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Cell division protein SepF

Cell division protein that is part of the divisome complex and is recruited early to the Z-ring. Probably stimulates Z-ring formation, perhaps through the cross-linking of FtsZ protofilaments. Its function overlaps with FtsA.

AlphaFold DB (Q2FZ86), UniProt , Accession Q99US7, Species STAAM (Staphylococcus aureus (strain Mu50 / ATCC 700699)), Gene sepF, Length 187 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	43.8	Very low	56.7	Low	241 Å²	241	133 Å²	133	100%	1.187	70%	0.696	S	S	*	*				0	125.2	0	-71.6	-151.1	-116.9	0	0	107.6
2	S	47	Very low	57.1	Low	103 Å²	103	127.9 Å²	127.9	72%	0.72	70%	0.699	S	S	*	*			trans	30.6	101.5	172.9	54.6	0	0	0	0	120.1	L4	S2-L4 PolarHBondContact O-N 3.37Å; S2-L4 VanDerWaalsContact O-N 3.16Å
3	H	50.6	Low	57.3	Low	186 Å²	186	125 Å²	125	86%	0.861	68%	0.676	S	S	*	*			trans	-75.3	82.8	158.4	-177.1	-69.1	0	0	0	108.7	A5	H3-A5 PolarHBondContact O-N 2.99Å
4	L	58.8	Low	57.2	Low	145 Å²	145	125.4 Å²	125.4	76%	0.759	67%	0.668	S	S	*	*			trans	-74.6	118.1	168.7	-114.6	77.8	0	0	0	108	S2	S2-L4 PolarHBondContact O-N 3.37Å; S2-L4 VanDerWaalsContact O-N 3.16Å
5	A	61	Low	57.1	Low	31 Å²	31	124.3 Å²	124.3	26%	0.256	67%	0.668	S	S	.	*			trans	-82.5	140.2	-174	0	0	0	0	0	110.4	H3 K7 D8	H3-A5 PolarHBondContact O-N 2.99Å; A5-K7 HydrophobicContact CB-CB 4.3Å; A5-K7 HydrophobicContact CB-CD 4.1Å; A5-K7 HydrophobicContact CB-CG 3.94Å; A5-K7 PolarHBondContact O-N 3.44Å; A5-D8 PolarHBondContact O-N 3.12Å
6	L	61.3	Low	57	Low	142 Å²	142	124 Å²	124	74%	0.743	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-43.5	-10.8	166.7	-109.2	140.6	0	0	0	116	D8	L6-D8 VanDerWaalsContact C-N 3.34Å
7	K	55.4	Low	57.1	Low	169 Å²	169	125.9 Å²	125.9	74%	0.735	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-29.7	-177.5	-55.4	179.9	-177.3	-174.6	0	112.2	A5 S11	A5-K7 HydrophobicContact CB-CB 4.3Å; A5-K7 HydrophobicContact CB-CD 4.1Å; A5-K7 HydrophobicContact CB-CG 3.94Å; A5-K7 PolarHBondContact O-N 3.44Å; K7-S11 PolarHBondContact O-OG 2.79Å
8	D	64	Low	57.5	Low	117 Å²	117	126 Å²	126	63%	0.626	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-15.7	-174.3	-61.8	-25.6	0	0	0	113.2	A5 L6 S11	A5-D8 PolarHBondContact O-N 3.12Å; L6-D8 VanDerWaalsContact C-N 3.34Å; D8-S11 PolarHBondContact O-OG 3.31Å
9	L	62.2	Low	57.6	Low	137 Å²	137	128.5 Å²	128.5	72%	0.717	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-27.3	-179.3	-161.7	75.7	0	0	0	113
10	F	60.6	Low	57.7	Low	114 Å²	114	132.5 Å²	132.5	50%	0.5	70%	0.697	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.8	-11.7	-173.2	-79.8	-82.8	0	0	0	114.6	G12 F13 F14	F10-G12 VanDerWaalsContact C-N 3.26Å; F10-G12 PolarHBondContact O-N 3.36Å; F10-F13 PolarHBondContact O-N 3.16Å; F10-F14 HydrophobicContact CD1-CE2 4.2Å
11	S	58.8	Low	57.7	Low	78 Å²	78	134.5 Å²	134.5	55%	0.545	70%	0.702	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.3	-24.8	179.6	26.9	0	0	0	0	113.9	K7 D8	K7-S11 PolarHBondContact O-OG 2.79Å; D8-S11 PolarHBondContact O-OG 3.31Å
12	G	61.9	Low	58.6	Low	72 Å²	72	128.9 Å²	128.9	74%	0.742	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-11.3	180	0	0	0	0	0	115.6	F10	F10-G12 VanDerWaalsContact C-N 3.26Å; F10-G12 PolarHBondContact O-N 3.36Å
13	F	60	Low	59.1	Low	90 Å²	90	132.8 Å²	132.8	40%	0.395	69%	0.688	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.4	-15.5	-173.6	-166.1	-104.3	0	0	0	114	F10 K137	F10-F13 PolarHBondContact O-N 3.16Å; F13-K137 HydrophobicContact CE1-CG 4.41Å; F13-K137 HydrophobicContact CZ-CG 4.17Å
14	F	55.1	Low	60	Low	130 Å²	130	130.8 Å²	130.8	57%	0.57	69%	0.689	S	S	*	*			trans	-105.6	14.7	-176.8	-81.4	-85.8	0	0	0	114.3	F10 I16	F10-F14 HydrophobicContact CD1-CE2 4.2Å; F14-I16 PolarHBondContact O-N 3.26Å
15	V	56	Low	60.4	Low	110 Å²	110	129.8 Å²	129.8	67%	0.667	69%	0.691	S	S	*	*			trans	-69.8	93.2	164.9	-174.6	0	0	0	0	107	D17	V15-D17 PolarHBondContact O-N 2.74Å
16	I	55.5	Low	59.9	Low	119 Å²	119	136.1 Å²	136.1	61%	0.61	72%	0.721	S	S	*	*			trans	-67.2	114.3	162.4	-68.9	160.4	0	0	0	104.3	F14 D18	F14-I16 PolarHBondContact O-N 3.26Å; I16-D18 PolarHBondContact O-N 3.49Å
17	D	59.1	Low	59.7	Low	156 Å²	156	138.7 Å²	138.7	83%	0.834	73%	0.726	S	S	*	*			trans	-61.2	91.6	161.3	-76.7	-37.2	0	0	0	106.7	V15 E19	V15-D17 PolarHBondContact O-N 2.74Å; D17-E19 PolarHBondContact O-N 3.24Å
18	D	64.5	Low	59.5	Low	128 Å²	128	138.5 Å²	138.5	68%	0.684	73%	0.728	S	S	*	*			trans	-67.3	110.3	166	-78	-34.4	0	0	0	107.6	I16	I16-D18 PolarHBondContact O-N 3.49Å
19	E	58.3	Low	58.9	Low	174 Å²	174	141.2 Å²	141.2	81%	0.813	74%	0.737	S	S	*	*			trans	55.6	94.5	142.6	-54.8	-175.5	166.5	0	0	118.1	D17	D17-E19 PolarHBondContact O-N 3.24Å
20	E	59.7	Low	58.5	Low	207 Å²	207	143 Å²	143	97%	0.967	74%	0.741	S	S	*	*			trans	-103.4	92	145.3	-81.3	-166.6	168.4	0	0	109.7
21	E	58.1	Low	58.1	Low	175 Å²	175	143 Å²	143	82%	0.818	75%	0.75	S	S	*	*			trans	-75.2	141.1	154.7	-149.2	174	-157.9	0	0	107.3
22	V	61.7	Low	57.7	Low	123 Å²	123	145.3 Å²	145.3	75%	0.745	76%	0.757	S	S	*	*			trans	159.2	114.7	140.4	166.6	0	0	0	0	114
23	E	58.3	Low	57.4	Low	185 Å²	185	150.6 Å²	150.6	86%	0.864	76%	0.762	S	S	*	*			trans	66.9	110.4	144	-70.3	176.4	169.9	0	0	123.5
24	V	70.1	Confident	57.6	Low	144 Å²	144	151 Å²	151	87%	0.873	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-100.3	131.1	157.8	-110.8	0	0	0	0	110.2
25	P	65.8	Low	57.2	Low	125 Å²	125	150.6 Å²	150.6	81%	0.812	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-87.9	134.7	178.5	31.6	-30.5	0	0	0	113.4
26	D	50.7	Low	57.2	Low	164 Å²	164	149.7 Å²	149.7	88%	0.877	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-65.2	137.5	176.4	-87.1	-41.6	0	0	0	114.5
27	K	58	Low	57.3	Low	195 Å²	195	154.2 Å²	154.2	85%	0.848	81%	0.812	S	S	*	*			trans	-139.4	100.4	155.4	-76.9	-166.2	178.8	-177.4	0	112.9
28	Q	50.1	Low	56.8	Low	166 Å²	166	156 Å²	156	78%	0.776	82%	0.815	S	S	*	*			trans	45.4	109.4	132.6	-65.6	172.5	-7.8	0	0	119
29	Q	51.8	Low	56.4	Low	174 Å²	174	159.1 Å²	159.1	81%	0.813	83%	0.825	S	S	*	*				65.3	119.9	93.6	-81.6	173.7	-2.2	0	0	113.6
30	Q	54.4	Low	55.9	Low	174 Å²	174	155.5 Å²	155.5	81%	0.813	82%	0.82	S	S	*	*			cis	-163	155.3	48.9	-88.2	157.2	12.4	0	0	107.4
31	V	51.8	Low	55.9	Low	114 Å²	114	153.1 Å²	153.1	69%	0.691	81%	0.808	S	S	*	*				174.5	124.6	86.6	167.6	0	0	0	0	109.3
32	N	51.4	Low	55.8	Low	126 Å²	126	152.3 Å²	152.3	67%	0.674	80%	0.804	S	S	*	*			trans	66.5	114.3	145.4	-52.1	-2	0	0	0	122.9
33	E	55.5	Low	54.8	Low	184 Å²	184	152.3 Å²	152.3	86%	0.86	81%	0.805	S	S	*	*				75.7	128.7	102.9	-70.2	176.5	135.5	0	0	114.1
34	A	63.2	Low	54.4	Low	97 Å²	97	149.1 Å²	149.1	80%	0.802	80%	0.798	S	S	*	*			cis	-164	173.8	23	0	0	0	0	0	109.9
35	P	46.7	Very low	53.9	Low	123 Å²	123	150.2 Å²	150.2	80%	0.799	79%	0.791	S	S	*	*			trans	-108.6	170.5	-152.6	40.4	-34	0	0	0	117.7
36	A	55.8	Low	53.8	Low	91 Å²	91	151.8 Å²	151.8	75%	0.752	79%	0.788	S	S	*	*			trans	81.9	117.1	145.9	0	0	0	0	0	120.9
37	K	58.5	Low	53.9	Low	214 Å²	214	152.2 Å²	152.2	93%	0.93	79%	0.79	S	S	*	*				-164.5	104.4	123.2	-102.1	171.7	-169.8	-175.5	0	111.2
38	E	49.2	Very low	54	Low	194 Å²	194	146.7 Å²	146.7	91%	0.907	78%	0.781	S	S	*	*			trans	-67.9	132.5	158.5	-80.8	173.6	132.6	0	0	110.1
39	Q	55.1	Low	54.3	Low	192 Å²	192	146.7 Å²	146.7	90%	0.897	78%	0.784	S	S	*	*			trans	-138.2	99	149.5	-100.2	179.8	2.7	0	0	109.2
40	S	48.1	Very low	54.8	Low	99 Å²	99	147.7 Å²	147.7	69%	0.692	79%	0.786	S	S	*	*			trans	-52.5	141	155.5	45.7	0	0	0	0	112.6
41	Q	59.3	Low	55.1	Low	157 Å²	157	144.2 Å²	144.2	73%	0.734	78%	0.781	S	S	*	*			trans	-177.7	129.1	130.5	-98	162.3	61	0	0	114.4
42	Q	56.7	Low	55.7	Low	157 Å²	157	145.6 Å²	145.6	73%	0.734	79%	0.789	S	S	*	*			trans	69.8	103.4	141.5	-62.4	165.8	21	0	0	117.6
43	T	41	Very low	56.5	Low	124 Å²	124	145.1 Å²	145.1	76%	0.761	79%	0.793	S	S	*	*				50.6	103.7	64.9	-36.9	0	0	0	0	114.9
44	T	49	Very low	56.7	Low	117 Å²	117	145.9 Å²	145.9	72%	0.718	80%	0.796	S	S	*	*				165.7	113.9	124.8	28.5	0	0	0	0	110.5
45	K	59	Low	56.5	Low	167 Å²	167	151.2 Å²	151.2	73%	0.726	80%	0.802	S	S	*	*				76	121.3	102	-74.5	-175.8	-179.5	-179.6	0	115.7
46	Q	63.3	Low	56.9	Low	159 Å²	159	150.8 Å²	150.8	74%	0.743	80%	0.802	S	S	*	*			trans	74.2	115.3	138.4	-63	166.5	11.5	0	0	117.2
47	N	54.5	Low	56.8	Low	172 Å²	172	151.4 Å²	151.4	92%	0.92	81%	0.807	S	S	*	*				-144.9	116.2	127.9	-94.3	-32.8	0	0	0	111.1
48	A	58.5	Low	56.7	Low	79 Å²	79	145.2 Å²	145.2	65%	0.653	79%	0.791	S	S	*	*			trans	-72.5	132.5	175.3	0	0	0	0	0	110.9
49	I	57.4	Low	56.6	Low	167 Å²	167	146.8 Å²	146.8	86%	0.856	79%	0.788	S	S	*	*				24.8	101.7	129	-48.3	169.7	0	0	0	114.5
50	K	62.8	Low	56.8	Low	195 Å²	195	147.8 Å²	147.8	85%	0.848	79%	0.785	S	S	*	*			trans	-112.8	106.1	162.5	-86.2	-176.9	177	179	0	110.6
51	S	59.9	Low	56.9	Low	100 Å²	100	148.6 Å²	148.6	70%	0.699	79%	0.786	S	S	*	*			trans	49	104.2	134.4	61	0	0	0	0	119
52	V	65.6	Low	56.7	Low	143 Å²	143	147 Å²	147	87%	0.867	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-96.1	126.8	152.5	-179.3	0	0	0	0	108.5
53	P	66.5	Low	56.4	Low	117 Å²	117	144.7 Å²	144.7	76%	0.76	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-77.8	139.9	176.8	-9.1	25.5	0	0	0	112.8
54	Q	60.4	Low	56.9	Low	199 Å²	199	144 Å²	144	93%	0.93	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-66.3	132.3	173.7	-65.3	176.6	-50.6	0	0	111.5
55	K	59.1	Low	57.4	Low	209 Å²	209	147.1 Å²	147.1	91%	0.909	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-103.3	119	168.2	-147.7	175.3	-173.1	-179.1	0	109.7
56	S	54.7	Low	57.2	Low	115 Å²	115	148 Å²	148	80%	0.804	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-64	133.4	179.9	31.4	0	0	0	0	113
57	A	54.4	Low	56.7	Low	104 Å²	104	151.8 Å²	151.8	86%	0.86	81%	0.805	S	S	*	*			trans	-91.2	110.8	164.2	0	0	0	0	0	108.7
58	S	56.5	Low	56.8	Low	84 Å²	84	149.7 Å²	149.7	59%	0.587	79%	0.794	S	S	*	*			trans	-94.5	117.4	169	-166	0	0	0	0	109.3	Y60	S58-Y60 WeakPolarHBondContact OG-CE2 3.35Å; S58-Y60 VanDerWaalsContact OG-CZ 3.31Å; S58-Y60 PolarHBondContact OG-OH 3.33Å
59	R	47.5	Very low	56.9	Low	227 Å²	227	151 Å²	151	86%	0.857	79%	0.79	S	S	*	*			trans	-102.6	111	175.5	-167.9	-177.8	-64.2	160.8	-0.2	106.6
60	Y	58.1	Low	56.8	Low	212 Å²	212	152.7 Å²	152.7	83%	0.831	79%	0.785	S	S	*	*			trans	-100.7	108.8	171.5	-68.2	-76.9	0	0	0	109.8	S58	S58-Y60 WeakPolarHBondContact OG-CE2 3.35Å; S58-Y60 VanDerWaalsContact OG-CZ 3.31Å; S58-Y60 PolarHBondContact OG-OH 3.33Å
61	T	50.4	Low	56.5	Low	117 Å²	117	151.4 Å²	151.4	72%	0.718	78%	0.784	S	S	*	*			trans	-94.5	140.1	151.3	49.1	0	0	0	0	107.1
62	T	55.2	Low	55.9	Low	122 Å²	122	151 Å²	151	75%	0.748	78%	0.781	S	S	*	*			trans	171.9	115.6	147.8	-80.8	0	0	0	0	112
63	T	51.6	Low	55.4	Low	109 Å²	109	151.4 Å²	151.4	67%	0.669	78%	0.779	S	S	*	*			trans	56	120.9	138	69.7	0	0	0	0	120.8
64	S	51.3	Low	54.5	Low	109 Å²	109	157 Å²	157	76%	0.762	79%	0.786	S	S	*	*				78.2	96.5	87	-48.8	0	0	0	0	113.8
65	E	58.4	Low	54.1	Low	184 Å²	184	153.2 Å²	153.2	86%	0.86	78%	0.782	S	S	*	*			trans	-150.5	101.1	154.9	-67.5	-169.3	159.4	0	0	106.6
66	E	55.8	Low	53.8	Low	184 Å²	184	152.1 Å²	152.1	86%	0.86	78%	0.777	S	S	*	*				47	99.6	91.8	-76.3	-171	149.1	0	0	114.4
67	R	52.1	Low	53.7	Low	239 Å²	239	153.7 Å²	153.7	90%	0.902	78%	0.776	S	S	*	*			trans	-175.4	102.7	139	-98.4	153.8	-169.5	-168.1	6.7	109.4
68	N	57.2	Low	53.9	Low	129 Å²	129	155.5 Å²	155.5	69%	0.69	77%	0.771	S	S	*	*				100.9	133.8	72.6	-160.3	11.8	0	0	0	110.7
69	N	61	Low	54	Low	106 Å²	106	155 Å²	155	57%	0.567	77%	0.768	S	S	*	*			trans	70.9	138.8	160.1	-69.1	-35.7	0	0	0	117.4
70	R	55	Low	54.5	Low	203 Å²	203	154.2 Å²	154.2	77%	0.766	77%	0.765	S	S	*	*			cis	-168.2	138.9	10.3	-109.5	157.9	-169.2	-168	-3.3	108.5
71	M	55.8	Low	54.7	Low	168 Å²	168	152.5 Å²	152.5	83%	0.828	77%	0.77	S	S	*	*			trans	59.7	110.2	131.8	-143.5	138.7	66.8	0	0	120.3
72	S	46.7	Very low	55.5	Low	90 Å²	90	152.2 Å²	152.2	63%	0.629	77%	0.768	S	S	*	*			trans	19	123.8	130.5	174.9	0	0	0	0	117.4
73	N	55.2	Low	56.3	Low	152 Å²	152	151.9 Å²	151.9	81%	0.813	77%	0.766	S	S	*	*				-167.2	120.4	114.6	-86.7	-19.8	0	0	0	112.3
74	Y	48.9	Very low	57.2	Low	236 Å²	236	152.1 Å²	152.1	93%	0.925	77%	0.767	S	S	*	*			trans	-54.9	126.1	156.2	-100.9	-106.9	0	0	0	109.6
75	S	50.4	Low	57.8	Low	119 Å²	119	154.2 Å²	154.2	83%	0.832	77%	0.767	S	S	*	*			trans	-154.6	100.4	151	-165.3	0	0	0	0	110.8
76	K	53.3	Low	58.2	Low	185 Å²	185	152 Å²	152	80%	0.804	76%	0.761	S	S	*	*			trans	-74.1	109.2	163.8	-176.1	-176.2	-166.2	175.9	0	106.5
77	N	53.8	Low	58.4	Low	149 Å²	149	150.4 Å²	150.4	80%	0.797	76%	0.758	S	S	*	*			trans	168.1	135.1	139.5	-92.2	-24.4	0	0	0	113.5
78	N	57.3	Low	58.6	Low	141 Å²	141	143 Å²	143	75%	0.754	75%	0.749	S	S	*	*			trans	86.7	114	140.4	-138.2	15	0	0	0	119.4
79	S	59.2	Low	58.7	Low	75 Å²	75	142.3 Å²	142.3	52%	0.524	75%	0.749	S	S	.	*			trans	58	98.8	137.1	63.9	0	0	0	0	116.8
80	R	58	Low	58.5	Low	210 Å²	210	141.7 Å²	141.7	79%	0.792	75%	0.751	S	S	*	*				179.4	97.3	129.2	-98.3	163.8	-77.5	139.7	-10.3	109.4	V82	R80-V82 HydrophobicContact CB-CG1 4.19Å; R80-V82 HydrophobicContact CG-CG1 4.4Å; R80-V82 PolarHBondContact O-N 3.37Å
81	N	61.6	Low	58.6	Low	175 Å²	175	138.4 Å²	138.4	94%	0.936	75%	0.748	S	S	*	*			trans	-66.9	90.7	155	-79.1	-15.9	0	0	0	106.8
82	V	68.4	Low	58.7	Low	111 Å²	111	138.3 Å²	138.3	67%	0.673	75%	0.751	S	S	*	*			trans	-105.9	113.7	168.5	-77.2	0	0	0	0	107.5	R80	R80-V82 HydrophobicContact CB-CG1 4.19Å; R80-V82 HydrophobicContact CG-CG1 4.4Å; R80-V82 PolarHBondContact O-N 3.37Å
83	V	70.5	Confident	59.2	Low	115 Å²	115	137.7 Å²	137.7	70%	0.697	75%	0.752	S	S	*	*			trans	-90.2	113.5	173.1	-175.7	0	0	0	0	107.1	M85	V83-M85 HydrophobicContact CB-SD 4.31Å; V83-M85 HydrophobicContact CG1-CE 3.83Å; V83-M85 HydrophobicContact CG1-SD 3.6Å; V83-M85 PolarHBondContact O-N 3.11Å
84	T	71.1	Confident	59.1	Low	115 Å²	115	135 Å²	135	71%	0.706	74%	0.744	S	S	*	*			trans	-82	100.4	169.5	-59.1	0	0	0	0	108.2	N86	T84-N86 WeakPolarHBondContact CG2-OD1 3.02Å; T84-N86 PolarHBondContact O-N 3.23Å; T84-N86 VanDerWaalsContact O-N 3.12Å
85	M	64.2	Low	59.6	Low	152 Å²	152	133.1 Å²	133.1	75%	0.749	74%	0.744	S	S	*	*			trans	-75	89.5	164.5	-92.9	84.6	-169.7	0	0	108.9	V83 N87	V83-M85 HydrophobicContact CB-SD 4.31Å; V83-M85 HydrophobicContact CG1-CE 3.83Å; V83-M85 HydrophobicContact CG1-SD 3.6Å; V83-M85 PolarHBondContact O-N 3.11Å; M85-N87 PolarHBondContact O-N 3.35Å
86	N	65.8	Low	60.4	Low	138 Å²	138	135.7 Å²	135.7	74%	0.738	74%	0.743	S	S	*	*			trans	-81.4	101.4	158.2	-87	22	0	0	0	107.5	T84 A88	T84-N86 WeakPolarHBondContact CG2-OD1 3.02Å; T84-N86 PolarHBondContact O-N 3.23Å; T84-N86 VanDerWaalsContact O-N 3.12Å; N86-A88 PolarHBondContact O-N 2.83Å
87	N	59.9	Low	61.3	Low	150 Å²	150	131 Å²	131	80%	0.802	73%	0.734	S	S	*	*			trans	-60	83	162.3	-94.2	30	0	0	0	108.9	M85 T89	M85-N87 PolarHBondContact O-N 3.35Å; N87-T89 PolarHBondContact O-N 3.45Å
88	A	57.5	Low	62.5	Low	85 Å²	85	129.8 Å²	129.8	70%	0.702	74%	0.737	S	S	*	*			trans	-77.8	100.3	161.1	0	0	0	0	0	107.1	N86 P90	N86-A88 PolarHBondContact O-N 2.83Å; A88-P90 WeakPolarHBondContact O-CD 3.04Å
89	T	59.2	Low	63.8	Low	113 Å²	113	129.9 Å²	129.9	69%	0.693	73%	0.731	S	S	*	*			trans	-89.3	92	153.6	25.2	0	0	0	0	108.1	N87 N91	N87-T89 PolarHBondContact O-N 3.45Å; T89-N91 PolarHBondContact O-N 3.01Å
90	P	56	Low	65.4	Low	93 Å²	93	131.1 Å²	131.1	60%	0.604	73%	0.729	S	S	*	*			trans	-89.3	51.8	163.1	39	-34.2	0	0	0	109	A88 N92	A88-P90 WeakPolarHBondContact O-CD 3.04Å; P90-N92 PolarHBondContact O-N 3.4Å
91	N	58.3	Low	67.3	Low	134 Å²	134	122.4 Å²	122.4	72%	0.717	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	12.8	-177.9	-78	11.2	0	0	0	113.6	T89	T89-N91 PolarHBondContact O-N 3.01Å
92	N	57.5	Low	69	Low	166 Å²	166	120.4 Å²	120.4	89%	0.888	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.9	28.1	179.4	-74.8	-39.5	0	0	0	113	P90 S94	P90-N92 PolarHBondContact O-N 3.4Å; N92-S94 PolarHBondContact O-N 2.81Å
93	A	56.5	Low	70.5	Confident	77 Å²	77	117.4 Å²	117.4	64%	0.636	67%	0.667	S	S	*	*	S	Bend	trans	-85.7	95.7	168.4	0	0	0	0	0	108.6
94	S	54.7	Low	71.8	Confident	95 Å²	95	116 Å²	116	66%	0.664	65%	0.653	S	S	*	*			trans	51.7	83.3	160.6	55.8	0	0	0	0	115.7	N92 E96	N92-S94 PolarHBondContact O-N 2.81Å; S94-E96 PolarHBondContact O-N 3.27Å
95	Q	59.4	Low	73	Confident	197 Å²	197	110.7 Å²	110.7	92%	0.921	62%	0.62	S	S	*	*			trans	-61.7	89.6	146.8	-165.5	173.4	3.6	0	0	105.6	S97	Q95-S97 PolarHBondContact O-N 2.91Å
96	E	66.4	Low	74.6	Confident	173 Å²	173	111.6 Å²	111.6	81%	0.808	62%	0.615	S	S	*	*			trans	-56.9	94.7	172.8	-105.9	179.8	170.4	0	0	106.3	S94 S98	S94-E96 PolarHBondContact O-N 3.27Å; E96-S98 PolarHBondContact O-N 3.09Å
97	S	72.2	Confident	76	Confident	87 Å²	87	108.5 Å²	108.5	61%	0.608	60%	0.601	S	S	*	*			trans	-63.3	112.8	174.8	47	0	0	0	0	106.6	Q95 K99	Q95-S97 PolarHBondContact O-N 2.91Å; S97-K99 PolarHBondContact O-N 3.02Å
98	S	78.6	Confident	77.8	Confident	123 Å²	123	104.7 Å²	104.7	86%	0.86	58%	0.578	S	S	*	*			trans	-59.3	106.8	173.8	-51.8	0	0	0	0	107.8	E96	E96-S98 PolarHBondContact O-N 3.09Å
99	K	85.5	Confident	79.7	Confident	144 Å²	144	103.9 Å²	103.9	63%	0.626	57%	0.567	S	S	*	*			trans	-87.7	135.7	178	-69.3	179	-176.7	176	0	109.1	S97 R122	S97-K99 PolarHBondContact O-N 3.02Å; K99-R122 HydrophobicContact CB-CG 4.34Å
100	M	93.3	Very high	81.6	Confident	100 Å²	100	100.5 Å²	100.5	49%	0.493	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137	172.5	179.7	171.3	175.6	0	0	108.7	A123 L125 L163	M100-A123 CarbonylContact C-O 3.57Å; M100-A123 VanDerWaalsContact CA-O 3.31Å; M100-A123 WeakPolarHBondContact CA-O 3.46Å; M100-A123 HydrophobicContact CG-CB 4.31Å; M100-L125 HydrophobicContact CE-CB 3.67Å; M100-L125 HydrophobicContact CE-CD1 4.16Å; M100-L125 HydrophobicContact CE-CG 4.38Å; M100-L163 HydrophobicContact CE-CD1 3.78Å
101	C	96.8	Very high	83.5	Confident	28 Å²	28	96.2 Å²	96.2	19%	0.189	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	143.8	-177.4	-59	0	0	0	0	110.4	F103 E117 A123 T124 L125	C101-F103 HydrophobicContact CB-CD2 4.33Å; C101-F103 HydrophobicContact CB-CE2 3.69Å; C101-E117 HydrophobicContact CB-CG 4.36Å; C101-E117 PolarHBondContact SG-OE2 3.06Å; C101-A123 PolarHBondContact N-O 3.49Å; C101-T124 HydrophobicContact CB-CG2 4.22Å; C101-T124 CarbonylContact O-C 3.51Å; C101-T124 VanDerWaalsContact O-CA 3.23Å; C101-T124 WeakPolarHBondContact O-CA 3.18Å; C101-L125 PolarHBondContact O-N 3.04Å
102	L	98	Very high	85.4	Confident	133 Å²	133	96 Å²	96	70%	0.696	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	132.2	179.7	-57.2	174.6	0	0	0	108.6	L125	L102-L125 HydrophobicContact CD2-CB 3.57Å; L102-L125 HydrophobicContact CD2-CD2 3.87Å; L102-L125 HydrophobicContact CD2-CG 4.38Å
103	F	98.4	Very high	87.4	Confident	48 Å²	48	92.6 Å²	92.6	21%	0.211	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	137.1	-180	-72.3	-91.3	0	0	0	110.5	C101 P105 D113 I114 E117 T124 L125 V126 N127	C101-F103 HydrophobicContact CB-CD2 4.33Å; C101-F103 HydrophobicContact CB-CE2 3.69Å; F103-P105 HydrophobicContact CB-CG 4.47Å; F103-D113 HydrophobicContact CE1-CB 3.98Å; F103-D113 HydrophobicContact CZ-CB 4.49Å; F103-I114 HydrophobicContact CB-CD1 4Å; F103-I114 HydrophobicContact CB-CG1 3.98Å; F103-I114 HydrophobicContact CD1-CD1 4.26Å; F103-I114 HydrophobicContact CD1-CG1 3.54Å; F103-I114 HydrophobicContact CD2-CG1 3.74Å; F103-I114 HydrophobicContact CE1-CG1 3.85Å; F103-I114 HydrophobicContact CE2-CG1 4.02Å; F103-I114 HydrophobicContact CG-CD1 4.07Å; F103-I114 HydrophobicContact CG-CG1 3.47Å; F103-I114 VanDerWaalsContact CG-CG1 3.47Å; F103-I114 HydrophobicContact CZ-CG1 4.07Å; F103-E117 HydrophobicContact CE2-CB 4.38Å; F103-E117 HydrophobicContact CE2-CG 3.78Å; F103-E117 HydrophobicContact CZ-CB 4.5Å; F103-E117 HydrophobicContact CZ-CG 3.53Å; F103-T124 HydrophobicContact CD2-CG2 4.3Å; F103-T124 HydrophobicContact CE2-CG2 3.88Å; F103-L125 PolarHBondContact N-O 3.34Å; F103-V126 WeakPolarHBondContact O-CA 3.17Å; F103-N127 PolarHBondContact O-N 3.46Å
104	E	98	Very high	89.4	Confident	86 Å²	86	88.9 Å²	88.9	40%	0.402	46%	0.463	S	S	.	.			trans	-125.8	77.3	168	-171.7	-179	-172.3	0	0	107.9	N127 R130	E104-N127 HydrophobicContact CG-CB 4.43Å; E104-R130 VanDerWaalsContact OE1-CD 3.32Å; E104-R130 WeakPolarHBondContact OE1-CD 3.47Å; E104-R130 WeakPolarHBondContact OE1-CG 3.49Å; E104-R130 IonicContact OE1-CZ 3.52Å; E104-R130 IonicContact OE1-NE 3.32Å; E104-R130 PolarHBondContact OE1-NE 3.36Å; E104-R130 IonicContact OE1-NH2 3.56Å
105	P	97.8	Very high	91.5	Very high	2 Å²	2	84.8 Å²	84.8	1%	0.013	44%	0.435	C	S	.	.			trans	-54.8	149.3	-178	-28.5	38.6	0	0	0	112.4	F103 D110 I114 V126 N127 L128 I131 I139	F103-P105 HydrophobicContact CB-CG 4.47Å; P105-D110 WeakPolarHBondContact CA-OD2 3.08Å; P105-D110 HydrophobicContact CB-CB 3.98Å; P105-D110 HydrophobicContact CG-CB 4.46Å; P105-I114 HydrophobicContact CG-CD1 3.83Å; P105-V126 HydrophobicContact CG-CG1 3.82Å; P105-N127 WeakPolarHBondContact CD-O 3.41Å; P105-L128 HydrophobicContact CG-CD2 4.18Å; P105-I131 HydrophobicContact CB-CD1 4.31Å; P105-I131 HydrophobicContact CB-CG1 4.46Å; P105-I131 VanDerWaalsContact O-CD1 3.23Å; P105-I131 WeakPolarHBondContact O-CD1 3.49Å; P105-I131 WeakPolarHBondContact O-CG1 3.32Å; P105-I139 HydrophobicContact CB-CD1 4.21Å
106	R	96.3	Very high	93.3	Very high	171 Å²	171	78.8 Å²	78.8	65%	0.645	41%	0.409	S	S	*	.	S	Bend	trans	-118.2	-20.3	169.8	-66.1	-169	177.9	-162.4	1.3	112.9	D110 I131	R106-D110 PolarHBondContact N-OD2 3.5Å; R106-I131 VanDerWaalsContact CA-CD1 3.43Å; R106-I131 WeakPolarHBondContact O-CD1 3.48Å
107	V	96.8	Very high	94.8	Very high	74 Å²	74	72.6 Å²	72.6	45%	0.448	38%	0.38	S	S	.	.	S	Bend	trans	-139.4	157.5	179.7	-67.9	0	0	0	0	110.1	S109 D110	V107-S109 WeakPolarHBondContact CG2-OG 3.15Å; V107-S109 PolarHBondContact O-N 2.81Å; V107-D110 VanDerWaalsContact CG2-OD1 3.27Å; V107-D110 WeakPolarHBondContact CG2-OD1 3.4Å; V107-D110 PolarHBondContact N-OD2 3.12Å; V107-D110 VanDerWaalsContact N-OD2 3.15Å; V107-D110 WeakPolarHBondContact O-CB 3.38Å; V107-D110 PolarHBondContact O-N 3.47Å
108	F	97.8	Very high	96	Very high	69 Å²	69	68.5 Å²	68.5	30%	0.303	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-59	-30.7	-179.6	179.3	-96.9	0	0	0	113.4	D110 T111 R138 I139 F142	F108-D110 PolarHBondContact O-N 3.19Å; F108-T111 WeakPolarHBondContact O-CB 3.39Å; F108-T111 VanDerWaalsContact O-CG2 3.27Å; F108-T111 WeakPolarHBondContact O-CG2 3.42Å; F108-T111 PolarHBondContact O-N 3.05Å; F108-T111 PolarHBondContact O-OG1 3.24Å; F108-R138 HydrophobicContact CD2-CB 3.91Å; F108-R138 HydrophobicContact CE2-CB 3.87Å; F108-R138 WeakPolarHBondContact CE2-O 3.49Å; F108-I139 HydrophobicContact CD2-CG1 3.97Å; F108-F142 HydrophobicContact CE2-CB 4.06Å; F108-F142 HydrophobicContact CZ-CB 4.08Å; F108-F142 HydrophobicContact CZ-CD2 4.05Å; F108-F142 HydrophobicContact CZ-CG 4.23Å
109	S	97.4	Very high	96.9	Very high	68 Å²	68	68.8 Å²	68.8	48%	0.476	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-63.9	-23.5	-179.2	49.3	0	0	0	0	114.1	V107 T111 Q112	V107-S109 WeakPolarHBondContact CG2-OG 3.15Å; V107-S109 PolarHBondContact O-N 2.81Å; S109-T111 PolarHBondContact O-N 2.78Å; S109-T111 VanDerWaalsContact O-N 3.1Å; S109-Q112 PolarHBondContact O-N 3.12Å; S109-Q112 VanDerWaalsContact O-N 3.15Å
110	D	97.5	Very high	97.4	Very high	43 Å²	43	66.4 Å²	66.4	23%	0.23	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-63.4	-17.9	179.1	-57.5	-19.2	0	0	0	112	P105 R106 V107 F108 Q112 D113 I114	P105-D110 WeakPolarHBondContact CA-OD2 3.08Å; P105-D110 HydrophobicContact CB-CB 3.98Å; P105-D110 HydrophobicContact CG-CB 4.46Å; R106-D110 PolarHBondContact N-OD2 3.5Å; V107-D110 VanDerWaalsContact CG2-OD1 3.27Å; V107-D110 WeakPolarHBondContact CG2-OD1 3.4Å; V107-D110 PolarHBondContact N-OD2 3.12Å; V107-D110 VanDerWaalsContact N-OD2 3.15Å; V107-D110 WeakPolarHBondContact O-CB 3.38Å; V107-D110 PolarHBondContact O-N 3.47Å; F108-D110 PolarHBondContact O-N 3.19Å; D110-Q112 PolarHBondContact O-N 3.36Å; D110-D113 PolarHBondContact O-N 3.33Å; D110-I114 PolarHBondContact O-N 3.3Å
111	T	97.6	Very high	97.5	Very high	2 Å²	2	68.8 Å²	68.8	1%	0.012	33%	0.334	C	S	.	.	H	α-helix	trans	-60.4	-24.5	174.9	56.7	0	0	0	0	113.9	F108 S109 A115 I139 F142	F108-T111 WeakPolarHBondContact O-CB 3.39Å; F108-T111 VanDerWaalsContact O-CG2 3.27Å; F108-T111 WeakPolarHBondContact O-CG2 3.42Å; F108-T111 PolarHBondContact O-N 3.05Å; F108-T111 PolarHBondContact O-OG1 3.24Å; S109-T111 PolarHBondContact O-N 2.78Å; S109-T111 VanDerWaalsContact O-N 3.1Å; T111-A115 WeakPolarHBondContact O-CB 3.25Å; T111-A115 PolarHBondContact O-N 2.87Å; T111-I139 HydrophobicContact CG2-CB 4.03Å; T111-I139 HydrophobicContact CG2-CG1 3.72Å; T111-I139 HydrophobicContact CG2-CG2 3.71Å; T111-F142 VanDerWaalsContact CB-CD1 3.41Å; T111-F142 HydrophobicContact CG2-CD1 4.07Å
112	Q	98	Very high	97.4	Very high	129 Å²	129	70.3 Å²	70.3	60%	0.603	34%	0.336	S	S	*	.	H	α-helix	trans	-66.6	-44.7	177.2	-64.9	-176.4	-7.6	0	0	111.6	S109 D110 I114 A115 D116	S109-Q112 PolarHBondContact O-N 3.12Å; S109-Q112 VanDerWaalsContact O-N 3.15Å; D110-Q112 PolarHBondContact O-N 3.36Å; Q112-I114 VanDerWaalsContact C-N 3.33Å; Q112-I114 PolarHBondContact O-N 3.47Å; Q112-A115 WeakPolarHBondContact O-CB 3.44Å; Q112-A115 PolarHBondContact O-N 3.38Å; Q112-D116 PolarHBondContact O-N 3.08Å
113	D	98.3	Very high	97.4	Very high	95 Å²	95	64.4 Å²	64.4	51%	0.508	31%	0.306	S	S	.	.	H	α-helix	trans	-63.2	-43.1	178.1	-64.9	-27.4	0	0	0	110.4	F103 D110 A115 D116 E117	F103-D113 HydrophobicContact CE1-CB 3.98Å; F103-D113 HydrophobicContact CZ-CB 4.49Å; D110-D113 PolarHBondContact O-N 3.33Å; D113-A115 VanDerWaalsContact C-N 3.33Å; D113-A115 PolarHBondContact O-N 3.3Å; D113-D116 PolarHBondContact O-N 2.86Å; D113-E117 WeakPolarHBondContact O-CG 3.46Å; D113-E117 PolarHBondContact O-N 3.27Å
114	I	98.4	Very high	97.4	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58.7	-45.4	175	-61	165.4	0	0	0	110.7	F103 P105 D110 Q112 D116 E117 L118 T124 V126 L143	F103-I114 HydrophobicContact CB-CD1 4Å; F103-I114 HydrophobicContact CB-CG1 3.98Å; F103-I114 HydrophobicContact CD1-CD1 4.26Å; F103-I114 HydrophobicContact CD1-CG1 3.54Å; F103-I114 HydrophobicContact CD2-CG1 3.74Å; F103-I114 HydrophobicContact CE1-CG1 3.85Å; F103-I114 HydrophobicContact CE2-CG1 4.02Å; F103-I114 HydrophobicContact CG-CD1 4.07Å; F103-I114 HydrophobicContact CG-CG1 3.47Å; F103-I114 VanDerWaalsContact CG-CG1 3.47Å; F103-I114 HydrophobicContact CZ-CG1 4.07Å; P105-I114 HydrophobicContact CG-CD1 3.83Å; D110-I114 PolarHBondContact O-N 3.3Å; Q112-I114 VanDerWaalsContact C-N 3.33Å; Q112-I114 PolarHBondContact O-N 3.47Å; I114-D116 VanDerWaalsContact C-N 3.32Å; I114-D116 PolarHBondContact O-N 2.97Å; I114-E117 PolarHBondContact O-N 3.19Å; I114-L118 HydrophobicContact CG2-CD1 4.13Å; I114-L118 WeakPolarHBondContact O-CG 3.36Å; I114-L118 PolarHBondContact O-N 3.13Å; I114-L118 VanDerWaalsContact O-N 3.07Å; I114-T124 HydrophobicContact CG2-CG2 4.29Å; I114-V126 HydrophobicContact CD1-CG1 3.95Å; I114-V126 HydrophobicContact CD1-CG2 3.94Å; I114-V126 HydrophobicContact CG2-CG2 4.07Å; I114-L143 HydrophobicContact CB-CD2 3.98Å; I114-L143 HydrophobicContact CD1-CD1 4.41Å; I114-L143 HydrophobicContact CG2-CD1 4.34Å; I114-L143 HydrophobicContact CG2-CD2 3.52Å
115	A	98.4	Very high	97.4	Very high	9 Å²	9	60.4 Å²	60.4	7%	0.074	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-37.3	178.5	0	0	0	0	0	112.7	T111 Q112 D113 L118 K119 F142 T146	T111-A115 WeakPolarHBondContact O-CB 3.25Å; T111-A115 PolarHBondContact O-N 2.87Å; Q112-A115 WeakPolarHBondContact O-CB 3.44Å; Q112-A115 PolarHBondContact O-N 3.38Å; D113-A115 VanDerWaalsContact C-N 3.33Å; D113-A115 PolarHBondContact O-N 3.3Å; A115-L118 PolarHBondContact O-N 2.7Å; A115-K119 WeakPolarHBondContact O-CB 3.38Å; A115-K119 WeakPolarHBondContact O-CD 3.49Å; A115-K119 WeakPolarHBondContact O-CG 3.35Å; A115-K119 PolarHBondContact O-N 2.82Å; A115-F142 HydrophobicContact CB-CE1 4.14Å; A115-T146 HydrophobicContact CB-CG2 3.68Å
116	D	98	Very high	97.4	Very high	71 Å²	71	60.3 Å²	60.3	38%	0.38	29%	0.289	S	S	.	.	H	α-helix	trans	-68.8	-37.2	176.6	-80.1	-22.8	0	0	0	112.3	Q112 D113 I114 K119 N120	Q112-D116 PolarHBondContact O-N 3.08Å; D113-D116 PolarHBondContact O-N 2.86Å; I114-D116 VanDerWaalsContact C-N 3.32Å; I114-D116 PolarHBondContact O-N 2.97Å; D116-K119 PolarHBondContact O-N 2.85Å; D116-K119 IonicContact OD1-NZ 3.99Å; D116-K119 PolarHBondContact OD1-NZ 3.17Å; D116-N120 WeakPolarHBondContact O-CB 3.24Å; D116-N120 VanDerWaalsContact O-CG 3.28Å; D116-N120 PolarHBondContact O-N 3.47Å; D116-N120 PolarHBondContact O-ND2 3.39Å
117	E	97.9	Very high	97.5	Very high	43 Å²	43	53.7 Å²	53.7	20%	0.201	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-44.9	172	-63.7	-57.9	110.4	0	0	111.9	C101 F103 D113 I114 N120 R121 R122 T124	C101-E117 HydrophobicContact CB-CG 4.36Å; C101-E117 PolarHBondContact SG-OE2 3.06Å; F103-E117 HydrophobicContact CE2-CB 4.38Å; F103-E117 HydrophobicContact CE2-CG 3.78Å; F103-E117 HydrophobicContact CZ-CB 4.5Å; F103-E117 HydrophobicContact CZ-CG 3.53Å; D113-E117 WeakPolarHBondContact O-CG 3.46Å; D113-E117 PolarHBondContact O-N 3.27Å; I114-E117 PolarHBondContact O-N 3.19Å; E117-N120 CarbonylContact O-C 3.59Å; E117-N120 PolarHBondContact O-N 2.72Å; E117-N120 VanDerWaalsContact O-N 3.13Å; E117-R121 PolarHBondContact O-N 2.88Å; E117-R122 PolarHBondContact O-N 2.8Å; E117-R122 VanDerWaalsContact O-N 3.17Å; E117-R122 IonicContact OE1-CZ 3.7Å; E117-R122 IonicContact OE1-NH2 3.78Å; E117-R122 PolarHBondContact OE1-NH2 2.94Å; E117-R122 IonicContact OE2-CZ 3.01Å; E117-R122 IonicContact OE2-NE 2.72Å; E117-R122 PolarHBondContact OE2-NE 2.87Å; E117-R122 IonicContact OE2-NH2 3.4Å; E117-R122 PolarHBondContact OE2-NH2 3.12Å; E117-T124 HydrophobicContact CB-CG2 3.64Å; E117-T124 HydrophobicContact CG-CG2 4.47Å
118	L	97.6	Very high	97.6	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-61.7	-45.6	177.6	-70.9	168.1	0	0	0	111.8	I114 A115 N120 R121 T124 T146 V147 I150 C164	I114-L118 HydrophobicContact CG2-CD1 4.13Å; I114-L118 WeakPolarHBondContact O-CG 3.36Å; I114-L118 PolarHBondContact O-N 3.13Å; I114-L118 VanDerWaalsContact O-N 3.07Å; A115-L118 PolarHBondContact O-N 2.7Å; L118-N120 PolarHBondContact O-N 3.32Å; L118-R121 PolarHBondContact O-N 2.84Å; L118-T124 HydrophobicContact CD2-CG2 4.23Å; L118-T124 HydrophobicContact CG-CG2 4.17Å; L118-T146 HydrophobicContact CD1-CG2 4.25Å; L118-V147 HydrophobicContact CD1-CG1 3.98Å; L118-I150 HydrophobicContact CB-CD1 3.84Å; L118-C164 HydrophobicContact CD1-CB 3.89Å; L118-C164 HydrophobicContact CD2-CB 3.73Å; L118-C164 HydrophobicContact CG-CB 4.39Å
119	K	96.6	Very high	97.5	Very high	128 Å²	128	52.9 Å²	52.9	56%	0.557	26%	0.259	S	S	*	.	H	α-helix	trans	-60.5	-31.3	174.8	-76.5	161.9	56	-158.9	0	112.8	A115 D116 R121 I150	A115-K119 WeakPolarHBondContact O-CB 3.38Å; A115-K119 WeakPolarHBondContact O-CD 3.49Å; A115-K119 WeakPolarHBondContact O-CG 3.35Å; A115-K119 PolarHBondContact O-N 2.82Å; D116-K119 PolarHBondContact O-N 2.85Å; D116-K119 IonicContact OD1-NZ 3.99Å; D116-K119 PolarHBondContact OD1-NZ 3.17Å; K119-R121 PolarHBondContact O-N 3.34Å; K119-I150 HydrophobicContact CG-CG2 4.36Å
120	N	96	Very high	97.4	Very high	95 Å²	95	57 Å²	57	51%	0.508	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	20.6	174.8	-67.5	-55.5	0	0	0	113.3	D116 E117 L118 R122	D116-N120 WeakPolarHBondContact O-CB 3.24Å; D116-N120 VanDerWaalsContact O-CG 3.28Å; D116-N120 PolarHBondContact O-N 3.47Å; D116-N120 PolarHBondContact O-ND2 3.39Å; E117-N120 CarbonylContact O-C 3.59Å; E117-N120 PolarHBondContact O-N 2.72Å; E117-N120 VanDerWaalsContact O-N 3.13Å; L118-N120 PolarHBondContact O-N 3.32Å; N120-R122 VanDerWaalsContact C-N 3.3Å; N120-R122 PolarHBondContact O-N 2.84Å
121	R	95.4	Very high	97.4	Very high	149 Å²	149	56 Å²	56	56%	0.562	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	31.1	173.2	-67.8	-173.8	166.6	-142.8	-18.2	114.2	E117 L118 K119 D167 N168	E117-R121 PolarHBondContact O-N 2.88Å; L118-R121 PolarHBondContact O-N 2.84Å; K119-R121 PolarHBondContact O-N 3.34Å; R121-D167 IonicContact CZ-OD1 3.07Å; R121-D167 IonicContact CZ-OD2 3.39Å; R121-D167 IonicContact NE-OD1 2.78Å; R121-D167 IonicContact NH2-OD1 3.78Å; R121-D167 PolarHBondContact NH2-OD1 3.07Å; R121-D167 IonicContact NH2-OD2 2.77Å; R121-D167 PolarHBondContact NH2-OD2 3.27Å; R121-N168 WeakPolarHBondContact CA-OD1 3.27Å; R121-N168 WeakPolarHBondContact CB-OD1 3.45Å; R121-N168 WeakPolarHBondContact CG-OD1 3.44Å; R121-N168 PolarHBondContact O-ND2 2.83Å; R121-N168 PolarHBondContact O-OD1 2.68Å
122	R	96.4	Very high	97.3	Very high	61 Å²	61	60.2 Å²	60.2	23%	0.23	28%	0.281	C	S	.	.			trans	-110.9	132.9	174	-63.6	-172.1	-68.4	-82	4.6	110.7	K99 E117 N120	K99-R122 HydrophobicContact CB-CG 4.34Å; E117-R122 PolarHBondContact O-N 2.8Å; E117-R122 VanDerWaalsContact O-N 3.17Å; E117-R122 IonicContact OE1-CZ 3.7Å; E117-R122 IonicContact OE1-NH2 3.78Å; E117-R122 PolarHBondContact OE1-NH2 2.94Å; E117-R122 IonicContact OE2-CZ 3.01Å; E117-R122 IonicContact OE2-NE 2.72Å; E117-R122 PolarHBondContact OE2-NE 2.87Å; E117-R122 IonicContact OE2-NH2 3.4Å; E117-R122 PolarHBondContact OE2-NH2 3.12Å; N120-R122 VanDerWaalsContact C-N 3.3Å; N120-R122 PolarHBondContact O-N 2.84Å
123	A	97.3	Very high	97.2	Very high	8 Å²	8	63.4 Å²	63.4	7%	0.066	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	147.8	172.1	0	0	0	0	0	110.4	M100 C101 C164 T165 V169	M100-A123 CarbonylContact C-O 3.57Å; M100-A123 VanDerWaalsContact CA-O 3.31Å; M100-A123 WeakPolarHBondContact CA-O 3.46Å; M100-A123 HydrophobicContact CG-CB 4.31Å; C101-A123 PolarHBondContact N-O 3.49Å; A123-C164 WeakPolarHBondContact CA-O 3.38Å; A123-T165 HydrophobicContact CB-CG2 4.09Å; A123-V169 HydrophobicContact CB-CG1 4.34Å; A123-V169 HydrophobicContact CB-CG2 4.33Å
124	T	98.1	Very high	97.1	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	130.3	-178.7	65.1	0	0	0	0	111.6	C101 F103 I114 E117 L118 C164	C101-T124 HydrophobicContact CB-CG2 4.22Å; C101-T124 CarbonylContact O-C 3.51Å; C101-T124 VanDerWaalsContact O-CA 3.23Å; C101-T124 WeakPolarHBondContact O-CA 3.18Å; F103-T124 HydrophobicContact CD2-CG2 4.3Å; F103-T124 HydrophobicContact CE2-CG2 3.88Å; I114-T124 HydrophobicContact CG2-CG2 4.29Å; E117-T124 HydrophobicContact CB-CG2 3.64Å; E117-T124 HydrophobicContact CG-CG2 4.47Å; L118-T124 HydrophobicContact CD2-CG2 4.23Å; L118-T124 HydrophobicContact CG-CG2 4.17Å; T124-C164 PolarHBondContact N-O 3.24Å; T124-C164 PolarHBondContact O-N 3.1Å; T124-C164 WeakPolarHBondContact OG1-CB 3.45Å
125	L	98.2	Very high	97	Very high	50 Å²	50	65.4 Å²	65.4	26%	0.262	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	129	166.6	-160.6	72.6	0	0	0	109.2	M100 C101 L102 F103 V157 I161 F162 L163	M100-L125 HydrophobicContact CE-CB 3.67Å; M100-L125 HydrophobicContact CE-CD1 4.16Å; M100-L125 HydrophobicContact CE-CG 4.38Å; C101-L125 PolarHBondContact O-N 3.04Å; L102-L125 HydrophobicContact CD2-CB 3.57Å; L102-L125 HydrophobicContact CD2-CD2 3.87Å; L102-L125 HydrophobicContact CD2-CG 4.38Å; F103-L125 PolarHBondContact N-O 3.34Å; L125-V157 HydrophobicContact CD1-CG2 3.92Å; L125-I161 HydrophobicContact CD1-CG2 3.84Å; L125-I161 HydrophobicContact CD2-CG2 4.12Å; L125-I161 HydrophobicContact CG-CG2 3.81Å; L125-F162 CarbonylContact C-O 3.6Å; L125-F162 WeakPolarHBondContact CA-O 3.35Å; L125-L163 HydrophobicContact CD1-CB 4.22Å; L125-L163 HydrophobicContact CD1-CD1 4.43Å
126	V	98.5	Very high	97	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	115.8	-175.5	-172	0	0	0	0	108.8	F103 P105 I114 L128 L143 I161 F162	F103-V126 WeakPolarHBondContact O-CA 3.17Å; P105-V126 HydrophobicContact CG-CG1 3.82Å; I114-V126 HydrophobicContact CD1-CG1 3.95Å; I114-V126 HydrophobicContact CD1-CG2 3.94Å; I114-V126 HydrophobicContact CG2-CG2 4.07Å; V126-L128 HydrophobicContact CG1-CD2 3.63Å; V126-L128 HydrophobicContact CG1-CG 4.17Å; V126-L143 HydrophobicContact CG1-CD1 4.35Å; V126-L143 HydrophobicContact CG2-CD1 4.05Å; V126-I161 WeakPolarHBondContact O-CA 3.41Å; V126-F162 PolarHBondContact N-O 3.03Å; V126-F162 PolarHBondContact O-N 3.42Å
127	N	98.2	Very high	96.9	Very high	33 Å²	33	66.5 Å²	66.5	18%	0.176	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	114.7	174.4	-176.6	2.4	0	0	0	110.1	F103 E104 P105 Q129	F103-N127 PolarHBondContact O-N 3.46Å; E104-N127 HydrophobicContact CG-CB 4.43Å; P105-N127 WeakPolarHBondContact CD-O 3.41Å; N127-Q129 PolarHBondContact ND2-OE1 2.96Å; N127-Q129 VanDerWaalsContact OD1-CB 3.27Å; N127-Q129 WeakPolarHBondContact OD1-CB 3.31Å; N127-Q129 WeakPolarHBondContact OD1-CG 3.09Å; N127-Q129 PolarHBondContact OD1-N 3.08Å; N127-Q129 PolarHBondContact OD1-OE1 3.47Å
128	L	97.9	Very high	96.9	Very high	2 Å²	2	71 Å²	71	1%	0.01	33%	0.326	C	S	.	.			trans	-100.4	9.6	-177.8	-56.3	179.8	0	0	0	113.3	P105 V126 R130 I131 A136 I139 I140 D160 F162	P105-L128 HydrophobicContact CG-CD2 4.18Å; V126-L128 HydrophobicContact CG1-CD2 3.63Å; V126-L128 HydrophobicContact CG1-CG 4.17Å; L128-R130 PolarHBondContact O-N 2.77Å; L128-I131 HydrophobicContact CD2-CG1 4.32Å; L128-I131 WeakPolarHBondContact O-CB 3.39Å; L128-I131 PolarHBondContact O-N 2.86Å; L128-A136 HydrophobicContact CB-CB 4.39Å; L128-A136 HydrophobicContact CD1-CB 4.23Å; L128-I139 HydrophobicContact CD1-CG2 4.28Å; L128-I139 HydrophobicContact CD2-CB 4.38Å; L128-I139 HydrophobicContact CD2-CD1 4Å; L128-I139 HydrophobicContact CD2-CG2 3.77Å; L128-I140 HydrophobicContact CD1-CD1 4.01Å; L128-I140 HydrophobicContact CD1-CG1 3.74Å; L128-D160 HydrophobicContact CB-CB 4.16Å; L128-D160 WeakPolarHBondContact CB-O 3.42Å; L128-D160 PolarHBondContact N-O 2.78Å; L128-F162 HydrophobicContact CD1-CD2 3.78Å; L128-F162 HydrophobicContact CD1-CE2 3.84Å; L128-F162 HydrophobicContact CG-CD2 4.34Å
129	Q	96.4	Very high	96.9	Very high	123 Å²	123	70.9 Å²	70.9	58%	0.575	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-22.3	-178.6	-77.8	174.3	-24.7	0	0	115	N127 D160	N127-Q129 PolarHBondContact ND2-OE1 2.96Å; N127-Q129 VanDerWaalsContact OD1-CB 3.27Å; N127-Q129 WeakPolarHBondContact OD1-CB 3.31Å; N127-Q129 WeakPolarHBondContact OD1-CG 3.09Å; N127-Q129 PolarHBondContact OD1-N 3.08Å; N127-Q129 PolarHBondContact OD1-OE1 3.47Å; Q129-D160 HydrophobicContact CG-CB 3.99Å
130	R	95.2	Very high	97	Very high	155 Å²	155	65.9 Å²	65.9	59%	0.585	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	8.6	179.1	-59.9	-162.7	-167.4	-142.7	4.4	114.2	E104 L128	E104-R130 VanDerWaalsContact OE1-CD 3.32Å; E104-R130 WeakPolarHBondContact OE1-CD 3.47Å; E104-R130 WeakPolarHBondContact OE1-CG 3.49Å; E104-R130 IonicContact OE1-CZ 3.52Å; E104-R130 IonicContact OE1-NE 3.32Å; E104-R130 PolarHBondContact OE1-NE 3.36Å; E104-R130 IonicContact OE1-NH2 3.56Å; L128-R130 PolarHBondContact O-N 2.77Å
131	I	96.7	Very high	97.1	Very high	21 Å²	21	65.2 Å²	65.2	11%	0.108	30%	0.301	C	S	.	.	S	Bend	trans	-107.2	139.5	-179.9	-60.1	-66.8	0	0	0	108.6	P105 R106 L128 A136 I139	P105-I131 HydrophobicContact CB-CD1 4.31Å; P105-I131 HydrophobicContact CB-CG1 4.46Å; P105-I131 VanDerWaalsContact O-CD1 3.23Å; P105-I131 WeakPolarHBondContact O-CD1 3.49Å; P105-I131 WeakPolarHBondContact O-CG1 3.32Å; R106-I131 VanDerWaalsContact CA-CD1 3.43Å; R106-I131 WeakPolarHBondContact O-CD1 3.48Å; L128-I131 HydrophobicContact CD2-CG1 4.32Å; L128-I131 WeakPolarHBondContact O-CB 3.39Å; L128-I131 PolarHBondContact O-N 2.86Å; I131-A136 HydrophobicContact CB-CB 4.32Å; I131-A136 HydrophobicContact CG2-CB 3.89Å; I131-I139 HydrophobicContact CD1-CD1 4.14Å; I131-I139 HydrophobicContact CG1-CD1 4.05Å; I131-I139 HydrophobicContact CG2-CD1 4.08Å
132	D	96.1	Very high	97.3	Very high	91 Å²	91	61.6 Å²	61.6	49%	0.487	29%	0.289	S	S	.	.			trans	-65.1	152.5	172.9	67.4	-84	0	0	0	111.5	V134 S135 A136	D132-V134 PolarHBondContact O-N 2.82Å; D132-V134 WeakPolarHBondContact OD2-CB 3.41Å; D132-V134 PolarHBondContact OD2-N 3.36Å; D132-S135 PolarHBondContact O-N 2.88Å; D132-S135 VanDerWaalsContact O-N 3.11Å; D132-S135 WeakPolarHBondContact OD1-CB 3.47Å; D132-S135 PolarHBondContact OD1-OG 3.43Å; D132-S135 PolarHBondContact OD2-N 2.89Å; D132-S135 PolarHBondContact OD2-OG 3.47Å; D132-A136 WeakPolarHBondContact O-CB 3.3Å; D132-A136 PolarHBondContact O-N 3.27Å
133	K	94.8	Very high	97.4	Very high	196 Å²	196	58.8 Å²	58.8	85%	0.852	28%	0.279	S	S	*	.	H	α-helix	trans	-53	-36.9	-174.6	-65.4	-175.6	178.8	-177.7	0	113.5	K137	K133-K137 PolarHBondContact O-N 3.45Å; K133-K137 VanDerWaalsContact O-N 3.1Å
134	V	96.6	Very high	97.4	Very high	105 Å²	105	60.2 Å²	60.2	64%	0.636	29%	0.288	S	S	*	.	H	α-helix	trans	-70.5	-48.4	-179	-179.5	0	0	0	0	110.6	D132 A136 K137 R138	D132-V134 PolarHBondContact O-N 2.82Å; D132-V134 WeakPolarHBondContact OD2-CB 3.41Å; D132-V134 PolarHBondContact OD2-N 3.36Å; V134-A136 VanDerWaalsContact C-N 3.34Å; V134-K137 PolarHBondContact O-N 2.92Å; V134-R138 WeakPolarHBondContact O-CG 3.39Å; V134-R138 PolarHBondContact O-N 3.47Å
135	S	96.9	Very high	97.4	Very high	32 Å²	32	62.2 Å²	62.2	22%	0.224	31%	0.309	C	S	.	.	H	α-helix	trans	-65.6	-36.2	176	-63.3	0	0	0	0	112.3	D132 R138 I139	D132-S135 PolarHBondContact O-N 2.88Å; D132-S135 VanDerWaalsContact O-N 3.11Å; D132-S135 WeakPolarHBondContact OD1-CB 3.47Å; D132-S135 PolarHBondContact OD1-OG 3.43Å; D132-S135 PolarHBondContact OD2-N 2.89Å; D132-S135 PolarHBondContact OD2-OG 3.47Å; S135-R138 WeakPolarHBondContact O-CB 3.41Å; S135-R138 PolarHBondContact O-N 2.98Å; S135-I139 WeakPolarHBondContact O-CG1 3.47Å; S135-I139 PolarHBondContact O-N 3.42Å
136	A	97.5	Very high	97.4	Very high	8 Å²	8	60.9 Å²	60.9	7%	0.066	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-46.2	178.7	0	0	0	0	0	110.5	L128 I131 D132 V134 R138 I139 I140	L128-A136 HydrophobicContact CB-CB 4.39Å; L128-A136 HydrophobicContact CD1-CB 4.23Å; I131-A136 HydrophobicContact CB-CB 4.32Å; I131-A136 HydrophobicContact CG2-CB 3.89Å; D132-A136 WeakPolarHBondContact O-CB 3.3Å; D132-A136 PolarHBondContact O-N 3.27Å; V134-A136 VanDerWaalsContact C-N 3.34Å; A136-R138 VanDerWaalsContact C-N 3.33Å; A136-R138 PolarHBondContact O-N 3.21Å; A136-I139 WeakPolarHBondContact O-CB 3.39Å; A136-I139 PolarHBondContact O-N 3.41Å; A136-I139 VanDerWaalsContact O-N 3.16Å; A136-I140 VanDerWaalsContact O-CG1 3.3Å; A136-I140 WeakPolarHBondContact O-CG1 3.23Å; A136-I140 PolarHBondContact O-N 3.2Å
137	K	96.9	Very high	97.4	Very high	96 Å²	96	61.1 Å²	61.1	42%	0.417	30%	0.304	S	S	.	.	H	α-helix	trans	-55.4	-47.3	172.5	-178.9	171.1	-177.8	169.7	0	111.8	F13 K133 V134 I139 I140 D141	F13-K137 HydrophobicContact CE1-CG 4.41Å; F13-K137 HydrophobicContact CZ-CG 4.17Å; K133-K137 PolarHBondContact O-N 3.45Å; K133-K137 VanDerWaalsContact O-N 3.1Å; V134-K137 PolarHBondContact O-N 2.92Å; K137-I139 VanDerWaalsContact C-N 3.32Å; K137-I139 PolarHBondContact O-N 3.03Å; K137-I140 PolarHBondContact O-N 2.96Å; K137-D141 VanDerWaalsContact O-CG 3.26Å; K137-D141 PolarHBondContact O-N 3.42Å
138	R	98	Very high	97.4	Very high	136 Å²	136	69.1 Å²	69.1	51%	0.513	33%	0.333	S	S	.	.	H	α-helix	trans	-60	-41.5	177.2	-68	178.6	66.8	-175.3	0.5	112.5	F108 V134 S135 A136 D141 F142	F108-R138 HydrophobicContact CD2-CB 3.91Å; F108-R138 HydrophobicContact CE2-CB 3.87Å; F108-R138 WeakPolarHBondContact CE2-O 3.49Å; V134-R138 WeakPolarHBondContact O-CG 3.39Å; V134-R138 PolarHBondContact O-N 3.47Å; S135-R138 WeakPolarHBondContact O-CB 3.41Å; S135-R138 PolarHBondContact O-N 2.98Å; A136-R138 VanDerWaalsContact C-N 3.33Å; A136-R138 PolarHBondContact O-N 3.21Å; R138-D141 PolarHBondContact O-N 2.98Å; R138-F142 WeakPolarHBondContact O-CB 3.48Å; R138-F142 PolarHBondContact O-N 3.07Å
139	I	98.3	Very high	97.5	Very high	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-61.8	-46.9	176.3	-70.9	172.6	0	0	0	110.3	P105 F108 T111 L128 I131 S135 A136 K137 D141 F142 L143	P105-I139 HydrophobicContact CB-CD1 4.21Å; F108-I139 HydrophobicContact CD2-CG1 3.97Å; T111-I139 HydrophobicContact CG2-CB 4.03Å; T111-I139 HydrophobicContact CG2-CG1 3.72Å; T111-I139 HydrophobicContact CG2-CG2 3.71Å; L128-I139 HydrophobicContact CD1-CG2 4.28Å; L128-I139 HydrophobicContact CD2-CB 4.38Å; L128-I139 HydrophobicContact CD2-CD1 4Å; L128-I139 HydrophobicContact CD2-CG2 3.77Å; I131-I139 HydrophobicContact CD1-CD1 4.14Å; I131-I139 HydrophobicContact CG1-CD1 4.05Å; I131-I139 HydrophobicContact CG2-CD1 4.08Å; S135-I139 WeakPolarHBondContact O-CG1 3.47Å; S135-I139 PolarHBondContact O-N 3.42Å; A136-I139 WeakPolarHBondContact O-CB 3.39Å; A136-I139 PolarHBondContact O-N 3.41Å; A136-I139 VanDerWaalsContact O-N 3.16Å; K137-I139 VanDerWaalsContact C-N 3.32Å; K137-I139 PolarHBondContact O-N 3.03Å; I139-D141 PolarHBondContact O-N 2.77Å; I139-F142 PolarHBondContact O-N 3.28Å; I139-L143 HydrophobicContact CG2-CD1 3.84Å; I139-L143 HydrophobicContact CG2-CG 4.32Å; I139-L143 WeakPolarHBondContact O-CG 3.37Å; I139-L143 PolarHBondContact O-N 2.63Å
140	I	97.9	Very high	97.5	Very high	22 Å²	22	69.4 Å²	69.4	11%	0.113	35%	0.35	C	S	.	.	H	α-helix	trans	-61.2	-44.3	178.2	-64.7	159.9	0	0	0	110.7	L128 A136 K137 F142 L143 S144 F162	L128-I140 HydrophobicContact CD1-CD1 4.01Å; L128-I140 HydrophobicContact CD1-CG1 3.74Å; A136-I140 VanDerWaalsContact O-CG1 3.3Å; A136-I140 WeakPolarHBondContact O-CG1 3.23Å; A136-I140 PolarHBondContact O-N 3.2Å; K137-I140 PolarHBondContact O-N 2.96Å; I140-F142 VanDerWaalsContact C-N 3.34Å; I140-F142 PolarHBondContact O-N 2.78Å; I140-L143 PolarHBondContact O-N 3.01Å; I140-S144 VanDerWaalsContact O-CB 3.24Å; I140-S144 WeakPolarHBondContact O-CB 3.49Å; I140-S144 PolarHBondContact O-N 3.04Å; I140-S144 PolarHBondContact O-OG 3.04Å; I140-F162 HydrophobicContact CD1-CD2 4.42Å; I140-F162 HydrophobicContact CD1-CE1 3.97Å; I140-F162 HydrophobicContact CD1-CE2 3.59Å; I140-F162 HydrophobicContact CD1-CZ 3.32Å; I140-F162 HydrophobicContact CG1-CD2 4.32Å; I140-F162 HydrophobicContact CG1-CE1 4.16Å; I140-F162 HydrophobicContact CG1-CE2 3.97Å; I140-F162 HydrophobicContact CG1-CZ 3.89Å; I140-F162 HydrophobicContact CG2-CE1 4.45Å
141	D	98.1	Very high	97.6	Very high	81 Å²	81	64.7 Å²	64.7	43%	0.433	35%	0.349	S	S	.	.	H	α-helix	trans	-60.2	-43.7	177.5	-68.1	-24.5	0	0	0	111.5	K137 R138 I139 G145	K137-D141 VanDerWaalsContact O-CG 3.26Å; K137-D141 PolarHBondContact O-N 3.42Å; R138-D141 PolarHBondContact O-N 2.98Å; I139-D141 PolarHBondContact O-N 2.77Å; D141-G145 PolarHBondContact O-N 3.3Å
142	F	98.5	Very high	97.7	Very high	74 Å²	74	64.6 Å²	64.6	33%	0.325	35%	0.354	S	S	.	.	H	α-helix	trans	-64.7	-46.4	177.8	179.5	-86.5	0	0	0	112.2	F108 T111 A115 R138 I139 I140 G145 T146	F108-F142 HydrophobicContact CE2-CB 4.06Å; F108-F142 HydrophobicContact CZ-CB 4.08Å; F108-F142 HydrophobicContact CZ-CD2 4.05Å; F108-F142 HydrophobicContact CZ-CG 4.23Å; T111-F142 VanDerWaalsContact CB-CD1 3.41Å; T111-F142 HydrophobicContact CG2-CD1 4.07Å; A115-F142 HydrophobicContact CB-CE1 4.14Å; R138-F142 WeakPolarHBondContact O-CB 3.48Å; R138-F142 PolarHBondContact O-N 3.07Å; I139-F142 PolarHBondContact O-N 3.28Å; I140-F142 VanDerWaalsContact C-N 3.34Å; I140-F142 PolarHBondContact O-N 2.78Å; F142-G145 PolarHBondContact O-N 3.28Å; F142-T146 PolarHBondContact O-N 2.89Å; F142-T146 PolarHBondContact O-OG1 2.73Å
143	L	98.5	Very high	97.7	Very high	2 Å²	2	63.8 Å²	63.8	1%	0.01	35%	0.349	C	S	.	.	H	α-helix	trans	-67.5	-37.8	179.3	-67.7	178.5	0	0	0	111.4	I114 V126 I139 I140 G145 T146 V147 I154	I114-L143 HydrophobicContact CB-CD2 3.98Å; I114-L143 HydrophobicContact CD1-CD1 4.41Å; I114-L143 HydrophobicContact CG2-CD1 4.34Å; I114-L143 HydrophobicContact CG2-CD2 3.52Å; V126-L143 HydrophobicContact CG1-CD1 4.35Å; V126-L143 HydrophobicContact CG2-CD1 4.05Å; I139-L143 HydrophobicContact CG2-CD1 3.84Å; I139-L143 HydrophobicContact CG2-CG 4.32Å; I139-L143 WeakPolarHBondContact O-CG 3.37Å; I139-L143 PolarHBondContact O-N 2.63Å; I140-L143 PolarHBondContact O-N 3.01Å; L143-G145 VanDerWaalsContact C-N 3.34Å; L143-G145 PolarHBondContact O-N 2.78Å; L143-T146 WeakPolarHBondContact O-CA 3.46Å; L143-T146 WeakPolarHBondContact O-CB 3.27Å; L143-T146 PolarHBondContact O-N 3.35Å; L143-T146 VanDerWaalsContact O-N 3.08Å; L143-V147 WeakPolarHBondContact O-CG2 3.48Å; L143-V147 PolarHBondContact O-N 3.07Å; L143-I154 HydrophobicContact CB-CD1 4.01Å
144	S	98.3	Very high	97.9	Very high	38 Å²	38	56 Å²	56	27%	0.266	32%	0.317	S	S	.	.	H	α-helix	trans	-59.1	-44.6	173.6	-60.2	0	0	0	0	111.4	I140 T146 V147 Y148	I140-S144 VanDerWaalsContact O-CB 3.24Å; I140-S144 WeakPolarHBondContact O-CB 3.49Å; I140-S144 PolarHBondContact O-N 3.04Å; I140-S144 PolarHBondContact O-OG 3.04Å; S144-T146 VanDerWaalsContact C-N 3.32Å; S144-T146 PolarHBondContact O-N 2.81Å; S144-V147 WeakPolarHBondContact O-CG2 3.35Å; S144-Y148 VanDerWaalsContact O-CB 3.25Å; S144-Y148 WeakPolarHBondContact O-CB 3.4Å; S144-Y148 PolarHBondContact O-N 2.79Å; S144-Y148 VanDerWaalsContact O-N 3.08Å
145	G	98.3	Very high	97.8	Very high	42 Å²	42	53.4 Å²	53.4	43%	0.433	30%	0.298	S	S	.	.	H	α-helix	trans	-63.6	-36.8	173	0	0	0	0	0	113.2	D141 F142 L143 A149	D141-G145 PolarHBondContact O-N 3.3Å; F142-G145 PolarHBondContact O-N 3.28Å; L143-G145 VanDerWaalsContact C-N 3.34Å; L143-G145 PolarHBondContact O-N 2.78Å; G145-A149 WeakPolarHBondContact O-CB 3.35Å; G145-A149 PolarHBondContact O-N 3.18Å; G145-A149 VanDerWaalsContact O-N 3.12Å
146	T	98.5	Very high	97.7	Very high	21 Å²	21	56.4 Å²	56.4	13%	0.129	30%	0.304	C	S	.	.	H	α-helix	trans	-67	-51.4	179	-59	0	0	0	0	111.8	A115 L118 F142 L143 S144 Y148 A149 I150	A115-T146 HydrophobicContact CB-CG2 3.68Å; L118-T146 HydrophobicContact CD1-CG2 4.25Å; F142-T146 PolarHBondContact O-N 2.89Å; F142-T146 PolarHBondContact O-OG1 2.73Å; L143-T146 WeakPolarHBondContact O-CA 3.46Å; L143-T146 WeakPolarHBondContact O-CB 3.27Å; L143-T146 PolarHBondContact O-N 3.35Å; L143-T146 VanDerWaalsContact O-N 3.08Å; S144-T146 VanDerWaalsContact C-N 3.32Å; S144-T146 PolarHBondContact O-N 2.81Å; T146-Y148 VanDerWaalsContact C-N 3.33Å; T146-Y148 PolarHBondContact O-N 2.87Å; T146-A149 PolarHBondContact O-N 3.22Å; T146-I150 PolarHBondContact O-N 3.39Å
147	V	98.4	Very high	97.6	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.03	31%	0.312	C	S	.	.	H	α-helix	trans	-64.7	-39.3	179.9	-61.5	0	0	0	0	111.1	L118 L143 S144 A149 I150 G151 G152 I154 C164	L118-V147 HydrophobicContact CD1-CG1 3.98Å; L143-V147 WeakPolarHBondContact O-CG2 3.48Å; L143-V147 PolarHBondContact O-N 3.07Å; S144-V147 WeakPolarHBondContact O-CG2 3.35Å; V147-A149 VanDerWaalsContact C-N 3.3Å; V147-A149 PolarHBondContact O-N 3.4Å; V147-I150 WeakPolarHBondContact O-CG1 3.38Å; V147-I150 PolarHBondContact O-N 3.2Å; V147-G151 PolarHBondContact O-N 3.38Å; V147-G151 VanDerWaalsContact O-N 3.11Å; V147-G152 PolarHBondContact O-N 2.91Å; V147-I154 HydrophobicContact CG2-CB 3.92Å; V147-I154 HydrophobicContact CG2-CG2 3.84Å; V147-C164 HydrophobicContact CG1-CB 4Å
148	Y	98.5	Very high	97.5	Very high	201 Å²	201	54.1 Å²	54.1	79%	0.788	30%	0.3	S	S	*	.	H	α-helix	trans	-58.4	-42.7	175.2	179.3	-99.2	0	0	0	111.9	S144 T146 I150 G151	S144-Y148 VanDerWaalsContact O-CB 3.25Å; S144-Y148 WeakPolarHBondContact O-CB 3.4Å; S144-Y148 PolarHBondContact O-N 2.79Å; S144-Y148 VanDerWaalsContact O-N 3.08Å; T146-Y148 VanDerWaalsContact C-N 3.33Å; T146-Y148 PolarHBondContact O-N 2.87Å; Y148-I150 VanDerWaalsContact C-N 3.29Å; Y148-I150 PolarHBondContact O-N 3.29Å; Y148-G151 PolarHBondContact O-N 2.93Å
149	A	98.4	Very high	97.2	Very high	81 Å²	81	51.5 Å²	51.5	67%	0.669	30%	0.3	S	S	*	.	H	α-helix	trans	-66.8	-26.9	-179.5	0	0	0	0	0	113.9	G145 T146 V147	G145-A149 WeakPolarHBondContact O-CB 3.35Å; G145-A149 PolarHBondContact O-N 3.18Å; G145-A149 VanDerWaalsContact O-N 3.12Å; T146-A149 PolarHBondContact O-N 3.22Å; V147-A149 VanDerWaalsContact C-N 3.3Å; V147-A149 PolarHBondContact O-N 3.4Å
150	I	97.6	Very high	97	Very high	50 Å²	50	54.3 Å²	54.3	26%	0.256	32%	0.315	S	S	.	.	H	α-helix	trans	-101.4	4.1	-179.8	67.1	173.1	0	0	0	113.6	L118 K119 T146 V147 Y148 G152 P166	L118-I150 HydrophobicContact CB-CD1 3.84Å; K119-I150 HydrophobicContact CG-CG2 4.36Å; T146-I150 PolarHBondContact O-N 3.39Å; V147-I150 WeakPolarHBondContact O-CG1 3.38Å; V147-I150 PolarHBondContact O-N 3.2Å; Y148-I150 VanDerWaalsContact C-N 3.29Å; Y148-I150 PolarHBondContact O-N 3.29Å; I150-G152 VanDerWaalsContact C-N 3.25Å; I150-G152 PolarHBondContact O-N 3.16Å; I150-P166 HydrophobicContact CD1-CB 4.22Å
151	G	97.5	Very high	97	Very high	56 Å²	56	55.5 Å²	55.5	58%	0.577	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	25.2	-175	0	0	0	0	0	113.7	V147 Y148	V147-G151 PolarHBondContact O-N 3.38Å; V147-G151 VanDerWaalsContact O-N 3.11Å; Y148-G151 PolarHBondContact O-N 2.93Å
152	G	97.6	Very high	96.9	Very high	20 Å²	20	52.7 Å²	52.7	21%	0.206	31%	0.305	C	S	.	.			trans	-90.5	-170.9	173.9	0	0	0	0	0	112.7	V147 I150 T165	V147-G152 PolarHBondContact O-N 2.91Å; I150-G152 VanDerWaalsContact C-N 3.25Å; I150-G152 PolarHBondContact O-N 3.16Å; G152-T165 CarbonylContact C-O 3.45Å; G152-T165 WeakPolarHBondContact CA-O 3.47Å
153	D	97.5	Very high	96.9	Very high	73 Å²	73	50.4 Å²	50.4	39%	0.39	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	153.6	-179.9	-166.1	22.9	0	0	0	111.8	Q155 C164 T165	D153-Q155 PolarHBondContact OD2-NE2 3.15Å; D153-C164 CarbonylContact O-C 3.57Å; D153-C164 WeakPolarHBondContact O-CA 3.23Å; D153-T165 PolarHBondContact N-O 3.24Å; D153-T165 PolarHBondContact O-N 3.19Å; D153-T165 PolarHBondContact O-OG1 3.22Å
154	I	97.5	Very high	96.9	Very high	33 Å²	33	50.3 Å²	50.3	17%	0.169	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	127	175.6	-175.3	169.9	0	0	0	109.6	L143 V147 F162 L163	L143-I154 HydrophobicContact CB-CD1 4.01Å; V147-I154 HydrophobicContact CG2-CB 3.92Å; V147-I154 HydrophobicContact CG2-CG2 3.84Å; I154-F162 HydrophobicContact CD1-CD1 4.42Å; I154-F162 HydrophobicContact CG1-CD1 4.4Å; I154-L163 CarbonylContact C-O 3.57Å; I154-L163 WeakPolarHBondContact CA-O 3.36Å
155	Q	95.8	Very high	96.9	Very high	51 Å²	51	48.7 Å²	48.7	24%	0.238	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135	-176.5	-62.1	-177.7	25.9	0	0	110.7	D153 F162 L163	D153-Q155 PolarHBondContact OD2-NE2 3.15Å; Q155-F162 CarbonylContact O-C 3.46Å; Q155-F162 WeakPolarHBondContact O-CA 3.09Å; Q155-L163 PolarHBondContact N-O 3.21Å; Q155-L163 PolarHBondContact O-N 3.49Å
156	R	95.2	Very high	96.8	Very high	94 Å²	94	46.8 Å²	46.8	36%	0.355	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	129.5	169.9	-172.5	170.9	179.7	-156.3	18.1	109.1	G158 T159 F162 D177	R156-G158 WeakPolarHBondContact CG-O 3.27Å; R156-G158 PolarHBondContact NE-O 2.66Å; R156-T159 PolarHBondContact NE-O 3.26Å; R156-T159 PolarHBondContact NH2-O 3.47Å; R156-F162 HydrophobicContact CB-CD1 4.17Å; R156-F162 HydrophobicContact CB-CE1 3.89Å; R156-F162 HydrophobicContact CG-CE1 4.05Å; R156-F162 HydrophobicContact CG-CZ 4.21Å; R156-D177 WeakPolarHBondContact CD-OD2 3.18Å; R156-D177 IonicContact CZ-OD2 2.63Å; R156-D177 IonicContact NE-OD2 2.66Å; R156-D177 PolarHBondContact NE-OD2 2.82Å; R156-D177 IonicContact NH1-OD2 2.73Å; R156-D177 PolarHBondContact NH1-OD2 2.94Å
157	V	95	Very high	96.7	Very high	40 Å²	40	50.1 Å²	50.1	24%	0.242	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	0.1	-179.8	-60.4	0	0	0	0	112.6	L125 I161 L163 I175	L125-V157 HydrophobicContact CD1-CG2 3.92Å; V157-I161 HydrophobicContact CG2-CB 3.93Å; V157-I161 HydrophobicContact CG2-CG2 3.5Å; V157-I161 WeakPolarHBondContact CG2-O 3.09Å; V157-I161 PolarHBondContact N-O 3.1Å; V157-L163 HydrophobicContact CG1-CB 3.89Å; V157-I175 HydrophobicContact CB-CD1 3.73Å; V157-I175 HydrophobicContact CG1-CD1 4.16Å; V157-I175 WeakPolarHBondContact O-CD1 3.49Å
158	G	93.7	Very high	96.6	Very high	16 Å²	16	53.6 Å²	53.6	17%	0.165	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.6	-179.4	173.6	0	0	0	0	0	111.5	R156 D160 I161	R156-G158 WeakPolarHBondContact CG-O 3.27Å; R156-G158 PolarHBondContact NE-O 2.66Å; G158-D160 VanDerWaalsContact C-N 3.25Å; G158-D160 PolarHBondContact O-N 3.42Å; G158-I161 PolarHBondContact N-O 2.82Å; G158-I161 PolarHBondContact O-N 3.03Å
159	T	91.6	Very high	96.4	Very high	81 Å²	81	46.4 Å²	46.4	50%	0.497	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-44.2	-172	-53.6	0	0	0	0	113.6	R156 I179	R156-T159 PolarHBondContact NE-O 3.26Å; R156-T159 PolarHBondContact NH2-O 3.47Å; T159-I179 HydrophobicContact CG2-CD1 4.1Å
160	D	95.1	Very high	96.2	Very high	60 Å²	60	51.5 Å²	51.5	32%	0.321	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.6	24.2	179	-56.7	-59.6	0	0	0	111.8	L128 Q129 G158	L128-D160 HydrophobicContact CB-CB 4.16Å; L128-D160 WeakPolarHBondContact CB-O 3.42Å; L128-D160 PolarHBondContact N-O 2.78Å; Q129-D160 HydrophobicContact CG-CB 3.99Å; G158-D160 VanDerWaalsContact C-N 3.25Å; G158-D160 PolarHBondContact O-N 3.42Å
161	I	96.8	Very high	96	Very high	46 Å²	46	51.3 Å²	51.3	24%	0.236	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	125	-176.2	-52.1	179.4	0	0	0	109.4	L125 V126 V157 G158	L125-I161 HydrophobicContact CD1-CG2 3.84Å; L125-I161 HydrophobicContact CD2-CG2 4.12Å; L125-I161 HydrophobicContact CG-CG2 3.81Å; V126-I161 WeakPolarHBondContact O-CA 3.41Å; V157-I161 HydrophobicContact CG2-CB 3.93Å; V157-I161 HydrophobicContact CG2-CG2 3.5Å; V157-I161 WeakPolarHBondContact CG2-O 3.09Å; V157-I161 PolarHBondContact N-O 3.1Å; G158-I161 PolarHBondContact N-O 2.82Å; G158-I161 PolarHBondContact O-N 3.03Å
162	F	97.7	Very high	95.8	Very high	23 Å²	23	53.2 Å²	53.2	10%	0.101	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	132.6	-176.6	-66.1	-94.8	0	0	0	110.5	L125 V126 L128 I140 I154 Q155 R156	L125-F162 CarbonylContact C-O 3.6Å; L125-F162 WeakPolarHBondContact CA-O 3.35Å; V126-F162 PolarHBondContact N-O 3.03Å; V126-F162 PolarHBondContact O-N 3.42Å; L128-F162 HydrophobicContact CD1-CD2 3.78Å; L128-F162 HydrophobicContact CD1-CE2 3.84Å; L128-F162 HydrophobicContact CG-CD2 4.34Å; I140-F162 HydrophobicContact CD1-CD2 4.42Å; I140-F162 HydrophobicContact CD1-CE1 3.97Å; I140-F162 HydrophobicContact CD1-CE2 3.59Å; I140-F162 HydrophobicContact CD1-CZ 3.32Å; I140-F162 HydrophobicContact CG1-CD2 4.32Å; I140-F162 HydrophobicContact CG1-CE1 4.16Å; I140-F162 HydrophobicContact CG1-CE2 3.97Å; I140-F162 HydrophobicContact CG1-CZ 3.89Å; I140-F162 HydrophobicContact CG2-CE1 4.45Å; I154-F162 HydrophobicContact CD1-CD1 4.42Å; I154-F162 HydrophobicContact CG1-CD1 4.4Å; Q155-F162 CarbonylContact O-C 3.46Å; Q155-F162 WeakPolarHBondContact O-CA 3.09Å; R156-F162 HydrophobicContact CB-CD1 4.17Å; R156-F162 HydrophobicContact CB-CE1 3.89Å; R156-F162 HydrophobicContact CG-CE1 4.05Å; R156-F162 HydrophobicContact CG-CZ 4.21Å
163	L	97.8	Very high	95.5	Very high	25 Å²	25	55.4 Å²	55.4	13%	0.131	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	120.6	169.7	174.1	62.3	0	0	0	108.3	M100 L125 I154 Q155 V157 T165 V171	M100-L163 HydrophobicContact CE-CD1 3.78Å; L125-L163 HydrophobicContact CD1-CB 4.22Å; L125-L163 HydrophobicContact CD1-CD1 4.43Å; I154-L163 CarbonylContact C-O 3.57Å; I154-L163 WeakPolarHBondContact CA-O 3.36Å; Q155-L163 PolarHBondContact N-O 3.21Å; Q155-L163 PolarHBondContact O-N 3.49Å; V157-L163 HydrophobicContact CG1-CB 3.89Å; L163-T165 HydrophobicContact CD1-CG2 4.02Å; L163-T165 HydrophobicContact CD2-CG2 4.22Å; L163-T165 HydrophobicContact CG-CG2 3.91Å; L163-V171 HydrophobicContact CD2-CG1 4.09Å; L163-V171 HydrophobicContact CD2-CG2 3.87Å
164	C	98.2	Very high	95	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132.2	170.5	-52.1	0	0	0	0	108.8	L118 A123 T124 V147 D153	L118-C164 HydrophobicContact CD1-CB 3.89Å; L118-C164 HydrophobicContact CD2-CB 3.73Å; L118-C164 HydrophobicContact CG-CB 4.39Å; A123-C164 WeakPolarHBondContact CA-O 3.38Å; T124-C164 PolarHBondContact N-O 3.24Å; T124-C164 PolarHBondContact O-N 3.1Å; T124-C164 WeakPolarHBondContact OG1-CB 3.45Å; V147-C164 HydrophobicContact CG1-CB 4Å; D153-C164 CarbonylContact O-C 3.57Å; D153-C164 WeakPolarHBondContact O-CA 3.23Å
165	T	97.5	Very high	94.5	Very high	4 Å²	4	60.2 Å²	60.2	3%	0.025	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	138.7	-176.6	52.8	0	0	0	0	111.1	A123 G152 D153 L163 V169 V171	A123-T165 HydrophobicContact CB-CG2 4.09Å; G152-T165 CarbonylContact C-O 3.45Å; G152-T165 WeakPolarHBondContact CA-O 3.47Å; D153-T165 PolarHBondContact N-O 3.24Å; D153-T165 PolarHBondContact O-N 3.19Å; D153-T165 PolarHBondContact O-OG1 3.22Å; L163-T165 HydrophobicContact CD1-CG2 4.02Å; L163-T165 HydrophobicContact CD2-CG2 4.22Å; L163-T165 HydrophobicContact CG-CG2 3.91Å; T165-V169 HydrophobicContact CG2-CB 4.27Å; T165-V169 HydrophobicContact CG2-CG1 3.86Å; T165-V171 HydrophobicContact CG2-CG2 3.58Å
166	P	97.5	Very high	93.9	Very high	2 Å²	2	62.5 Å²	62.5	1%	0.013	37%	0.371	C	S	.	.			trans	-78.7	173	169.2	34.3	-37.2	0	0	0	111.8	I150 N168 V169	I150-P166 HydrophobicContact CD1-CB 4.22Å; P166-N168 WeakPolarHBondContact CB-OD1 3.43Å; P166-N168 WeakPolarHBondContact CG-OD1 3.32Å; P166-N168 PolarHBondContact O-N 2.89Å; P166-V169 HydrophobicContact CG-CG2 3.99Å; P166-V169 PolarHBondContact O-N 3.11Å; P166-V169 VanDerWaalsContact O-N 3.09Å
167	D	96.4	Very high	92.8	Very high	91 Å²	91	60.8 Å²	60.8	49%	0.487	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-21.2	-178.9	67.6	-17.2	0	0	0	115.3	R121	R121-D167 IonicContact CZ-OD1 3.07Å; R121-D167 IonicContact CZ-OD2 3.39Å; R121-D167 IonicContact NE-OD1 2.78Å; R121-D167 IonicContact NH2-OD1 3.78Å; R121-D167 PolarHBondContact NH2-OD1 3.07Å; R121-D167 IonicContact NH2-OD2 2.77Å; R121-D167 PolarHBondContact NH2-OD2 3.27Å
168	N	95.1	Very high	91.2	Very high	78 Å²	78	67 Å²	67	42%	0.417	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	2.8	-179.1	68.1	-78.8	0	0	0	114.8	R121 P166	R121-N168 WeakPolarHBondContact CA-OD1 3.27Å; R121-N168 WeakPolarHBondContact CB-OD1 3.45Å; R121-N168 WeakPolarHBondContact CG-OD1 3.44Å; R121-N168 PolarHBondContact O-ND2 2.83Å; R121-N168 PolarHBondContact O-OD1 2.68Å; P166-N168 WeakPolarHBondContact CB-OD1 3.43Å; P166-N168 WeakPolarHBondContact CG-OD1 3.32Å; P166-N168 PolarHBondContact O-N 2.89Å
169	V	95.1	Very high	89.6	Confident	50 Å²	50	70.5 Å²	70.5	30%	0.303	41%	0.409	S	S	.	.			trans	-121.6	117	-179.3	179.1	0	0	0	0	109.6	A123 T165 P166	A123-V169 HydrophobicContact CB-CG1 4.34Å; A123-V169 HydrophobicContact CB-CG2 4.33Å; T165-V169 HydrophobicContact CG2-CB 4.27Å; T165-V169 HydrophobicContact CG2-CG1 3.86Å; P166-V169 HydrophobicContact CG-CG2 3.99Å; P166-V169 PolarHBondContact O-N 3.11Å; P166-V169 VanDerWaalsContact O-N 3.09Å
170	E	93.6	Very high	87.9	Confident	188 Å²	188	74.2 Å²	74.2	88%	0.879	42%	0.421	S	S	*	.			trans	-91.1	133.2	175.3	-171.9	178.2	178.9	0	0	110.4
171	V	94.2	Very high	85.9	Confident	47 Å²	47	77.8 Å²	77.8	29%	0.285	44%	0.439	S	S	.	.			trans	-111.5	129.4	176.5	-176.3	0	0	0	0	109	L163 T165	L163-V171 HydrophobicContact CD2-CG1 4.09Å; L163-V171 HydrophobicContact CD2-CG2 3.87Å; T165-V171 HydrophobicContact CG2-CG2 3.58Å
172	A	92.7	Very high	84	Confident	96 Å²	96	84.5 Å²	84.5	79%	0.793	47%	0.472	S	S	*	.			trans	-119	143.4	177.8	0	0	0	0	0	111.2
173	G	91.6	Very high	82.1	Confident	66 Å²	66	92.3 Å²	92.3	68%	0.68	51%	0.509	S	S	*	.			trans	90.6	177.5	-175.6	0	0	0	0	0	112.9
174	S	86.3	Confident	80.2	Confident	103 Å²	103	99.6 Å²	99.6	72%	0.72	54%	0.542	S	S	*	.			trans	-149.7	140.3	178.1	58.2	0	0	0	0	109.4
175	I	87.4	Confident	78.2	Confident	103 Å²	103	103.7 Å²	103.7	53%	0.528	57%	0.571	S	S	.	*			trans	-94.5	120.3	171.2	-66.6	167.6	0	0	0	107	V157 D177	V157-I175 HydrophobicContact CB-CD1 3.73Å; V157-I175 HydrophobicContact CG1-CD1 4.16Å; V157-I175 WeakPolarHBondContact O-CD1 3.49Å; I175-D177 PolarHBondContact O-N 3.15Å
176	T	82.9	Confident	76.4	Confident	99 Å²	99	113.6 Å²	113.6	61%	0.607	61%	0.614	S	S	*	*			trans	-81	117.8	175.2	-55.5	0	0	0	0	108.3	H178	T176-H178 PolarHBondContact O-N 3.22Å; T176-H178 VanDerWaalsContact O-N 3.12Å
177	D	71.6	Confident	74.3	Confident	59 Å²	59	125.1 Å²	125.1	32%	0.316	68%	0.675	S	S	.	*			trans	-71.6	103	173.4	-74.5	-29.3	0	0	0	109.4	R156 I175 I179	R156-D177 WeakPolarHBondContact CD-OD2 3.18Å; R156-D177 IonicContact CZ-OD2 2.63Å; R156-D177 IonicContact NE-OD2 2.66Å; R156-D177 PolarHBondContact NE-OD2 2.82Å; R156-D177 IonicContact NH1-OD2 2.73Å; R156-D177 PolarHBondContact NH1-OD2 2.94Å; I175-D177 PolarHBondContact O-N 3.15Å; D177-I179 HydrophobicContact CB-CD1 4.38Å; D177-I179 HydrophobicContact CB-CG1 4.32Å; D177-I179 PolarHBondContact O-N 2.99Å; D177-I179 VanDerWaalsContact O-N 3.12Å
178	H	62.7	Low	73.2	Confident	169 Å²	169	126.8 Å²	126.8	78%	0.782	69%	0.685	S	S	*	*			trans	-83.6	60.9	162.7	-72.6	-66.4	0	0	0	109.7	T176	T176-H178 PolarHBondContact O-N 3.22Å; T176-H178 VanDerWaalsContact O-N 3.12Å
179	I	59.6	Low	72.1	Confident	90 Å²	90	129.4 Å²	129.4	46%	0.462	70%	0.699	S	S	.	*			trans	-105.4	69.1	172.6	-55	173.4	0	0	0	106.4	T159 D177	T159-I179 HydrophobicContact CG2-CD1 4.1Å; D177-I179 HydrophobicContact CB-CD1 4.38Å; D177-I179 HydrophobicContact CB-CG1 4.32Å; D177-I179 PolarHBondContact O-N 2.99Å; D177-I179 VanDerWaalsContact O-N 3.12Å
180	E	56.6	Low	70.8	Confident	160 Å²	160	133.8 Å²	133.8	75%	0.748	72%	0.721	S	S	*	*			trans	-122.4	108.5	169.9	-73	-178.4	176.5	0	0	107.6
181	N	51.6	Low	69.5	Low	134 Å²	134	130.6 Å²	130.6	72%	0.717	71%	0.711	S	S	*	*			trans	76.4	27.9	136	-53.9	-18.3	0	0	0	121.1	E183	N181-E183 VanDerWaalsContact C-N 3.29Å; N181-E183 PolarHBondContact O-N 2.66Å
182	M	57.5	Low	67.9	Low	188 Å²	188	135.8 Å²	135.8	93%	0.926	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	4.1	171.4	-109.8	-170.2	-61.5	0	0	116
183	E	59	Low	66.3	Low	187 Å²	187	138.5 Å²	138.5	87%	0.874	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	6.4	-173.9	-139.5	170.3	-172.2	0	0	115.2	N181	N181-E183 VanDerWaalsContact C-N 3.29Å; N181-E183 PolarHBondContact O-N 2.66Å
184	H	57.7	Low	64.5	Low	177 Å²	177	143.6 Å²	143.6	82%	0.819	74%	0.738	S	S	*	*	S	Bend	trans	-115.3	23	-176.3	-74	91.1	0	0	0	115.5
185	S	55	Low	62.8	Low	87 Å²	87	146.8 Å²	146.8	61%	0.608	74%	0.74	S	S	*	*			trans	-143.1	72	178.8	63.9	0	0	0	0	113.6
186	F	59.5	Low	60.7	Low	212 Å²	212	150.4 Å²	150.4	93%	0.93	76%	0.757	S	S	*	*			trans	-146	88.6	148.9	-80.7	-78	0	0	0	107.4
187	D	54.9	Low	58.7	Low	243 Å²	243	155.1 Å²	155.1	100%	1.299	77%	0.771	S	S	*	*			trans	-63.1	0	154.1	-79.7	-49.9	0	0	0	110.9

Retrieved 187 of 187 residues in 285.7 ms (Link to these results)

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