CG1-CB 4.22Å; S299-A303 WeakPolarHBondContact O-CB 3.17Å; S299-A303 PolarHBondContact O-N 2.71Å; K300-A303 WeakPolarHBondContact O-CB 3.26Å; K300-A303 PolarHBondContact O-N 3.18Å; N301-A303 VanDerWaalsContact C-N 3.31Å; N301-A303 PolarHBondContact O-N 3.5Å; A303-I305 VanDerWaalsContact C-N 3.31Å; A303-I305 PolarHBondContact O-N 3.04Å; A303-A306 WeakPolarHBondContact O-CB 3.39Å; A303-A306 PolarHBondContact O-N 3.41Å; A303-A306 VanDerWaalsContact O-N 3.13Å; A303-V307 WeakPolarHBondContact O-CG2 3.35Å; A303-V307 PolarHBondContact O-N 3.39Å
304	R	98.9	Very high	98.3	Very high	65 Å²	65	22.1 Å²	22.1	25%	0.245	12%	0.12	C	C	.	.	H	α-helix	trans	-58.8	-41	173.6	-69	162.4	74.5	-132.4	13.7	111.8	D287 D289 K300 N301 I302 R308	D287-R304 PolarHBondContact O-NH1 3.25Å; D287-R304 PolarHBondContact O-NH2 3.31Å; D289-R304 VanDerWaalsContact CG-NH2 3.31Å; D289-R304 IonicContact OD1-NH2 2.68Å; D289-R304 PolarHBondContact OD1-NH2 2.68Å; D289-R304 IonicContact OD2-CZ 2.66Å; D289-R304 IonicContact OD2-NE 2.96Å; D289-R304 PolarHBondContact OD2-NE 3.28Å; D289-R304 VanDerWaalsContact OD2-NE 3.15Å; D289-R304 IonicContact OD2-NH1 3.45Å; D289-R304 IonicContact OD2-NH2 3.79Å; D289-R304 PolarHBondContact OD2-NH2 2.78Å; K300-R304 WeakPolarHBondContact O-CG 3.31Å; K300-R304 PolarHBondContact O-N 3.38Å; N301-R304 WeakPolarHBondContact O-CB 3.39Å; N301-R304 PolarHBondContact O-N 2.7Å; N301-R304 PolarHBondContact OD1-NH1 3.31Å; I302-R304 PolarHBondContact O-N 3.36Å; R304-R308 WeakPolarHBondContact O-CB 3.45Å; R304-R308 PolarHBondContact O-N 3.05Å; R304-R308 VanDerWaalsContact O-N 3.08Å
305	I	98.9	Very high	98.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-65.1	-45.6	173.6	-63.5	170	0	0	0	110.6	I260 Y264 L277 M280 L281 L284 M286 N301 I302 A303 V307 R308 M309	I260-I305 HydrophobicContact CD1-CB 4.12Å; I260-I305 HydrophobicContact CD1-CG2 3.75Å; I260-I305 HydrophobicContact CG1-CG2 4.48Å; Y264-I305 HydrophobicContact CD2-CG2 4.16Å; L277-I305 HydrophobicContact CD1-CD1 3.54Å; M280-I305 HydrophobicContact CB-CD1 3.72Å; M280-I305 HydrophobicContact CE-CD1 4.04Å; L281-I305 HydrophobicContact CD2-CD1 4.01Å; L281-I305 HydrophobicContact CD2-CG1 3.73Å; L281-I305 HydrophobicContact CG-CD1 4.08Å; L281-I305 HydrophobicContact CG-CG1 4.33Å; L284-I305 HydrophobicContact CD1-CB 4.45Å; L284-I305 HydrophobicContact CD1-CG1 4.2Å; L284-I305 HydrophobicContact CD1-CG2 4.03Å; M286-I305 HydrophobicContact CE-CG1 4.21Å; N301-I305 WeakPolarHBondContact O-CG1 3.17Å; N301-I305 PolarHBondContact O-N 3.13Å; N301-I305 VanDerWaalsContact O-N 3.09Å; I302-I305 WeakPolarHBondContact O-CB 3.37Å; I302-I305 PolarHBondContact O-N 2.93Å; A303-I305 VanDerWaalsContact C-N 3.31Å; A303-I305 PolarHBondContact O-N 3.04Å; I305-V307 PolarHBondContact O-N 3.17Å; I305-R308 WeakPolarHBondContact O-CB 3.45Å; I305-R308 PolarHBondContact O-N 2.83Å; I305-M309 HydrophobicContact CG2-CG 4.28Å; I305-M309 HydrophobicContact CG2-SD 4.03Å; I305-M309 WeakPolarHBondContact O-CG 3.34Å; I305-M309 PolarHBondContact O-N 3.19Å
306	A	98.9	Very high	98.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.3	-48.5	179.5	0	0	0	0	0	111.5	L159 L228 I260 I302 A303 R308 M309 L310 L316	L159-A306 HydrophobicContact CD2-CB 3.97Å; L228-A306 HydrophobicContact CD1-CB 4.29Å; I260-A306 HydrophobicContact CD1-CB 4.01Å; I302-A306 PolarHBondContact O-N 3.47Å; A303-A306 WeakPolarHBondContact O-CB 3.39Å; A303-A306 PolarHBondContact O-N 3.41Å; A303-A306 VanDerWaalsContact O-N 3.13Å; A306-R308 VanDerWaalsContact C-N 3.32Å; A306-R308 PolarHBondContact O-N 3.4Å; A306-M309 PolarHBondContact O-N 2.99Å; A306-L310 VanDerWaalsContact O-CG 3.29Å; A306-L310 WeakPolarHBondContact O-CG 3.24Å; A306-L310 PolarHBondContact O-N 3.08Å; A306-L316 HydrophobicContact CB-CD1 3.88Å
307	V	98.8	Very high	98	Very high	25 Å²	25	28.8 Å²	28.8	15%	0.152	15%	0.145	C	C	.	.	H	α-helix	trans	-53.3	-50.6	173.9	166.1	0	0	0	0	110.6	L159 L164 A303 I305 M309 L310 Q311	L159-V307 HydrophobicContact CD1-CG2 3.5Å; L159-V307 VanDerWaalsContact CD1-CG2 3.5Å; L159-V307 HydrophobicContact CD2-CG2 3.99Å; L159-V307 HydrophobicContact CG-CG2 4.41Å; L164-V307 HydrophobicContact CB-CG1 4.14Å; L164-V307 HydrophobicContact CB-CG2 4.42Å; L164-V307 WeakPolarHBondContact O-CG2 3.39Å; A303-V307 WeakPolarHBondContact O-CG2 3.35Å; A303-V307 PolarHBondContact O-N 3.39Å; I305-V307 PolarHBondContact O-N 3.17Å; V307-M309 VanDerWaalsContact C-N 3.34Å; V307-M309 PolarHBondContact O-N 3.02Å; V307-L310 PolarHBondContact O-N 3.41Å; V307-Q311 HydrophobicContact CG1-CG 4.43Å; V307-Q311 WeakPolarHBondContact O-CG 3.39Å; V307-Q311 PolarHBondContact O-N 3.47Å
308	R	98.7	Very high	98	Very high	14 Å²	14	28 Å²	28	5%	0.053	14%	0.141	C	C	.	.	H	α-helix	trans	-60	-43.5	179.4	166.6	52	125.1	-146.5	-10.1	112.6	E94 R105 L284 M286 R304 I305 A306 L310 Q311 D312	E94-R308 VanDerWaalsContact CB-NH1 3.32Å; E94-R308 VanDerWaalsContact CG-CZ 3.45Å; R105-R308 VanDerWaalsContact CZ-CZ 3.45Å; L284-R308 HydrophobicContact CD1-CB 4.38Å; L284-R308 HydrophobicContact CD1-CG 3.81Å; L284-R308 HydrophobicContact CD2-CG 3.75Å; L284-R308 HydrophobicContact CG-CG 4.26Å; M286-R308 HydrophobicContact CE-CB 4.33Å; R304-R308 WeakPolarHBondContact O-CB 3.45Å; R304-R308 PolarHBondContact O-N 3.05Å; R304-R308 VanDerWaalsContact O-N 3.08Å; I305-R308 WeakPolarHBondContact O-CB 3.45Å; I305-R308 PolarHBondContact O-N 2.83Å; A306-R308 VanDerWaalsContact C-N 3.32Å; A306-R308 PolarHBondContact O-N 3.4Å; R308-L310 VanDerWaalsContact C-N 3.34Å; R308-Q311 PolarHBondContact O-N 2.98Å; R308-D312 IonicContact NE-OD2 3.68Å; R308-D312 WeakPolarHBondContact O-CB 3.22Å; R308-D312 PolarHBondContact O-N 3.41Å
309	M	98.7	Very high	98	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-63.2	-41.6	178	-73.9	-175.8	69.7	0	0	111.7	I260 Y264 F267 Y268 I305 A306 V307 D312 G313 C314 L316	I260-M309 HydrophobicContact CD1-SD 4.29Å; I260-M309 HydrophobicContact CG1-SD 4.02Å; Y264-M309 HydrophobicContact CD2-SD 3.95Å; F267-M309 HydrophobicContact CB-CE 4.06Å; F267-M309 HydrophobicContact CD1-CE 4.46Å; F267-M309 HydrophobicContact CG-CE 4.44Å; Y268-M309 HydrophobicContact CE2-CG 3.8Å; Y268-M309 HydrophobicContact CE2-SD 4.43Å; I305-M309 HydrophobicContact CG2-CG 4.28Å; I305-M309 HydrophobicContact CG2-SD 4.03Å; I305-M309 WeakPolarHBondContact O-CG 3.34Å; I305-M309 PolarHBondContact O-N 3.19Å; A306-M309 PolarHBondContact O-N 2.99Å; V307-M309 VanDerWaalsContact C-N 3.34Å; V307-M309 PolarHBondContact O-N 3.02Å; M309-D312 PolarHBondContact O-N 3.26Å; M309-G313 PolarHBondContact O-N 3.44Å; M309-C314 HydrophobicContact CB-CB 4.02Å; M309-C314 HydrophobicContact CE-CB 4.24Å; M309-C314 WeakPolarHBondContact O-CB 3.46Å; M309-C314 PolarHBondContact O-N 3.36Å; M309-L316 HydrophobicContact CB-CD2 4.47Å; M309-L316 HydrophobicContact CE-CD2 3.69Å; M309-L316 HydrophobicContact SD-CD2 4.11Å
310	L	97.9	Very high	97.9	Very high	28 Å²	28	28.9 Å²	28.9	15%	0.147	15%	0.145	C	C	.	.	H	α-helix	trans	-61.9	-46.1	175.3	-67.5	166.4	0	0	0	111.2	Y126 I130 L159 L164 A306 V307 R308 D312 G313 L316	Y126-L310 HydrophobicContact CE1-CD2 3.87Å; Y126-L310 VanDerWaalsContact OH-CD2 3.31Å; Y126-L310 WeakPolarHBondContact OH-CD2 3.21Å; I130-L310 HydrophobicContact CD1-CD1 4.49Å; L159-L310 HydrophobicContact CD2-CD1 4.3Å; L164-L310 HydrophobicContact CD2-CB 3.9Å; L164-L310 HydrophobicContact CD2-CD1 3.67Å; L164-L310 HydrophobicContact CD2-CG 4.43Å; A306-L310 VanDerWaalsContact O-CG 3.29Å; A306-L310 WeakPolarHBondContact O-CG 3.24Å; A306-L310 PolarHBondContact O-N 3.08Å; V307-L310 PolarHBondContact O-N 3.41Å; R308-L310 VanDerWaalsContact C-N 3.34Å; L310-D312 VanDerWaalsContact C-N 3.29Å; L310-D312 PolarHBondContact O-N 2.84Å; L310-G313 WeakPolarHBondContact O-CA 3.26Å; L310-G313 PolarHBondContact O-N 3.37Å; L310-L316 HydrophobicContact CD2-CD1 4.32Å; L310-L316 HydrophobicContact CD2-CG 4.39Å; L310-L316 HydrophobicContact CG-CD1 4.2Å
311	Q	96.8	Very high	97.9	Very high	113 Å²	113	28.5 Å²	28.5	53%	0.528	14%	0.144	S	C	.	.	H	α-helix	trans	-61	-37.1	175.6	-70.6	174.3	-17.6	0	0	112.6	L164 V307 R308 G313	L164-Q311 HydrophobicContact CD1-CG 3.61Å; V307-Q311 HydrophobicContact CG1-CG 4.43Å; V307-Q311 WeakPolarHBondContact O-CG 3.39Å; V307-Q311 PolarHBondContact O-N 3.47Å; R308-Q311 PolarHBondContact O-N 2.98Å; Q311-G313 PolarHBondContact O-N 3.16Å
312	D	96.5	Very high	97.8	Very high	6 Å²	6	29.5 Å²	29.5	3%	0.032	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-3.1	174.5	-74.5	-6.8	0	0	0	112.4	R105 N108 F267 Y268 R308 M309 L310	R105-D312 IonicContact CZ-OD1 4Å; R105-D312 IonicContact CZ-OD2 3.88Å; R105-D312 IonicContact NE-OD1 3.78Å; R105-D312 PolarHBondContact NE-OD1 3.27Å; R105-D312 IonicContact NE-OD2 3.73Å; R105-D312 IonicContact NH2-OD1 2.84Å; R105-D312 PolarHBondContact NH2-OD1 3.2Å; R105-D312 IonicContact NH2-OD2 2.76Å; R105-D312 PolarHBondContact NH2-OD2 2.91Å; N108-D312 WeakPolarHBondContact CB-O 3.39Å; N108-D312 PolarHBondContact ND2-O 3.44Å; F267-D312 HydrophobicContact CE1-CB 3.84Å; F267-D312 HydrophobicContact CZ-CB 4.05Å; Y268-D312 WeakPolarHBondContact CE1-OD2 3.32Å; Y268-D312 PolarHBondContact OH-OD2 3.04Å; R308-D312 IonicContact NE-OD2 3.68Å; R308-D312 WeakPolarHBondContact O-CB 3.22Å; R308-D312 PolarHBondContact O-N 3.41Å; M309-D312 PolarHBondContact O-N 3.26Å; L310-D312 VanDerWaalsContact C-N 3.29Å; L310-D312 PolarHBondContact O-N 2.84Å
313	G	95.1	Very high	97.5	Very high	48 Å²	48	35.1 Å²	35.1	50%	0.495	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	25.7	177.7	0	0	0	0	0	113.9	N108 M309 L310 Q311	N108-G313 PolarHBondContact ND2-O 3.25Å; M309-G313 PolarHBondContact O-N 3.44Å; L310-G313 WeakPolarHBondContact O-CA 3.26Å; L310-G313 PolarHBondContact O-N 3.37Å; Q311-G313 PolarHBondContact O-N 3.16Å
314	C	96.4	Very high	97	Very high	16 Å²	16	39.6 Å²	39.6	11%	0.108	21%	0.212	C	C	.	.			trans	-81.8	127.5	167.5	-168.9	0	0	0	0	109.9	F267 M309 L316	F267-C314 HydrophobicContact CD1-CB 4.09Å; F267-C314 HydrophobicContact CD2-CB 3.54Å; F267-C314 VanDerWaalsContact CD2-SG 3.52Å; F267-C314 HydrophobicContact CE1-CB 4.01Å; F267-C314 VanDerWaalsContact CE2-CA 3.45Å; F267-C314 HydrophobicContact CE2-CB 3.44Å; F267-C314 VanDerWaalsContact CE2-CB 3.44Å; F267-C314 HydrophobicContact CG-CB 3.85Å; F267-C314 HydrophobicContact CZ-CB 3.69Å; M309-C314 HydrophobicContact CB-CB 4.02Å; M309-C314 HydrophobicContact CE-CB 4.24Å; M309-C314 WeakPolarHBondContact O-CB 3.46Å; M309-C314 PolarHBondContact O-N 3.36Å; C314-L316 PolarHBondContact O-N 3.02Å
315	E	95.4	Very high	96.4	Very high	94 Å²	94	39.1 Å²	39.1	44%	0.439	23%	0.227	S	C	.	.			trans	-89.8	97.4	168.5	-166.7	-178.9	92.2	0	0	108.8	Y126 R317 I336	Y126-E315 HydrophobicContact CD2-CG 3.6Å; Y126-E315 HydrophobicContact CE2-CB 4.42Å; Y126-E315 HydrophobicContact CE2-CG 3.31Å; E315-R317 PolarHBondContact O-N 3.2Å; E315-R317 IonicContact OE1-CZ 2.71Å; E315-R317 IonicContact OE1-NE 3.56Å; E315-R317 IonicContact OE1-NH2 2.89Å; E315-R317 PolarHBondContact OE1-NH2 3.38Å; E315-I336 HydrophobicContact CG-CD1 3.86Å; E315-I336 WeakPolarHBondContact OE1-CD1 3.3Å
316	L	97.9	Very high	96.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.258	C	S	.	.			trans	-68.6	116.4	178.9	-64.1	171.6	0	0	0	109.1	Y126 Y127 I130 L228 I258 A306 M309 L310 C314	Y126-L316 VanDerWaalsContact CE2-O 3.31Å; Y126-L316 WeakPolarHBondContact CE2-O 3.49Å; Y126-L316 WeakPolarHBondContact OH-CA 3.26Å; Y126-L316 WeakPolarHBondContact OH-CB 3.42Å; Y126-L316 PolarHBondContact OH-N 2.5Å; Y126-L316 PolarHBondContact OH-O 3.3Å; Y127-L316 VanDerWaalsContact CE2-O 3.31Å; Y127-L316 WeakPolarHBondContact CE2-O 3.34Å; I130-L316 HydrophobicContact CD1-CD1 4.22Å; L228-L316 HydrophobicContact CD1-CD1 4.09Å; I258-L316 HydrophobicContact CD1-CB 4.19Å; I258-L316 HydrophobicContact CG2-CB 4.37Å; A306-L316 HydrophobicContact CB-CD1 3.88Å; M309-L316 HydrophobicContact CB-CD2 4.47Å; M309-L316 HydrophobicContact CE-CD2 3.69Å; M309-L316 HydrophobicContact SD-CD2 4.11Å; L310-L316 HydrophobicContact CD2-CD1 4.32Å; L310-L316 HydrophobicContact CD2-CG 4.39Å; L310-L316 HydrophobicContact CG-CD1 4.2Å; C314-L316 PolarHBondContact O-N 3.02Å
317	R	97.4	Very high	96	Very high	81 Å²	81	49.4 Å²	49.4	31%	0.306	28%	0.277	S	S	.	.			trans	-126.2	152.6	-177.6	63	-177.3	66.8	179.3	-0.6	111.3	E315 N319 S332 I336	E315-R317 PolarHBondContact O-N 3.2Å; E315-R317 IonicContact OE1-CZ 2.71Å; E315-R317 IonicContact OE1-NE 3.56Å; E315-R317 IonicContact OE1-NH2 2.89Å; E315-R317 PolarHBondContact OE1-NH2 3.38Å; R317-N319 PolarHBondContact O-N 3Å; R317-S332 PolarHBondContact NH1-O 3.05Å; R317-I336 HydrophobicContact CB-CD1 4.43Å; R317-I336 HydrophobicContact CB-CG1 4.46Å
318	I	98.4	Very high	95.9	Very high	17 Å²	17	52 Å²	52	9%	0.087	29%	0.288	C	S	.	.			trans	-50.3	124.8	172.9	-72.8	168	0	0	0	108.9	Y127 S226 K256 I258 V330	Y127-I318 WeakPolarHBondContact OH-CG1 3.42Å; S226-I318 WeakPolarHBondContact OG-CG1 3.38Å; K256-I318 HydrophobicContact CB-CD1 4.15Å; K256-I318 HydrophobicContact CB-CG2 3.78Å; K256-I318 HydrophobicContact CD-CG2 4.4Å; K256-I318 HydrophobicContact CG-CG2 4.4Å; I258-I318 HydrophobicContact CG1-CG1 4.35Å; I318-V330 HydrophobicContact CG2-CB 4.22Å; I318-V330 HydrophobicContact CG2-CG1 4.23Å; I318-V330 HydrophobicContact CG2-CG2 3.92Å
319	N	98.3	Very high	95.8	Very high	14 Å²	14	55.2 Å²	55.2	8%	0.075	31%	0.313	C	S	.	.			trans	-134.3	-3.4	-172.8	65.5	16.4	0	0	0	113.2	W257 N259 K262 S263 R317 V330	W257-N319 PolarHBondContact O-N 3.07Å; W257-N319 VanDerWaalsContact O-N 3.09Å; N259-N319 WeakPolarHBondContact CB-OD1 3.49Å; N259-N319 PolarHBondContact N-OD1 3.3Å; N259-N319 PolarHBondContact O-ND2 3.32Å; K262-N319 HydrophobicContact CD-CB 4.34Å; K262-N319 PolarHBondContact NZ-O 2.96Å; S263-N319 PolarHBondContact OG-ND2 3.27Å; R317-N319 PolarHBondContact O-N 3Å; N319-V330 PolarHBondContact O-N 3.23Å
320	E	98.4	Very high	95.7	Very high	14 Å²	14	56.6 Å²	56.6	7%	0.065	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	152.1	175.7	-73.6	-173.6	168.8	0	0	111.6	S232 K256 W257 N259 L327 M328	S232-E320 WeakPolarHBondContact CA-OE2 3.4Å; S232-E320 WeakPolarHBondContact CB-OE2 3.49Å; K256-E320 WeakPolarHBondContact CA-O 3.49Å; W257-E320 HydrophobicContact CD2-CB 4.29Å; W257-E320 HydrophobicContact CZ2-CB 3.9Å; W257-E320 PolarHBondContact N-O 2.84Å; W257-E320 PolarHBondContact NE1-OE2 3Å; W257-E320 VanDerWaalsContact NE1-OE2 3.08Å; W257-E320 PolarHBondContact O-N 2.87Å; N259-E320 VanDerWaalsContact CB-CD 3.48Å; N259-E320 HydrophobicContact CB-CG 4.06Å; N259-E320 VanDerWaalsContact CB-OE2 3.26Å; N259-E320 WeakPolarHBondContact CB-OE2 3.46Å; N259-E320 PolarHBondContact ND2-OE1 2.97Å; N259-E320 PolarHBondContact ND2-OE2 3.1Å; N259-E320 VanDerWaalsContact ND2-OE2 3.1Å; E320-L327 HydrophobicContact CB-CD1 4.23Å; E320-L327 HydrophobicContact CG-CD1 4.39Å; E320-M328 CarbonylContact C-O 3.58Å; E320-M328 WeakPolarHBondContact CA-O 3.4Å
321	K	98.1	Very high	95.5	Very high	63 Å²	63	58.1 Å²	58.1	27%	0.274	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	160.2	176.1	68.1	175.4	178.1	178.9	0	112	K255 K256 M328 V330	K255-K321 CarbonylContact O-C 3.43Å; K255-K321 WeakPolarHBondContact O-CA 3.28Å; K255-K321 VanDerWaalsContact O-CB 3.26Å; K255-K321 WeakPolarHBondContact O-CB 3.23Å; K256-K321 HydrophobicContact CG-CB 3.93Å; K321-M328 HydrophobicContact CG-CB 3.95Å; K321-M328 PolarHBondContact N-O 2.82Å; K321-M328 PolarHBondContact O-N 3.32Å; K321-V330 HydrophobicContact CB-CG2 3.83Å; K321-V330 HydrophobicContact CD-CG2 3.97Å; K321-V330 HydrophobicContact CG-CG2 3.83Å
322	I	96.4	Very high	95.2	Very high	20 Å²	20	56.8 Å²	56.8	10%	0.103	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.5	161.9	-67.9	171.2	0	0	0	109.6	M235 Y250 K255 W257 Q326	M235-I322 WeakPolarHBondContact O-CD1 3.5Å; Y250-I322 HydrophobicContact CE1-CD1 4.43Å; Y250-I322 HydrophobicContact CE2-CD1 3.84Å; K255-I322 PolarHBondContact O-N 3.28Å; W257-I322 HydrophobicContact CH2-CD1 4.1Å; W257-I322 HydrophobicContact CH2-CG1 3.68Å; W257-I322 HydrophobicContact CZ3-CD1 4.13Å; W257-I322 HydrophobicContact CZ3-CG1 3.79Å; I322-Q326 WeakPolarHBondContact CA-O 3.46Å
323	H	92.3	Very high	94.8	Very high	118 Å²	118	61.3 Å²	61.3	55%	0.546	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	130.5	169.8	-172.4	75	0	0	0	109.2	G325 Q326 M328	H323-G325 PolarHBondContact O-N 2.99Å; H323-G325 VanDerWaalsContact O-N 3.13Å; H323-Q326 PolarHBondContact N-O 3.18Å; H323-Q326 PolarHBondContact O-N 2.92Å; H323-M328 HydrophobicContact CB-SD 3.74Å
324	A	89.1	Confident	94.4	Very high	96 Å²	96	63.6 Å²	63.6	79%	0.793	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	35.9	-175.7	0	0	0	0	0	114.2	Q326	A324-Q326 PolarHBondContact O-N 2.84Å
325	G	86.1	Confident	94.1	Very high	54 Å²	54	67.7 Å²	67.7	56%	0.557	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-0.1	-178.7	0	0	0	0	0	115.1	H323	H323-G325 PolarHBondContact O-N 2.99Å; H323-G325 VanDerWaalsContact O-N 3.13Å
326	Q	92.4	Very high	93.9	Very high	141 Å²	141	64.4 Å²	64.4	66%	0.659	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	142	179.1	-64	-171.5	-11	0	0	112	I322 H323 A324	I322-Q326 WeakPolarHBondContact CA-O 3.46Å; H323-Q326 PolarHBondContact N-O 3.18Å; H323-Q326 PolarHBondContact O-N 2.92Å; A324-Q326 PolarHBondContact O-N 2.84Å
327	L	96.5	Very high	93.6	Very high	75 Å²	75	69.6 Å²	69.6	39%	0.393	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	125.9	171.3	178	64.5	0	0	0	109.9	S232 W257 E320	S232-L327 WeakPolarHBondContact OG-CD2 3.09Å; W257-L327 HydrophobicContact CH2-CD1 3.75Å; W257-L327 HydrophobicContact CZ2-CD1 3.55Å; E320-L327 HydrophobicContact CB-CD1 4.23Å; E320-L327 HydrophobicContact CG-CD1 4.39Å
328	M	97	Very high	93.3	Very high	81 Å²	81	67.3 Å²	67.3	40%	0.399	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	152.5	177.9	-60	-175.5	80.7	0	0	111.1	E320 K321 H323	E320-M328 CarbonylContact C-O 3.58Å; E320-M328 WeakPolarHBondContact CA-O 3.4Å; K321-M328 HydrophobicContact CG-CB 3.95Å; K321-M328 PolarHBondContact N-O 2.82Å; K321-M328 PolarHBondContact O-N 3.32Å; H323-M328 HydrophobicContact CB-SD 3.74Å
329	S	96.6	Very high	93.3	Very high	81 Å²	81	66.9 Å²	66.9	57%	0.566	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	148	169.1	-69.6	0	0	0	0	111.5	K262	K262-S329 PolarHBondContact NZ-OG 2.91Å
330	V	96.4	Very high	93.3	Very high	28 Å²	28	69.3 Å²	69.3	17%	0.17	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-99.6	134.5	167.2	180	0	0	0	0	108.7	I318 N319 K321 L334	I318-V330 HydrophobicContact CG2-CB 4.22Å; I318-V330 HydrophobicContact CG2-CG1 4.23Å; I318-V330 HydrophobicContact CG2-CG2 3.92Å; N319-V330 PolarHBondContact O-N 3.23Å; K321-V330 HydrophobicContact CB-CG2 3.83Å; K321-V330 HydrophobicContact CD-CG2 3.97Å; K321-V330 HydrophobicContact CG-CG2 3.83Å; V330-L334 HydrophobicContact CG1-CD1 4.16Å
331	S	93.9	Very high	93.3	Very high	61 Å²	61	71.2 Å²	71.2	43%	0.427	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-67.2	134	-178.9	-178.9	0	0	0	0	110.8	S333 L334	S331-S333 PolarHBondContact O-N 3.42Å; S331-S333 PolarHBondContact OG-N 3.4Å; S331-S333 PolarHBondContact OG-OG 3.25Å; S331-L334 PolarHBondContact O-N 2.91Å
332	S	89.6	Confident	93.3	Very high	85 Å²	85	68.3 Å²	68.3	59%	0.594	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-16.4	174.7	63.6	0	0	0	0	113.9	R317 L334	R317-S332 PolarHBondContact NH1-O 3.05Å; S332-L334 VanDerWaalsContact C-N 3.32Å
333	S	88.1	Confident	93.3	Very high	100 Å²	100	73.6 Å²	73.6	70%	0.699	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-11.4	178.7	63.7	0	0	0	0	113.9	S331	S331-S333 PolarHBondContact O-N 3.42Å; S331-S333 PolarHBondContact OG-N 3.4Å; S331-S333 PolarHBondContact OG-OG 3.25Å
334	L	87.8	Confident	93.6	Very high	97 Å²	97	70.4 Å²	70.4	51%	0.508	43%	0.433	S	S	.	.	S	Bend	trans	-74.4	148.8	178.5	-67.6	171.3	0	0	0	110.6	V330 S331 S332	V330-L334 HydrophobicContact CG1-CD1 4.16Å; S331-L334 PolarHBondContact O-N 2.91Å; S332-L334 VanDerWaalsContact C-N 3.32Å
335	P	89.8	Confident	94	Very high	101 Å²	101	66.4 Å²	66.4	66%	0.656	40%	0.399	S	S	*	.			trans	-56.9	153.5	172.4	-22.8	33.5	0	0	0	112	E337	P335-E337 PolarHBondContact O-N 2.88Å; P335-E337 VanDerWaalsContact O-N 3.09Å
336	I	90.8	Very high	94.4	Very high	26 Å²	26	70.5 Å²	70.5	13%	0.133	40%	0.404	C	S	.	.			trans	-70	108.3	172.9	-67.2	-171.6	0	0	0	108.8	Y126 Y127 K224 E315 R317	Y126-I336 HydrophobicContact CD2-CD1 3.62Å; Y126-I336 HydrophobicContact CE2-CD1 3.94Å; Y127-I336 HydrophobicContact CD1-CG2 4.32Å; Y127-I336 HydrophobicContact CE1-CG2 3.69Å; Y127-I336 HydrophobicContact CE2-CG2 4.07Å; K224-I336 PolarHBondContact NZ-O 3.3Å; E315-I336 HydrophobicContact CG-CD1 3.86Å; E315-I336 WeakPolarHBondContact OE1-CD1 3.3Å; R317-I336 HydrophobicContact CB-CD1 4.43Å; R317-I336 HydrophobicContact CB-CG1 4.46Å
337	E	91.4	Very high	94.5	Very high	109 Å²	109	69.8 Å²	69.8	51%	0.509	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-97.8	141.6	170.8	-68.8	176.8	176.8	0	0	110.1	Y127 K256 P335	Y127-E337 VanDerWaalsContact CE1-O 3.29Å; Y127-E337 WeakPolarHBondContact CE1-O 3.29Å; Y127-E337 PolarHBondContact OH-O 2.58Å; K256-E337 IonicContact NZ-OE2 2.82Å; K256-E337 PolarHBondContact NZ-OE2 2.99Å; P335-E337 PolarHBondContact O-N 2.88Å; P335-E337 VanDerWaalsContact O-N 3.09Å
338	G	92.9	Very high	94.1	Very high	33 Å²	33	71.6 Å²	71.6	34%	0.34	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-77.6	156.2	171.6	0	0	0	0	0	111.8
339	T	97.7	Very high	93	Very high	8 Å²	8	81 Å²	81	5%	0.049	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-72	140.3	169.5	-61.2	0	0	0	0	110	Y225 F253	Y225-T339 HydrophobicContact CE1-CG2 4.01Å; Y225-T339 WeakPolarHBondContact CE1-O 3.45Å; Y225-T339 HydrophobicContact CE2-CG2 3.82Å; Y225-T339 VanDerWaalsContact CZ-CG2 3.43Å; Y225-T339 WeakPolarHBondContact O-CB 3.44Å; Y225-T339 PolarHBondContact O-N 3Å; Y225-T339 PolarHBondContact O-OG1 3.04Å; Y225-T339 WeakPolarHBondContact OH-CG2 3.1Å; F253-T339 HydrophobicContact CB-CG2 3.82Å; F253-T339 WeakPolarHBondContact O-CG2 3.4Å
340	P	98.1	Very high	92.9	Very high	65 Å²	65	81 Å²	81	42%	0.422	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-63	158	177.4	26.7	-36.3	0	0	0	112.1	Y225 F253	Y225-P340 WeakPolarHBondContact CE1-O 3.45Å; Y225-P340 PolarHBondContact OH-O 3.02Å; F253-P340 HydrophobicContact CB-CG 4.3Å
341	P	98.2	Very high	92.7	Very high	54 Å²	54	83.8 Å²	83.8	35%	0.351	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-51.3	134.9	172.3	-21.5	26.3	0	0	0	111.7	G220 T221 Q343	G220-P341 WeakPolarHBondContact O-CG 3.33Å; T221-P341 HydrophobicContact CG2-CB 4.09Å; T221-P341 HydrophobicContact CG2-CG 3.92Å; P341-Q343 PolarHBondContact O-N 3.37Å
342	P	97.8	Very high	92.6	Very high	1 Å²	1	85.1 Å²	85.1	1%	0.006	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-69.6	134.2	-178.1	28.8	-33.4	0	0	0	110.7	I211 M214 K215 L219 F253	I211-P342 HydrophobicContact CG1-CB 4.31Å; I211-P342 HydrophobicContact CG2-CB 4.13Å; M214-P342 HydrophobicContact CB-CB 4.48Å; M214-P342 HydrophobicContact CB-CG 3.63Å; M214-P342 HydrophobicContact CE-CB 4.21Å; M214-P342 HydrophobicContact CE-CG 4.09Å; M214-P342 HydrophobicContact SD-CB 4.1Å; M214-P342 HydrophobicContact SD-CG 4.16Å; K215-P342 WeakPolarHBondContact CE-O 3.27Å; K215-P342 HydrophobicContact CG-CG 4.35Å; L219-P342 VanDerWaalsContact O-CD 3.25Å; L219-P342 WeakPolarHBondContact O-CD 3.42Å; F253-P342 HydrophobicContact CB-CB 4.49Å; F253-P342 HydrophobicContact CD1-CB 3.78Å; F253-P342 HydrophobicContact CD2-CB 4.23Å; F253-P342 HydrophobicContact CE1-CB 3.99Å; F253-P342 HydrophobicContact CE2-CB 4.45Å; F253-P342 HydrophobicContact CG-CB 3.92Å; F253-P342 HydrophobicContact CZ-CB 4.34Å
343	Q	97.6	Very high	92.8	Very high	131 Å²	131	85.1 Å²	85.1	61%	0.612	44%	0.439	S	S	*	.			trans	-131.8	140.5	177.7	-66.2	-175.4	-6.9	0	0	109.4	P341 P345	P341-Q343 PolarHBondContact O-N 3.37Å; Q343-P345 WeakPolarHBondContact O-CD 3.25Å
344	M	98	Very high	93.1	Very high	51 Å²	51	84.1 Å²	84.1	25%	0.251	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-63.9	121.1	176.5	-174	64.4	-172	0	0	108.8	P204 L207 K208 I211 L248	P204-M344 HydrophobicContact CB-CE 4.28Å; P204-M344 VanDerWaalsContact O-CE 3.29Å; P204-M344 WeakPolarHBondContact O-CE 3.15Å; L207-M344 HydrophobicContact CD2-CE 4.35Å; L207-M344 HydrophobicContact CD2-SD 4.3Å; L207-M344 HydrophobicContact CG-SD 4.18Å; K208-M344 HydrophobicContact CB-CE 4.43Å; K208-M344 HydrophobicContact CB-SD 3.97Å; K208-M344 HydrophobicContact CD-CB 4.14Å; K208-M344 HydrophobicContact CD-CG 4.1Å; K208-M344 HydrophobicContact CD-SD 4.16Å; I211-M344 HydrophobicContact CD1-CB 4.3Å; I211-M344 HydrophobicContact CD1-SD 3.96Å; L248-M344 HydrophobicContact CD1-CE 4.31Å; L248-M344 HydrophobicContact CD2-CE 4.44Å
345	P	96.8	Very high	93.4	Very high	12 Å²	12	83.3 Å²	83.3	8%	0.078	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-67.1	146	177.6	26.7	-33.2	0	0	0	110.8	L207 L248 K249 P251 Q343	L207-P345 HydrophobicContact CD2-CG 3.91Å; L248-P345 HydrophobicContact CB-CG 4.37Å; L248-P345 HydrophobicContact CD1-CG 4.48Å; L248-P345 HydrophobicContact CD2-CG 4.47Å; K249-P345 HydrophobicContact CB-CB 4.25Å; K249-P345 WeakPolarHBondContact O-CB 3.26Å; K249-P345 WeakPolarHBondContact O-CG 3.4Å; P251-P345 HydrophobicContact CB-CG 4.37Å; Q343-P345 WeakPolarHBondContact O-CD 3.25Å
346	H	95.7	Very high	93.7	Very high	141 Å²	141	82 Å²	82	65%	0.653	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-71.8	152.1	170.7	-56.9	-65.9	0	0	0	111.1	K249	K249-H346 PolarHBondContact N-O 2.83Å
347	F	93.6	Very high	93.9	Very high	126 Å²	126	86.3 Å²	86.3	55%	0.553	42%	0.42	S	S	*	.	B	Isolated β-bridge	trans	-59.2	142.4	165	-68.1	-83	0	0	0	110.5	P204 R247 L248	P204-F347 HydrophobicContact CB-CZ 4.4Å; R247-F347 CarbonylContact O-C 3.53Å; R247-F347 VanDerWaalsContact O-CA 3.24Å; R247-F347 WeakPolarHBondContact O-CA 3.49Å; L248-F347 HydrophobicContact CD2-CD1 3.68Å; L248-F347 HydrophobicContact CD2-CD2 4.34Å; L248-F347 HydrophobicContact CD2-CE1 3.71Å; L248-F347 HydrophobicContact CD2-CE2 4.36Å; L248-F347 HydrophobicContact CD2-CG 4.01Å; L248-F347 HydrophobicContact CD2-CZ 4.06Å; L248-F347 HydrophobicContact CG-CD1 4.36Å; L248-F347 HydrophobicContact CG-CE1 4.29Å
348	R	87.8	Confident	94.1	Very high	113 Å²	113	84.4 Å²	84.4	43%	0.426	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-71.8	133.1	166.4	-60.6	-174.3	-167.6	-163.6	3.6	106.8	R247 L248 K249	R247-R348 PolarHBondContact O-N 2.77Å; L248-R348 PolarHBondContact O-NE 3.19Å; L248-R348 PolarHBondContact O-NH2 2.96Å; K249-R348 HydrophobicContact CG-CG 3.87Å
349	K	75.4	Confident	94.2	Very high	278 Å²	278	89.1 Å²	89.1	100%	1.209	42%	0.419	S	S	*	.			trans	-68.6	0	172.7	-71	-171.8	177.2	-174.4	0	110.4

Retrieved 349 of 349 residues in 110.1 ms (Link to these results)

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