A0A060Y944_ONCMY Loading...

Large ribosomal subunit protein uL18m

Together with thiosulfate sulfurtransferase (TST), acts as a mitochondrial import factor for the cytosolic 5S rRNA. The precursor form shows RNA chaperone activity; is able to fold the 5S rRNA into an import-competent conformation that is recognized by rhodanese (TST). Both the cytoplasmic and mitochondrial forms are able to bind to the helix IV-loop D in the gamma domain of the 5S rRNA.

AlphaFold DB , UniProt , Accession A0A060Y944, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 194 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	38.4	Very low	39.7	Very low	237 Å²	237	151.7 Å²	151.7	100%	1.167	85%	0.851	S	S	*	*				0	79.9	0	-60.6	-80.6	-146.6	0	0	106.3
2	A	37.1	Very low	39.8	Very low	93 Å²	93	157.9 Å²	157.9	77%	0.769	85%	0.851	S	S	*	*				58.6	128.9	83.2	0	0	0	0	0	112.1
3	V	38.6	Very low	39.7	Very low	133 Å²	133	156.5 Å²	156.5	81%	0.806	84%	0.842	S	S	*	*			cis	-164.8	140.7	3.7	139.2	0	0	0	0	105.9
4	L	41.5	Very low	39.7	Very low	167 Å²	167	158.1 Å²	158.1	87%	0.874	85%	0.849	S	S	*	*			trans	-66.6	134.1	162.3	-90.2	144	0	0	0	109.7
5	G	36.8	Very low	39.7	Very low	72 Å²	72	157.7 Å²	157.7	74%	0.742	85%	0.845	S	S	*	*			trans	-135.7	88.3	177.3	0	0	0	0	0	112
6	D	39.7	Very low	39.6	Very low	150 Å²	150	152.3 Å²	152.3	80%	0.802	84%	0.838	S	S	*	*			trans	-59.9	139.9	162.9	-75.4	-50.2	0	0	0	111.1
7	L	41.9	Very low	39.6	Very low	180 Å²	180	154.4 Å²	154.4	94%	0.942	84%	0.84	S	S	*	*			trans	-119.9	107.9	162.9	-76.5	174.3	0	0	0	109.9
8	N	39.1	Very low	39.8	Very low	133 Å²	133	154.7 Å²	154.7	71%	0.711	84%	0.839	S	S	*	*			trans	-90.6	139.6	-175.7	-135.1	-19.3	0	0	0	110.8
9	R	43.7	Very low	39.9	Very low	227 Å²	227	156.2 Å²	156.2	86%	0.857	84%	0.84	S	S	*	*			trans	10.3	126.7	147.9	-62.5	172.9	178.5	-170.5	-0.8	118.8
10	T	39.9	Very low	39.7	Very low	130 Å²	130	160.7 Å²	160.7	80%	0.798	84%	0.844	S	S	*	*			trans	-147.4	96.2	148.7	8.9	0	0	0	0	111.1
11	V	40.4	Very low	39.5	Very low	147 Å²	147	159.1 Å²	159.1	89%	0.891	85%	0.846	S	S	*	*			trans	-89.9	109	160.7	173.6	0	0	0	0	106.1	L13	V11-L13 PolarHBondContact O-N 3.04Å
12	R	40.2	Very low	39.6	Very low	226 Å²	226	151.2 Å²	151.2	85%	0.853	82%	0.824	S	S	*	*			trans	-82.9	112.1	175.4	-84.4	-172.9	176.1	-167.9	-0.1	110.4
13	L	38.9	Very low	39.6	Very low	140 Å²	140	156.4 Å²	156.4	73%	0.733	83%	0.833	S	S	*	*			trans	-27.7	127.4	151.4	-78.5	129.6	0	0	0	114.7	V11 L15	V11-L13 PolarHBondContact O-N 3.04Å; L13-L15 HydrophobicContact CD2-CD1 3.93Å
14	L	39	Very low	39.5	Very low	179 Å²	179	155.7 Å²	155.7	94%	0.937	83%	0.834	S	S	*	*			trans	-123.6	80.8	153.3	-79.2	172	0	0	0	108.3
15	L	39.8	Very low	39.2	Very low	151 Å²	151	151.1 Å²	151.1	79%	0.791	83%	0.827	S	S	*	*			trans	-93.8	108.6	161.5	-90.1	161.6	0	0	0	107.4	L13	L13-L15 HydrophobicContact CD2-CD1 3.93Å
16	G	38.3	Very low	39.2	Very low	71 Å²	71	153.7 Å²	153.7	73%	0.732	83%	0.833	S	S	*	*			trans	-63.6	141.6	174.2	0	0	0	0	0	111.9
17	Q	40.3	Very low	39.1	Very low	189 Å²	189	151.3 Å²	151.3	88%	0.883	83%	0.834	S	S	*	*			trans	-68.9	129.1	-166.8	-64.4	164.5	-51.7	0	0	113
18	I	43.1	Very low	39.4	Very low	160 Å²	160	150.4 Å²	150.4	82%	0.821	83%	0.829	S	S	*	*			trans	-87.4	110.8	163	-61.8	170.1	0	0	0	107.1	R20	I18-R20 PolarHBondContact O-N 3.29Å
19	Q	41.2	Very low	39.7	Very low	183 Å²	183	151.7 Å²	151.7	86%	0.855	84%	0.836	S	S	*	*			trans	-70.8	117.6	169.6	-73.5	178.8	-14.5	0	0	109.4
20	R	36.5	Very low	40.1	Very low	245 Å²	245	149.3 Å²	149.3	93%	0.925	84%	0.835	S	S	*	*			trans	-81.2	113.1	169	-75.4	-177.9	174.7	179.1	-1.6	108.8	I18	I18-R20 PolarHBondContact O-N 3.29Å
21	C	36.1	Very low	40.3	Very low	129 Å²	129	152.7 Å²	152.7	87%	0.872	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-83.3	132.6	165.2	-166.1	0	0	0	0	109.1
22	G	38.7	Very low	41	Very low	70 Å²	70	155.4 Å²	155.4	72%	0.722	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-70.8	148.2	-172.2	0	0	0	0	0	114
23	Q	38.1	Very low	41.5	Very low	203 Å²	203	152.5 Å²	152.5	95%	0.949	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-83.7	125	169.3	-69.5	-174.8	-10	0	0	110
24	S	36.1	Very low	42.2	Very low	118 Å²	118	150.9 Å²	150.9	83%	0.825	83%	0.831	S	S	*	*			trans	-121.1	110.5	156	55.9	0	0	0	0	107.5
25	G	36.4	Very low	43.1	Very low	70 Å²	70	147.8 Å²	147.8	72%	0.722	82%	0.82	S	S	*	*			trans	-72.6	152.1	176.6	0	0	0	0	0	112.3
26	S	37	Very low	43.9	Very low	126 Å²	126	151 Å²	151	88%	0.881	82%	0.821	S	S	*	*			trans	-178.3	147.2	133.5	-81.5	0	0	0	0	112.3
27	A	37.7	Very low	44.7	Very low	100 Å²	100	153.1 Å²	153.1	83%	0.826	82%	0.824	S	S	*	*			trans	74.8	101.1	158.4	0	0	0	0	0	118.8	N29	A27-N29 PolarHBondContact O-N 3.31Å
28	I	46.8	Very low	45.7	Very low	161 Å²	161	151.6 Å²	151.6	83%	0.826	82%	0.818	S	S	*	*			trans	-53.2	124.6	154	-64.5	161.7	0	0	0	109
29	N	44.8	Very low	46.8	Very low	161 Å²	161	149.4 Å²	149.4	86%	0.861	82%	0.817	S	S	*	*			trans	-152.5	130.6	146.3	-114.7	-26.4	0	0	0	111.5	A27	A27-N29 PolarHBondContact O-N 3.31Å
30	Q	53.7	Low	48	Very low	177 Å²	177	148 Å²	148	83%	0.827	82%	0.815	S	S	*	*			trans	-66.5	125.2	-175.5	-68.9	163.7	-34.9	0	0	111.2
31	Y	43.3	Very low	49.7	Very low	201 Å²	201	140.7 Å²	140.7	79%	0.788	81%	0.807	S	S	*	*			trans	-159.3	85.9	143.1	-135.5	-92.2	0	0	0	109.1	K33	Y31-K33 HydrophobicContact CD1-CG 4.05Å; Y31-K33 HydrophobicContact CE1-CG 4.27Å; Y31-K33 PolarHBondContact O-N 3.28Å
32	Q	55.1	Low	51.2	Low	204 Å²	204	138.7 Å²	138.7	95%	0.953	80%	0.799	S	S	*	*			trans	-70.8	84.6	168.6	-78.6	178.4	-49.2	0	0	108.8	S34	Q32-S34 PolarHBondContact O-N 3.4Å
33	K	51.6	Low	52.5	Low	164 Å²	164	141.1 Å²	141.1	71%	0.713	80%	0.803	S	S	*	*			trans	-72.6	107.1	155.1	-92.4	175.2	-178.1	178.7	0	106.6	Y31 V35	Y31-K33 HydrophobicContact CD1-CG 4.05Å; Y31-K33 HydrophobicContact CE1-CG 4.27Å; Y31-K33 PolarHBondContact O-N 3.28Å; K33-V35 VanDerWaalsContact C-N 3.26Å; K33-V35 PolarHBondContact O-N 3.47Å
34	S	51.8	Low	53.8	Low	107 Å²	107	141.1 Å²	141.1	75%	0.748	80%	0.799	S	S	*	*			trans	-60.1	93.4	164.3	179.8	0	0	0	0	107.9	Q32 R36	Q32-S34 PolarHBondContact O-N 3.4Å; S34-R36 PolarHBondContact O-N 3.38Å; S34-R36 VanDerWaalsContact O-N 3.17Å
35	V	58.1	Low	55	Low	114 Å²	114	143.5 Å²	143.5	69%	0.691	80%	0.802	S	S	*	*			trans	-76	100.6	166.2	-174.7	0	0	0	0	104.9	K33 C37	K33-V35 VanDerWaalsContact C-N 3.26Å; K33-V35 PolarHBondContact O-N 3.47Å; V35-C37 VanDerWaalsContact C-N 3.28Å; V35-C37 PolarHBondContact O-N 3.26Å
36	R	57.1	Low	56.3	Low	217 Å²	217	148.2 Å²	148.2	82%	0.819	81%	0.805	S	S	*	*			trans	-61.5	97	167	-72.8	-178.5	179	177.8	-0.4	107.1	S34 M38	S34-R36 PolarHBondContact O-N 3.38Å; S34-R36 VanDerWaalsContact O-N 3.17Å; R36-M38 VanDerWaalsContact C-N 3.33Å; R36-M38 PolarHBondContact O-N 3.25Å
37	C	55	Low	57.8	Low	117 Å²	117	148 Å²	148	79%	0.791	80%	0.801	S	S	*	*			trans	-65.5	97.2	168.4	-57.8	0	0	0	0	107.2	V35 S39	V35-C37 VanDerWaalsContact C-N 3.28Å; V35-C37 PolarHBondContact O-N 3.26Å; C37-S39 PolarHBondContact O-N 3.45Å; C37-S39 VanDerWaalsContact O-N 3.07Å
38	M	61.2	Low	59.2	Low	156 Å²	156	149.4 Å²	149.4	77%	0.768	80%	0.799	S	S	*	*			trans	-66	105.2	165.6	-69.4	-75.7	-77.2	0	0	106.3	R36 L40	R36-M38 VanDerWaalsContact C-N 3.33Å; R36-M38 PolarHBondContact O-N 3.25Å; M38-L40 PolarHBondContact O-N 3.37Å
39	S	66.3	Low	60.3	Low	115 Å²	115	147.8 Å²	147.8	80%	0.804	80%	0.797	S	S	*	*			trans	-68.1	87.2	165.6	53	0	0	0	0	107.3	C37 A41	C37-S39 PolarHBondContact O-N 3.45Å; C37-S39 VanDerWaalsContact O-N 3.07Å; S39-A41 PolarHBondContact O-N 3.16Å
40	L	67	Low	62.1	Low	152 Å²	152	143.5 Å²	143.5	80%	0.796	77%	0.774	S	S	*	*			trans	-64.7	105.9	164.2	-68.7	175.1	0	0	0	105.8	M38 A42	M38-L40 PolarHBondContact O-N 3.37Å; L40-A42 PolarHBondContact O-N 2.9Å
41	A	71.5	Confident	63.3	Low	92 Å²	92	141.7 Å²	141.7	76%	0.76	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-51.9	126.3	170.3	0	0	0	0	0	107.5	S39	S39-A41 PolarHBondContact O-N 3.16Å
42	A	69	Low	65.3	Low	87 Å²	87	138.8 Å²	138.8	72%	0.719	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-50.9	132.1	178.3	0	0	0	0	0	108.8	L40 K44	L40-A42 PolarHBondContact O-N 2.9Å; A42-K44 PolarHBondContact O-N 2.97Å; A42-K44 VanDerWaalsContact O-N 3.11Å
43	P	65.7	Low	66.8	Low	121 Å²	121	136.1 Å²	136.1	79%	0.786	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-56.1	124.7	176.8	22.6	-31.1	0	0	0	107.8	L45	P43-L45 PolarHBondContact O-N 3.11Å
44	K	63.9	Low	68.4	Low	203 Å²	203	132.2 Å²	132.2	88%	0.883	75%	0.754	S	S	*	*			trans	-56.3	113.6	173.3	-77.5	-179.5	177.1	176.3	0	106.9	A42 Q46	A42-K44 PolarHBondContact O-N 2.97Å; A42-K44 VanDerWaalsContact O-N 3.11Å; K44-Q46 PolarHBondContact O-N 3.36Å
45	L	62.8	Low	70.2	Confident	168 Å²	168	133 Å²	133	88%	0.88	75%	0.753	S	S	*	*			trans	-49.8	123.8	171	-83.6	154.8	0	0	0	107.3	P43	P43-L45 PolarHBondContact O-N 3.11Å
46	Q	62.6	Low	71.8	Confident	170 Å²	170	131 Å²	131	79%	0.794	75%	0.745	S	S	*	*			trans	-59.3	136	171.7	-67	-172.1	4	0	0	107.2	K44 T48	K44-Q46 PolarHBondContact O-N 3.36Å; Q46-T48 PolarHBondContact O-N 3.08Å
47	P	68	Low	73.5	Confident	120 Å²	120	127.3 Å²	127.3	78%	0.779	75%	0.749	S	S	*	*			trans	-57.2	114.2	179.4	22.8	-30.9	0	0	0	107.8	V49	P47-V49 PolarHBondContact O-N 3.01Å; P47-V49 VanDerWaalsContact O-N 3.11Å
48	T	67.6	Low	75.5	Confident	130 Å²	130	126.7 Å²	126.7	80%	0.798	74%	0.742	S	S	*	*			trans	-64.2	112	169.5	47	0	0	0	0	105.7	Q46 D50	Q46-T48 PolarHBondContact O-N 3.08Å; T48-D50 PolarHBondContact O-N 2.9Å
49	V	70.8	Confident	77.1	Confident	127 Å²	127	127.4 Å²	127.4	77%	0.77	74%	0.741	S	S	*	*			trans	-63.9	106.5	178.9	-164.1	0	0	0	0	106.4	P47	P47-V49 PolarHBondContact O-N 3.01Å; P47-V49 VanDerWaalsContact O-N 3.11Å
50	D	81.3	Confident	78.5	Confident	72 Å²	72	127.1 Å²	127.1	39%	0.385	73%	0.734	S	S	.	*			trans	-78.3	119.9	171.7	-176.7	-8	0	0	0	106.9	T48 N52 E53	T48-D50 PolarHBondContact O-N 2.9Å; D50-N52 PolarHBondContact O-N 3.47Å; D50-N52 WeakPolarHBondContact OD1-CB 3.33Å; D50-N52 PolarHBondContact OD1-N 3.02Å; D50-N52 PolarHBondContact OD1-ND2 3.38Å; D50-E53 HydrophobicContact CB-CG 4.04Å; D50-E53 WeakPolarHBondContact O-CB 3.35Å; D50-E53 PolarHBondContact O-N 2.62Å
51	D	80.3	Confident	79.9	Confident	139 Å²	139	123.3 Å²	123.3	74%	0.743	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-58.7	-21.6	-179.7	-66.6	-40.3	0	0	0	112	E53 A54	D51-E53 VanDerWaalsContact C-N 3.29Å; D51-E53 PolarHBondContact O-N 3.42Å; D51-A54 WeakPolarHBondContact O-CB 3.38Å; D51-A54 PolarHBondContact O-N 2.94Å
52	N	85	Confident	81.1	Confident	139 Å²	139	130 Å²	130	74%	0.743	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-73	-18.6	174.3	-60.5	-66.2	0	0	0	113.6	D50 A54	D50-N52 PolarHBondContact O-N 3.47Å; D50-N52 WeakPolarHBondContact OD1-CB 3.33Å; D50-N52 PolarHBondContact OD1-N 3.02Å; D50-N52 PolarHBondContact OD1-ND2 3.38Å; N52-A54 VanDerWaalsContact C-N 3.33Å
53	E	85.9	Confident	82.4	Confident	149 Å²	149	129.4 Å²	129.4	70%	0.696	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-85.7	-7.8	176.8	-65	-178.1	173.1	0	0	112.5	D50 D51 V55	D50-E53 HydrophobicContact CB-CG 4.04Å; D50-E53 WeakPolarHBondContact O-CB 3.35Å; D50-E53 PolarHBondContact O-N 2.62Å; D51-E53 VanDerWaalsContact C-N 3.29Å; D51-E53 PolarHBondContact O-N 3.42Å; E53-V55 VanDerWaalsContact C-N 3.3Å; E53-V55 PolarHBondContact O-N 3.31Å
54	A	86.5	Confident	83.7	Confident	82 Å²	82	129 Å²	129	68%	0.678	70%	0.702	S	S	*	*			trans	-73.4	78.6	178.3	0	0	0	0	0	111.8	D51 N52	D51-A54 WeakPolarHBondContact O-CB 3.38Å; D51-A54 PolarHBondContact O-N 2.94Å; N52-A54 VanDerWaalsContact C-N 3.33Å
55	V	89.1	Confident	85.1	Confident	122 Å²	122	122.5 Å²	122.5	74%	0.739	67%	0.672	S	S	*	*			trans	-96.8	137.7	178.1	-175.6	0	0	0	0	111	E53	E53-V55 VanDerWaalsContact C-N 3.3Å; E53-V55 PolarHBondContact O-N 3.31Å
56	S	90.9	Very high	86.6	Confident	74 Å²	74	116.6 Å²	116.6	52%	0.517	64%	0.641	S	S	.	*			trans	-62.2	139	174.6	59.7	0	0	0	0	111.5	T58	S56-T58 PolarHBondContact O-N 2.73Å; S56-T58 VanDerWaalsContact O-N 3.12Å; S56-T58 PolarHBondContact OG-O 2.72Å
57	P	93.6	Very high	88.2	Confident	139 Å²	139	113 Å²	113	90%	0.903	63%	0.627	S	S	*	*	S	Bend	trans	-63.7	-21.6	179.9	26.1	-35.3	0	0	0	113.4
58	T	95.6	Very high	89.4	Confident	103 Å²	103	109.3 Å²	109.3	63%	0.632	60%	0.599	S	S	*	*	S	Bend	trans	-118.3	118.2	178.1	-54.7	0	0	0	0	110.4	S56	S56-T58 PolarHBondContact O-N 2.73Å; S56-T58 VanDerWaalsContact O-N 3.12Å; S56-T58 PolarHBondContact OG-O 2.72Å
59	F	95.3	Very high	90.6	Very high	172 Å²	172	109.1 Å²	109.1	75%	0.754	59%	0.589	S	S	*	*			trans	-89.6	126	175.2	178.7	-104.7	0	0	0	111.1	N61	F59-N61 HydrophobicContact CE1-CB 3.9Å
60	V	95.6	Very high	91.7	Very high	109 Å²	109	107.5 Å²	107.5	66%	0.661	57%	0.574	S	S	*	*			trans	-111.3	112.7	179.6	-178.1	0	0	0	0	110.3
61	N	96.8	Very high	92.3	Very high	71 Å²	71	104.3 Å²	104.3	38%	0.38	56%	0.558	S	S	.	*			trans	-97.2	125.8	172.9	-169.1	-13.6	0	0	0	110.8	F59 N63 N66	F59-N61 HydrophobicContact CE1-CB 3.9Å; N61-N63 VanDerWaalsContact OD1-CB 3.3Å; N61-N63 WeakPolarHBondContact OD1-CB 3.27Å; N61-N63 PolarHBondContact OD1-N 2.93Å; N61-N66 PolarHBondContact ND2-ND2 3.14Å; N61-N66 VanDerWaalsContact ND2-ND2 3.14Å
62	R	97	Very high	93	Very high	232 Å²	232	99.6 Å²	99.6	88%	0.875	53%	0.533	S	S	*	.			trans	-93.4	-2.6	179.8	-61.5	179.8	-177.8	166.6	0.7	114	P64	R62-P64 WeakPolarHBondContact O-CD 3.45Å
63	N	95.4	Very high	93.5	Very high	76 Å²	76	93.6 Å²	93.6	41%	0.406	50%	0.503	S	S	.	.			trans	-71.9	118.9	-179.6	178.1	2.2	0	0	0	110.7	N61 R65 N66	N61-N63 VanDerWaalsContact OD1-CB 3.3Å; N61-N63 WeakPolarHBondContact OD1-CB 3.27Å; N61-N63 PolarHBondContact OD1-N 2.93Å; N63-R65 PolarHBondContact O-N 2.68Å; N63-R65 PolarHBondContact OD1-N 3.43Å; N63-N66 HydrophobicContact CB-CB 4.26Å; N63-N66 WeakPolarHBondContact O-CB 3.39Å; N63-N66 PolarHBondContact O-N 3.13Å
64	P	92.8	Very high	93.8	Very high	111 Å²	111	92 Å²	92	72%	0.721	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-29.6	-178.9	24.5	-34.2	0	0	0	113.2	R62	R62-P64 WeakPolarHBondContact O-CD 3.45Å
65	R	93.4	Very high	94.2	Very high	68 Å²	68	88.6 Å²	88.6	26%	0.257	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-7.5	-175.6	-62.4	-174.8	67.1	-157.8	-7.8	114.2	N63 L67 E68 Q69 A151 G152	N63-R65 PolarHBondContact O-N 2.68Å; N63-R65 PolarHBondContact OD1-N 3.43Å; R65-L67 PolarHBondContact O-N 3.3Å; R65-E68 PolarHBondContact O-N 2.9Å; R65-Q69 WeakPolarHBondContact O-CG 3.42Å; R65-Q69 PolarHBondContact O-N 2.95Å; R65-Q69 VanDerWaalsContact O-N 3.08Å; R65-A151 PolarHBondContact NH1-O 3.46Å; R65-G152 PolarHBondContact NH2-O 3.43Å
66	N	96	Very high	94.3	Very high	44 Å²	44	85.4 Å²	85.4	24%	0.235	45%	0.451	C	S	.	.	H	α-helix	trans	-60.6	-49.4	-173.6	-178.3	47.6	0	0	0	112.2	N61 N63 E68 Q69 M70	N61-N66 PolarHBondContact ND2-ND2 3.14Å; N61-N66 VanDerWaalsContact ND2-ND2 3.14Å; N63-N66 HydrophobicContact CB-CB 4.26Å; N63-N66 WeakPolarHBondContact O-CB 3.39Å; N63-N66 PolarHBondContact O-N 3.13Å; N66-E68 VanDerWaalsContact C-N 3.28Å; N66-E68 PolarHBondContact O-N 3.32Å; N66-Q69 PolarHBondContact O-N 3.25Å; N66-M70 WeakPolarHBondContact O-CG 3.43Å; N66-M70 PolarHBondContact O-N 2.99Å; N66-M70 VanDerWaalsContact O-N 3.14Å
67	L	94.6	Very high	94.1	Very high	93 Å²	93	88 Å²	88	49%	0.487	45%	0.45	S	S	.	.	H	α-helix	trans	-68	-30	-178.4	-65.2	179.9	0	0	0	112.4	R65 A71 L72 A73	R65-L67 PolarHBondContact O-N 3.3Å; L67-A71 PolarHBondContact O-N 3.32Å; L67-L72 HydrophobicContact CD2-CB 4.38Å; L67-L72 PolarHBondContact O-N 3.41Å; L67-A73 HydrophobicContact CB-CB 3.72Å; L67-A73 PolarHBondContact O-N 3.23Å
68	E	93.9	Very high	93.8	Very high	44 Å²	44	83 Å²	83	21%	0.206	42%	0.424	C	S	.	.	H	α-helix	trans	-67.9	-44.5	176.5	-55.9	-179.7	149.5	0	0	110.9	R65 N66 M70 A71 A73 Y89 H90	R65-E68 PolarHBondContact O-N 2.9Å; N66-E68 VanDerWaalsContact C-N 3.28Å; N66-E68 PolarHBondContact O-N 3.32Å; E68-M70 VanDerWaalsContact C-N 3.31Å; E68-M70 PolarHBondContact O-N 3.23Å; E68-A71 PolarHBondContact O-N 2.86Å; E68-A73 HydrophobicContact CB-CB 4.41Å; E68-A73 HydrophobicContact CG-CB 3.85Å; E68-Y89 HydrophobicContact CB-CD1 4.36Å; E68-Y89 HydrophobicContact CB-CD2 4.33Å; E68-Y89 HydrophobicContact CB-CG 4.18Å; E68-Y89 HydrophobicContact CG-CD1 4.05Å; E68-Y89 HydrophobicContact CG-CE1 4.49Å; E68-Y89 HydrophobicContact CG-CG 4.26Å; E68-H90 IonicContact OE2-NE2 3.91Å
69	Q	93.3	Very high	93.5	Very high	125 Å²	125	83.8 Å²	83.8	58%	0.584	42%	0.415	S	S	*	.	H	α-helix	trans	-63.7	-36.3	177.3	-71.5	178.9	-12.3	0	0	112.2	R65 N66 A71	R65-Q69 WeakPolarHBondContact O-CG 3.42Å; R65-Q69 PolarHBondContact O-N 2.95Å; R65-Q69 VanDerWaalsContact O-N 3.08Å; N66-Q69 PolarHBondContact O-N 3.25Å; Q69-A71 PolarHBondContact O-N 2.8Å
70	M	94.1	Very high	93.3	Very high	93 Å²	93	87.3 Å²	87.3	46%	0.458	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-6.8	174.3	-66	177.1	67.2	0	0	113.9	N66 E68 L72	N66-M70 WeakPolarHBondContact O-CG 3.43Å; N66-M70 PolarHBondContact O-N 2.99Å; N66-M70 VanDerWaalsContact O-N 3.14Å; E68-M70 VanDerWaalsContact C-N 3.31Å; E68-M70 PolarHBondContact O-N 3.23Å; M70-L72 HydrophobicContact CB-CB 4.5Å; M70-L72 HydrophobicContact CB-CD1 4.14Å; M70-L72 HydrophobicContact CB-CG 4.09Å; M70-L72 HydrophobicContact CE-CD1 3.53Å; M70-L72 PolarHBondContact O-N 3.21Å; M70-L72 HydrophobicContact SD-CD1 4.36Å
71	A	94.3	Very high	93.2	Very high	5 Å²	5	88.8 Å²	88.8	4%	0.041	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	27.6	-170.7	0	0	0	0	0	114.2	L67 E68 Q69 P187 Q189 K190	L67-A71 PolarHBondContact O-N 3.32Å; E68-A71 PolarHBondContact O-N 2.86Å; Q69-A71 PolarHBondContact O-N 2.8Å; A71-P187 HydrophobicContact CB-CB 4.26Å; A71-P187 HydrophobicContact CB-CG 3.98Å; A71-Q189 CarbonylContact O-C 3.56Å; A71-Q189 VanDerWaalsContact O-CA 3.3Å; A71-Q189 WeakPolarHBondContact O-CA 3.48Å; A71-K190 HydrophobicContact CB-CG 4.47Å; A71-K190 PolarHBondContact O-N 2.91Å
72	L	94.7	Very high	93	Very high	40 Å²	40	89 Å²	89	21%	0.209	44%	0.437	C	S	.	.			trans	-96.6	-26.1	176	-67.7	176.3	0	0	0	112.4	L67 M70 Q189 K190 I192	L67-L72 HydrophobicContact CD2-CB 4.38Å; L67-L72 PolarHBondContact O-N 3.41Å; M70-L72 HydrophobicContact CB-CB 4.5Å; M70-L72 HydrophobicContact CB-CD1 4.14Å; M70-L72 HydrophobicContact CB-CG 4.09Å; M70-L72 HydrophobicContact CE-CD1 3.53Å; M70-L72 PolarHBondContact O-N 3.21Å; M70-L72 HydrophobicContact SD-CD1 4.36Å; L72-Q189 PolarHBondContact O-NE2 2.65Å; L72-Q189 VanDerWaalsContact O-NE2 3.1Å; L72-K190 HydrophobicContact CD2-CB 3.91Å; L72-I192 HydrophobicContact CD1-CD1 3.95Å; L72-I192 HydrophobicContact CD2-CD1 3.79Å; L72-I192 HydrophobicContact CD2-CG1 3.91Å
73	A	94.4	Very high	92.7	Very high	14 Å²	14	84.6 Å²	84.6	12%	0.116	42%	0.42	C	S	.	.	S	Bend	trans	-53.7	140.9	-179.9	0	0	0	0	0	111.6	L67 E68 K75 Y89 Q189	L67-A73 HydrophobicContact CB-CB 3.72Å; L67-A73 PolarHBondContact O-N 3.23Å; E68-A73 HydrophobicContact CB-CB 4.41Å; E68-A73 HydrophobicContact CG-CB 3.85Å; A73-K75 PolarHBondContact O-N 2.86Å; A73-Y89 HydrophobicContact CB-CD1 4.22Å; A73-Y89 HydrophobicContact CB-CE1 3.46Å; A73-Y89 VanDerWaalsContact CB-CE1 3.46Å; A73-Y89 VanDerWaalsContact O-CE1 3.31Å; A73-Y89 WeakPolarHBondContact O-CE1 3.19Å; A73-Y89 PolarHBondContact O-OH 2.96Å; A73-Q189 WeakPolarHBondContact O-CG 3.42Å; A73-Q189 PolarHBondContact O-NE2 3.23Å
74	V	93.2	Very high	92.4	Very high	114 Å²	114	82.9 Å²	82.9	69%	0.691	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-72.3	124.4	179.2	-178.8	0	0	0	0	109.3
75	K	93.7	Very high	92.3	Very high	12 Å²	12	79.1 Å²	79.1	5%	0.052	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-86.9	148.5	167.7	-60.8	-172.3	-176.3	-167.7	0	109.3	A73 R77 K87 Y89 E186 P187	A73-K75 PolarHBondContact O-N 2.86Å; K75-R77 WeakPolarHBondContact O-CG 3.34Å; K75-R77 PolarHBondContact O-N 2.98Å; K75-R77 VanDerWaalsContact O-N 3.08Å; K75-K87 HydrophobicContact CB-CG 3.89Å; K75-K87 HydrophobicContact CD-CG 4.09Å; K75-Y89 HydrophobicContact CD-CE1 4.25Å; K75-Y89 HydrophobicContact CG-CD1 3.99Å; K75-Y89 HydrophobicContact CG-CE1 3.48Å; K75-Y89 VanDerWaalsContact CG-CE1 3.48Å; K75-E186 WeakPolarHBondContact CE-OE2 3.41Å; K75-E186 IonicContact NZ-OE2 2.71Å; K75-E186 PolarHBondContact NZ-OE2 2.87Å; K75-P187 PolarHBondContact NZ-O 3.39Å
76	D	92	Very high	92.2	Very high	54 Å²	54	78.8 Å²	78.8	29%	0.289	39%	0.391	S	S	.	.			trans	-67.5	111.2	172.4	-171	-14	0	0	0	109.7	G78 W79 Q86 K87	D76-G78 PolarHBondContact OD1-N 3.01Å; D76-W79 PolarHBondContact OD2-NE1 3.48Å; D76-Q86 HydrophobicContact CB-CB 4.08Å; D76-Q86 CarbonylContact O-C 3.5Å; D76-K87 VanDerWaalsContact O-CA 3.22Å; D76-K87 WeakPolarHBondContact O-CA 3.13Å; D76-K87 WeakPolarHBondContact O-CB 3.29Å; D76-K87 PolarHBondContact O-N 3.44Å
77	R	86.5	Confident	92.1	Very high	129 Å²	129	82.1 Å²	82.1	49%	0.487	40%	0.403	S	S	.	.			trans	-99.6	28.5	-178.9	-65.2	174.3	-172	-175.5	1.6	111.5	K75 Q189 F191	K75-R77 WeakPolarHBondContact O-CG 3.34Å; K75-R77 PolarHBondContact O-N 2.98Å; K75-R77 VanDerWaalsContact O-N 3.08Å; R77-Q189 VanDerWaalsContact NH2-CD 3.29Å; R77-F191 VanDerWaalsContact NH1-CE1 3.28Å
78	G	87.8	Confident	92.2	Very high	35 Å²	35	78.3 Å²	78.3	36%	0.361	38%	0.383	S	S	.	.			trans	-90.4	-157.1	169.6	0	0	0	0	0	113.4	D76 R80	D76-G78 PolarHBondContact OD1-N 3.01Å; G78-R80 PolarHBondContact O-N 3.32Å
79	W	89.4	Confident	92.2	Very high	118 Å²	118	76.7 Å²	76.7	45%	0.447	38%	0.375	S	S	.	.			trans	62.4	34.8	158.7	-45.2	95.6	0	0	0	115.3	D76 T81 T82 Q86	D76-W79 PolarHBondContact OD2-NE1 3.48Å; W79-T81 PolarHBondContact O-N 3.02Å; W79-T82 PolarHBondContact O-N 3.38Å; W79-T82 VanDerWaalsContact O-O 3.08Å; W79-Q86 HydrophobicContact CB-CG 4.31Å; W79-Q86 HydrophobicContact CD2-CG 4.25Å; W79-Q86 HydrophobicContact CG-CB 4.23Å; W79-Q86 HydrophobicContact CG-CG 3.81Å
80	R	90.2	Very high	92.4	Very high	247 Å²	247	71.4 Å²	71.4	93%	0.932	35%	0.35	S	S	*	.	S	Bend	trans	-65.5	-30.7	178.4	-162.1	174.4	86.3	145.4	2.2	112.6	G78	G78-R80 PolarHBondContact O-N 3.32Å
81	T	94	Very high	92.5	Very high	140 Å²	140	70.4 Å²	70.4	86%	0.859	34%	0.341	S	S	*	.	S	Bend	trans	-88.4	-16.1	-178.2	49.1	0	0	0	0	113.4	W79	W79-T81 PolarHBondContact O-N 3.02Å
82	T	92.3	Very high	92.7	Very high	75 Å²	75	70.2 Å²	70.2	46%	0.46	34%	0.34	S	S	.	.	S	Bend	trans	-103	141.1	-178.4	-48.1	0	0	0	0	110.2	W79	W79-T82 PolarHBondContact O-N 3.38Å; W79-T82 VanDerWaalsContact O-O 3.08Å
83	W	89.9	Confident	92.8	Very high	139 Å²	139	69.8 Å²	69.8	53%	0.527	34%	0.339	S	S	.	.	S	Bend	trans	-108.6	136.8	170.4	-171.5	101.2	0	0	0	109.1	I161	W83-I161 HydrophobicContact CH2-CG1 3.65Å; W83-I161 HydrophobicContact CZ2-CG1 4.19Å; W83-I161 HydrophobicContact CZ3-CG1 4.14Å
84	P	90.4	Very high	92.9	Very high	41 Å²	41	69.7 Å²	69.7	27%	0.266	34%	0.336	S	S	.	.	S	Bend	cis	-80.6	164.9	-2.9	33.1	-34.5	0	0	0	113.1
85	S	90.9	Very high	93	Very high	31 Å²	31	66.5 Å²	66.5	22%	0.217	32%	0.318	C	S	.	.			trans	-70.5	137.4	176.3	178.3	0	0	0	0	111.3	K87 F88	S85-K87 VanDerWaalsContact C-N 3.26Å; S85-K87 PolarHBondContact O-N 2.93Å; S85-K87 PolarHBondContact OG-N 2.83Å; S85-F88 WeakPolarHBondContact O-CD1 3.41Å; S85-F88 WeakPolarHBondContact O-CE1 3.46Å
86	Q	91.6	Very high	93.1	Very high	62 Å²	62	73.3 Å²	73.3	29%	0.29	34%	0.344	S	S	.	.			trans	-83.8	6.3	176.6	-56.7	-152	37.5	0	0	114.3	D76 W79 F88	D76-Q86 HydrophobicContact CB-CB 4.08Å; D76-Q86 CarbonylContact O-C 3.5Å; W79-Q86 HydrophobicContact CB-CG 4.31Å; W79-Q86 HydrophobicContact CD2-CG 4.25Å; W79-Q86 HydrophobicContact CG-CB 4.23Å; W79-Q86 HydrophobicContact CG-CG 3.81Å; Q86-F88 VanDerWaalsContact C-N 3.32Å; Q86-F88 PolarHBondContact O-N 3.46Å
87	K	93.8	Very high	93.2	Very high	113 Å²	113	73.5 Å²	73.5	49%	0.491	35%	0.35	S	S	.	.			trans	-81.1	72.2	-178.5	-169.5	-174.3	175.4	176.9	0	112.1	K75 D76 S85	K75-K87 HydrophobicContact CB-CG 3.89Å; K75-K87 HydrophobicContact CD-CG 4.09Å; D76-K87 VanDerWaalsContact O-CA 3.22Å; D76-K87 WeakPolarHBondContact O-CA 3.13Å; D76-K87 WeakPolarHBondContact O-CB 3.29Å; D76-K87 PolarHBondContact O-N 3.44Å; S85-K87 VanDerWaalsContact C-N 3.26Å; S85-K87 PolarHBondContact O-N 2.93Å; S85-K87 PolarHBondContact OG-N 2.83Å
88	F	95.2	Very high	93.6	Very high	14 Å²	14	73.5 Å²	73.5	6%	0.061	36%	0.355	C	S	.	.			trans	-149.6	168	177.2	58.5	-98	0	0	0	111.8	S85 Q86 R91 N108 V157 E186	S85-F88 WeakPolarHBondContact O-CD1 3.41Å; S85-F88 WeakPolarHBondContact O-CE1 3.46Å; Q86-F88 VanDerWaalsContact C-N 3.32Å; Q86-F88 PolarHBondContact O-N 3.46Å; F88-R91 HydrophobicContact CD1-CB 4.11Å; F88-R91 HydrophobicContact CD2-CB 3.63Å; F88-R91 HydrophobicContact CE1-CB 3.94Å; F88-R91 HydrophobicContact CE1-CG 4.33Å; F88-R91 HydrophobicContact CE2-CB 3.46Å; F88-R91 VanDerWaalsContact CE2-CB 3.46Å; F88-R91 HydrophobicContact CG-CB 3.97Å; F88-R91 HydrophobicContact CZ-CB 3.63Å; F88-R91 HydrophobicContact CZ-CG 4.35Å; F88-N108 HydrophobicContact CD2-CB 4.29Å; F88-N108 HydrophobicContact CE2-CB 4.17Å; F88-N108 WeakPolarHBondContact O-CB 3.47Å; F88-V157 HydrophobicContact CB-CB 4.01Å; F88-V157 HydrophobicContact CB-CG2 3.71Å; F88-E186 VanDerWaalsContact CA-OE2 3.29Å; F88-E186 WeakPolarHBondContact CA-OE2 3.3Å
89	Y	95.8	Very high	93.9	Very high	10 Å²	10	77.6 Å²	77.6	4%	0.039	36%	0.364	C	S	.	.	S	Bend	trans	-97.2	-48.6	163.9	-57.7	-51.4	0	0	0	110.2	E68 A73 K75 A107 N108 E186	E68-Y89 HydrophobicContact CB-CD1 4.36Å; E68-Y89 HydrophobicContact CB-CD2 4.33Å; E68-Y89 HydrophobicContact CB-CG 4.18Å; E68-Y89 HydrophobicContact CG-CD1 4.05Å; E68-Y89 HydrophobicContact CG-CE1 4.49Å; E68-Y89 HydrophobicContact CG-CG 4.26Å; A73-Y89 HydrophobicContact CB-CD1 4.22Å; A73-Y89 HydrophobicContact CB-CE1 3.46Å; A73-Y89 VanDerWaalsContact CB-CE1 3.46Å; A73-Y89 VanDerWaalsContact O-CE1 3.31Å; A73-Y89 WeakPolarHBondContact O-CE1 3.19Å; A73-Y89 PolarHBondContact O-OH 2.96Å; K75-Y89 HydrophobicContact CD-CE1 4.25Å; K75-Y89 HydrophobicContact CG-CD1 3.99Å; K75-Y89 HydrophobicContact CG-CE1 3.48Å; K75-Y89 VanDerWaalsContact CG-CE1 3.48Å; Y89-A107 CarbonylContact O-C 3.55Å; Y89-A107 WeakPolarHBondContact O-CA 3.16Å; Y89-N108 PolarHBondContact O-N 2.94Å; Y89-E186 WeakPolarHBondContact CA-OE1 3.38Å; Y89-E186 VanDerWaalsContact N-CD 3.3Å; Y89-E186 PolarHBondContact N-OE1 3.17Å; Y89-E186 PolarHBondContact N-OE2 2.89Å
90	H	96.9	Very high	94.3	Very high	14 Å²	14	75.4 Å²	75.4	7%	0.065	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.7	173.9	-60.4	-54.6	0	0	0	110.8	E68 V105 F106 M156 V157 E186	E68-H90 IonicContact OE2-NE2 3.91Å; H90-V105 HydrophobicContact CB-CG1 4.14Å; H90-F106 CarbonylContact C-O 3.58Å; H90-F106 VanDerWaalsContact CA-O 3.26Å; H90-F106 WeakPolarHBondContact CA-O 3.37Å; H90-M156 HydrophobicContact CB-CB 3.91Å; H90-M156 CarbonylContact O-C 3.55Å; H90-M156 WeakPolarHBondContact O-CA 3.29Å; H90-M156 WeakPolarHBondContact O-CB 3.44Å; H90-V157 PolarHBondContact O-N 3.15Å; H90-E186 PolarHBondContact N-OE1 2.91Å; H90-E186 VanDerWaalsContact O-OE1 3.08Å
91	R	96.3	Very high	94.6	Very high	71 Å²	71	63.7 Å²	63.7	27%	0.268	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	128.3	176.6	179	176.8	63.6	103.6	6.2	110.5	F88 V93 V105 F106 V157	F88-R91 HydrophobicContact CD1-CB 4.11Å; F88-R91 HydrophobicContact CD2-CB 3.63Å; F88-R91 HydrophobicContact CE1-CB 3.94Å; F88-R91 HydrophobicContact CE1-CG 4.33Å; F88-R91 HydrophobicContact CE2-CB 3.46Å; F88-R91 VanDerWaalsContact CE2-CB 3.46Å; F88-R91 HydrophobicContact CG-CB 3.97Å; F88-R91 HydrophobicContact CZ-CB 3.63Å; F88-R91 HydrophobicContact CZ-CG 4.35Å; R91-V93 HydrophobicContact CG-CG2 4.34Å; R91-V93 VanDerWaalsContact CZ-CG2 3.46Å; R91-V105 WeakPolarHBondContact O-CA 3.46Å; R91-F106 PolarHBondContact N-O 3.03Å; R91-F106 PolarHBondContact O-N 3.08Å; R91-V157 WeakPolarHBondContact CA-O 3.33Å
92	L	97.4	Very high	94.8	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	130.3	170.9	-174.2	60.8	0	0	0	110.1	V105 L144 M156 V157 Y158 F173 M177 L184	L92-V105 HydrophobicContact CD1-CG2 3.89Å; L92-L144 HydrophobicContact CD1-CD2 3.63Å; L92-M156 HydrophobicContact CB-CG 4.22Å; L92-M156 HydrophobicContact CB-SD 3.68Å; L92-M156 HydrophobicContact CD1-SD 3.94Å; L92-M156 HydrophobicContact CD2-SD 4Å; L92-M156 HydrophobicContact CG-SD 4.09Å; L92-V157 PolarHBondContact N-O 3.33Å; L92-Y158 HydrophobicContact CB-CD2 3.98Å; L92-Y158 HydrophobicContact CD2-CD2 3.95Å; L92-Y158 HydrophobicContact CD2-CG 4.21Å; L92-Y158 HydrophobicContact CG-CD2 3.95Å; L92-F173 HydrophobicContact CD1-CZ 4.15Å; L92-F173 HydrophobicContact CD2-CE1 3.7Å; L92-F173 HydrophobicContact CD2-CZ 3.88Å; L92-F173 HydrophobicContact CG-CE1 4.28Å; L92-F173 HydrophobicContact CG-CZ 4.26Å; L92-M177 HydrophobicContact CD1-CE 4.36Å; L92-M177 HydrophobicContact CD2-CE 3.99Å; L92-M177 HydrophobicContact CD2-CG 4.37Å; L92-L184 HydrophobicContact CD2-CD2 3.66Å
93	V	96.6	Very high	95.1	Very high	32 Å²	32	54.6 Å²	54.6	19%	0.194	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	122.5	174.8	-177.7	0	0	0	0	108.1	R91 A103 E104 F106	R91-V93 HydrophobicContact CG-CG2 4.34Å; R91-V93 VanDerWaalsContact CZ-CG2 3.46Å; V93-A103 CarbonylContact O-C 3.55Å; V93-A103 VanDerWaalsContact O-CA 3.29Å; V93-A103 WeakPolarHBondContact O-CA 3.49Å; V93-E104 PolarHBondContact N-O 3.46Å; V93-E104 PolarHBondContact O-N 3.46Å; V93-F106 HydrophobicContact CB-CD2 4.31Å; V93-F106 HydrophobicContact CB-CE2 4.05Å; V93-F106 HydrophobicContact CG2-CD2 3.64Å; V93-F106 HydrophobicContact CG2-CE2 3.75Å
94	F	97.2	Very high	95.5	Very high	11 Å²	11	50.7 Å²	50.7	5%	0.048	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	129.4	172.3	177.6	-100.1	0	0	0	107.9	V101 A103 Y158 H160 V170 F173	F94-V101 HydrophobicContact CD2-CG1 4.28Å; F94-V101 HydrophobicContact CE2-CG1 3.32Å; F94-V101 HydrophobicContact CZ-CG1 3.67Å; F94-A103 HydrophobicContact CD2-CB 4.34Å; F94-Y158 HydrophobicContact CB-CE2 3.92Å; F94-H160 PolarHBondContact O-NE2 2.97Å; F94-V170 HydrophobicContact CD1-CG2 3.85Å; F94-V170 HydrophobicContact CE1-CG2 3.79Å; F94-F173 HydrophobicContact CB-CD1 4.16Å; F94-F173 HydrophobicContact CB-CE1 3.85Å; F94-F173 HydrophobicContact CB-CZ 4.37Å; F94-F173 HydrophobicContact CD2-CB 4.32Å; F94-F173 AromaticContact CD2-CD1 3.66Å; F94-F173 HydrophobicContact CD2-CD1 3.66Å; F94-F173 AromaticContact CD2-CD2 3.73Å; F94-F173 HydrophobicContact CD2-CD2 3.73Å; F94-F173 AromaticContact CD2-CE1 3.82Å; F94-F173 HydrophobicContact CD2-CE1 3.82Å; F94-F173 AromaticContact CD2-CE2 3.89Å; F94-F173 HydrophobicContact CD2-CE2 3.89Å; F94-F173 AromaticContact CD2-CG 3.61Å; F94-F173 HydrophobicContact CD2-CG 3.61Å; F94-F173 AromaticContact CD2-CZ 3.93Å; F94-F173 HydrophobicContact CD2-CZ 3.93Å; F94-F173 HydrophobicContact CE2-CB 4Å; F94-F173 HydrophobicContact CE2-CD1 4.22Å; F94-F173 AromaticContact CE2-CD2 3.83Å; F94-F173 HydrophobicContact CE2-CD2 3.83Å; F94-F173 HydrophobicContact CE2-CE2 4.38Å; F94-F173 AromaticContact CE2-CG 3.74Å; F94-F173 HydrophobicContact CE2-CG 3.74Å; F94-F173 AromaticContact CG-CD1 3.96Å; F94-F173 HydrophobicContact CG-CD1 3.96Å; F94-F173 HydrophobicContact CG-CE1 4.08Å; F94-F173 HydrophobicContact CG-CG 4.32Å; F94-F173 HydrophobicContact CZ-CB 4.41Å
95	S	95.6	Very high	95.8	Very high	47 Å²	47	48.7 Å²	48.7	33%	0.329	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	135.8	-179.9	52.2	0	0	0	0	110	T102	S95-T102 PolarHBondContact N-O 3.21Å; S95-T102 PolarHBondContact O-N 2.86Å; S95-T102 VanDerWaalsContact O-O 3.09Å; S95-T102 PolarHBondContact O-OG1 3.2Å; S95-T102 WeakPolarHBondContact OG-CB 3.42Å; S95-T102 PolarHBondContact OG-O 2.78Å; S95-T102 PolarHBondContact OG-OG1 2.83Å
96	R	94.8	Very high	96.1	Very high	155 Å²	155	48.5 Å²	48.5	59%	0.585	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-120.4	117.2	176.1	-170.7	173.4	87	150.3	2.7	109	V101 R132	R96-V101 HydrophobicContact CG-CG2 4.06Å; R96-R132 PolarHBondContact NH1-O 3.04Å
97	S	95	Very high	96.3	Very high	59 Å²	59	46.1 Å²	46.1	41%	0.413	22%	0.218	S	C	.	.			trans	-93.3	179.9	170.9	69.9	0	0	0	0	110.6	H99 Y100	S97-H99 PolarHBondContact O-N 2.96Å; S97-Y100 PolarHBondContact N-O 3.46Å; S97-Y100 WeakPolarHBondContact OG-CA 3.42Å; S97-Y100 PolarHBondContact OG-N 2.81Å; S97-Y100 PolarHBondContact OG-O 2.77Å
98	Q	94.8	Very high	96.2	Very high	129 Å²	129	43 Å²	43	60%	0.603	21%	0.206	S	C	*	.	S	Bend	trans	-59.8	-34.3	176.5	-176.7	62	13	0	0	113.1
99	H	94.4	Very high	95.8	Very high	120 Å²	120	45.8 Å²	45.8	56%	0.556	24%	0.239	S	C	*	.	S	Bend	trans	-114.1	-24.9	-171.3	-60.9	-67.1	0	0	0	113.8	S97 T131	S97-H99 PolarHBondContact O-N 2.96Å; H99-T131 VanDerWaalsContact O-CB 3.29Å; H99-T131 WeakPolarHBondContact O-CB 3.25Å; H99-T131 PolarHBondContact O-OG1 2.96Å
100	Y	96.6	Very high	95.6	Very high	73 Å²	73	50 Å²	50	29%	0.286	26%	0.262	S	S	.	.			trans	-139.3	146.2	-169.4	-54.6	-70.3	0	0	0	112.1	S97 T119 K120	S97-Y100 PolarHBondContact N-O 3.46Å; S97-Y100 WeakPolarHBondContact OG-CA 3.42Å; S97-Y100 PolarHBondContact OG-N 2.81Å; S97-Y100 PolarHBondContact OG-O 2.77Å; Y100-T119 WeakPolarHBondContact CA-OG1 3.48Å; Y100-T119 WeakPolarHBondContact CB-OG1 3.4Å; Y100-K120 HydrophobicContact CD1-CG 3.72Å; Y100-K120 HydrophobicContact CD2-CD 4.47Å; Y100-K120 HydrophobicContact CD2-CG 4.02Å; Y100-K120 HydrophobicContact CE1-CG 4.09Å; Y100-K120 HydrophobicContact CE2-CG 4.36Å; Y100-K120 HydrophobicContact CG-CD 4.5Å; Y100-K120 HydrophobicContact CG-CG 3.69Å
101	V	97.8	Very high	95.3	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	137.4	164.2	-177.5	0	0	0	0	109.4	F94 R96 S118 T119 T131 V140	F94-V101 HydrophobicContact CD2-CG1 4.28Å; F94-V101 HydrophobicContact CE2-CG1 3.32Å; F94-V101 HydrophobicContact CZ-CG1 3.67Å; R96-V101 HydrophobicContact CG-CG2 4.06Å; V101-S118 PolarHBondContact O-OG 2.89Å; V101-T119 HydrophobicContact CB-CG2 4.02Å; V101-T119 PolarHBondContact N-OG1 3.41Å; V101-T119 PolarHBondContact O-N 3.4Å; V101-T119 PolarHBondContact O-OG1 3.44Å; V101-T131 PolarHBondContact N-O 3.4Å; V101-V140 HydrophobicContact CB-CG2 4.34Å; V101-V140 HydrophobicContact CG1-CB 4.43Å; V101-V140 HydrophobicContact CG1-CG1 4.44Å; V101-V140 HydrophobicContact CG1-CG2 4.15Å
102	T	97.9	Very high	95.3	Very high	24 Å²	24	55.7 Å²	55.7	15%	0.147	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	131	-178.2	29.9	0	0	0	0	109.7	S95 S118	S95-T102 PolarHBondContact N-O 3.21Å; S95-T102 PolarHBondContact O-N 2.86Å; S95-T102 VanDerWaalsContact O-O 3.09Å; S95-T102 PolarHBondContact O-OG1 3.2Å; S95-T102 WeakPolarHBondContact OG-CB 3.42Å; S95-T102 PolarHBondContact OG-O 2.78Å; S95-T102 PolarHBondContact OG-OG1 2.83Å; T102-S118 WeakPolarHBondContact CG2-OG 3.32Å
103	A	98.1	Very high	95.3	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	132.4	174.7	0	0	0	0	0	110	V93 F94 S116 C117 V140 L144 F173	V93-A103 CarbonylContact O-C 3.55Å; V93-A103 VanDerWaalsContact O-CA 3.29Å; V93-A103 WeakPolarHBondContact O-CA 3.49Å; F94-A103 HydrophobicContact CD2-CB 4.34Å; A103-S116 CarbonylContact O-C 3.48Å; A103-S116 WeakPolarHBondContact O-CA 3.48Å; A103-C117 PolarHBondContact N-O 3.46Å; A103-C117 PolarHBondContact O-N 3.43Å; A103-V140 HydrophobicContact CB-CG1 3.49Å; A103-V140 VanDerWaalsContact CB-CG1 3.49Å; A103-L144 HydrophobicContact CB-CD2 3.62Å; A103-F173 HydrophobicContact CB-CE2 3.67Å; A103-F173 HydrophobicContact CB-CZ 3.79Å
104	E	97.9	Very high	95.2	Very high	57 Å²	57	59.5 Å²	59.5	27%	0.266	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	142.7	-169.3	-66.8	175.3	162	0	0	110.3	V93 F106 P113 L115	V93-E104 PolarHBondContact N-O 3.46Å; V93-E104 PolarHBondContact O-N 3.46Å; E104-F106 HydrophobicContact CB-CD2 4.28Å; E104-F106 HydrophobicContact CB-CE2 3.57Å; E104-F106 HydrophobicContact CB-CZ 4.15Å; E104-F106 WeakPolarHBondContact OE2-CE2 3.37Å; E104-F106 WeakPolarHBondContact OE2-CZ 3.42Å; E104-P113 HydrophobicContact CB-CB 4.08Å; E104-P113 HydrophobicContact CG-CB 4.44Å; E104-L115 CarbonylContact C-O 3.55Å; E104-L115 WeakPolarHBondContact CA-O 3.28Å
105	V	98	Very high	95.2	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	117.4	177.2	-177	0	0	0	0	108.3	H90 R91 L92 P113 V114 L115 L144 M156	H90-V105 HydrophobicContact CB-CG1 4.14Å; R91-V105 WeakPolarHBondContact O-CA 3.46Å; L92-V105 HydrophobicContact CD1-CG2 3.89Å; V105-P113 CarbonylContact O-C 3.51Å; V105-P113 WeakPolarHBondContact O-CA 3.43Å; V105-V114 PolarHBondContact O-N 3.39Å; V105-L115 HydrophobicContact CB-CB 4.21Å; V105-L115 HydrophobicContact CG2-CB 4.32Å; V105-L115 PolarHBondContact N-O 2.89Å; V105-L115 PolarHBondContact O-N 3.23Å; V105-L144 HydrophobicContact CG2-CD1 4.37Å; V105-L144 HydrophobicContact CG2-CD2 4.27Å; V105-M156 HydrophobicContact CG1-CE 4.16Å; V105-M156 HydrophobicContact CG2-CE 3.99Å; V105-M156 HydrophobicContact CG2-SD 4.15Å
106	F	96.9	Very high	95.3	Very high	26 Å²	26	61 Å²	61	11%	0.114	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	139.2	178.1	-67.3	-92.4	0	0	0	110.3	H90 R91 V93 E104 A111 P113	H90-F106 CarbonylContact C-O 3.58Å; H90-F106 VanDerWaalsContact CA-O 3.26Å; H90-F106 WeakPolarHBondContact CA-O 3.37Å; R91-F106 PolarHBondContact N-O 3.03Å; R91-F106 PolarHBondContact O-N 3.08Å; V93-F106 HydrophobicContact CB-CD2 4.31Å; V93-F106 HydrophobicContact CB-CE2 4.05Å; V93-F106 HydrophobicContact CG2-CD2 3.64Å; V93-F106 HydrophobicContact CG2-CE2 3.75Å; E104-F106 HydrophobicContact CB-CD2 4.28Å; E104-F106 HydrophobicContact CB-CE2 3.57Å; E104-F106 HydrophobicContact CB-CZ 4.15Å; E104-F106 WeakPolarHBondContact OE2-CE2 3.37Å; E104-F106 WeakPolarHBondContact OE2-CZ 3.42Å; F106-A111 WeakPolarHBondContact CE1-O 3.4Å; F106-P113 HydrophobicContact CD1-CB 4.22Å; F106-P113 HydrophobicContact CE1-CB 3.91Å; F106-P113 HydrophobicContact CE1-CG 4.28Å; F106-P113 HydrophobicContact CE2-CB 4.35Å; F106-P113 HydrophobicContact CZ-CB 3.98Å; F106-P113 HydrophobicContact CZ-CG 4.36Å
107	A	94.8	Very high	95.5	Very high	12 Å²	12	53.6 Å²	53.6	10%	0.099	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	160.5	163.7	0	0	0	0	0	110.4	Y89 G109 D110 V114	Y89-A107 CarbonylContact O-C 3.55Å; Y89-A107 WeakPolarHBondContact O-CA 3.16Å; A107-G109 PolarHBondContact O-N 3.3Å; A107-D110 HydrophobicContact CB-CB 4.28Å; A107-D110 WeakPolarHBondContact CB-OD2 3.33Å; A107-D110 PolarHBondContact O-N 3.37Å; A107-V114 HydrophobicContact CB-CG2 3.8Å
108	N	91.9	Very high	95.6	Very high	47 Å²	47	51.5 Å²	51.5	25%	0.251	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	129.5	177.9	-174.2	26.3	0	0	0	110.7	F88 Y89 D110	F88-N108 HydrophobicContact CD2-CB 4.29Å; F88-N108 HydrophobicContact CE2-CB 4.17Å; F88-N108 WeakPolarHBondContact O-CB 3.47Å; Y89-N108 PolarHBondContact O-N 2.94Å; N108-D110 PolarHBondContact O-N 2.98Å
109	G	87.4	Confident	95.8	Very high	73 Å²	73	45.3 Å²	45.3	75%	0.753	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	-15.1	-178.6	0	0	0	0	0	115.4	A107	A107-G109 PolarHBondContact O-N 3.3Å
110	D	90.5	Very high	95.9	Very high	99 Å²	99	46 Å²	46	53%	0.529	28%	0.278	S	S	.	.			trans	-90.3	132.2	-178.8	-69.1	-27.9	0	0	0	112.1	A107 N108	A107-D110 HydrophobicContact CB-CB 4.28Å; A107-D110 WeakPolarHBondContact CB-OD2 3.33Å; A107-D110 PolarHBondContact O-N 3.37Å; N108-D110 PolarHBondContact O-N 2.98Å
111	A	91.3	Very high	95.9	Very high	95 Å²	95	44.9 Å²	44.9	79%	0.785	28%	0.276	S	S	*	.	S	Bend	trans	-80	-20	173.8	0	0	0	0	0	112.9	F106	F106-A111 WeakPolarHBondContact CE1-O 3.4Å
112	V	95.9	Very high	95.9	Very high	110 Å²	110	53.3 Å²	53.3	67%	0.667	31%	0.308	S	S	*	.	S	Bend	trans	-98	133	-177.6	177.9	0	0	0	0	109.3
113	P	97.2	Very high	95.8	Very high	40 Å²	40	54.8 Å²	54.8	26%	0.26	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	136	177	28.6	-33.7	0	0	0	110.9	E104 V105 F106	E104-P113 HydrophobicContact CB-CB 4.08Å; E104-P113 HydrophobicContact CG-CB 4.44Å; V105-P113 CarbonylContact O-C 3.51Å; V105-P113 WeakPolarHBondContact O-CA 3.43Å; F106-P113 HydrophobicContact CD1-CB 4.22Å; F106-P113 HydrophobicContact CE1-CB 3.91Å; F106-P113 HydrophobicContact CE1-CG 4.28Å; F106-P113 HydrophobicContact CE2-CB 4.35Å; F106-P113 HydrophobicContact CZ-CB 3.98Å; F106-P113 HydrophobicContact CZ-CG 4.36Å
114	V	96	Very high	95.8	Very high	73 Å²	73	55.5 Å²	55.5	44%	0.442	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	-40.8	174.1	-177.4	0	0	0	0	110.3	V105 A107 I153	V105-V114 PolarHBondContact O-N 3.39Å; A107-V114 HydrophobicContact CB-CG2 3.8Å; V114-I153 HydrophobicContact CG1-CD1 4.05Å
115	L	97.4	Very high	95.7	Very high	32 Å²	32	57.4 Å²	57.4	17%	0.168	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141.3	175.5	-63.8	174	0	0	0	109.3	E104 V105 L144 R147 C148 A151 I153	E104-L115 CarbonylContact C-O 3.55Å; E104-L115 WeakPolarHBondContact CA-O 3.28Å; V105-L115 HydrophobicContact CB-CB 4.21Å; V105-L115 HydrophobicContact CG2-CB 4.32Å; V105-L115 PolarHBondContact N-O 2.89Å; V105-L115 PolarHBondContact O-N 3.23Å; L115-L144 HydrophobicContact CB-CD1 4.17Å; L115-R147 HydrophobicContact CD1-CB 4.45Å; L115-C148 HydrophobicContact CD1-CB 4.25Å; L115-A151 HydrophobicContact CD1-CB 3.95Å; L115-A151 HydrophobicContact CD2-CB 4.28Å; L115-I153 HydrophobicContact CD1-CD1 3.95Å; L115-I153 HydrophobicContact CG-CD1 4.43Å
116	S	97.6	Very high	95.7	Very high	56 Å²	56	63.7 Å²	63.7	39%	0.392	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	153	172.2	57.3	0	0	0	0	109.5	A103 R147	A103-S116 CarbonylContact O-C 3.48Å; A103-S116 WeakPolarHBondContact O-CA 3.48Å; S116-R147 PolarHBondContact O-NH1 3.12Å
117	C	97.9	Very high	95.6	Very high	1 Å²	1	69.3 Å²	69.3	1%	0.007	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	124.8	169.9	-176.7	0	0	0	0	108.4	A103 E121 V140 L144	A103-C117 PolarHBondContact N-O 3.46Å; A103-C117 PolarHBondContact O-N 3.43Å; C117-E121 WeakPolarHBondContact CA-OE1 3.34Å; C117-V140 HydrophobicContact CB-CG1 4.28Å; C117-L144 HydrophobicContact CB-CB 3.95Å; C117-L144 HydrophobicContact CB-CD1 3.93Å; C117-L144 HydrophobicContact CB-CG 4.45Å
118	S	97.8	Very high	95.7	Very high	14 Å²	14	70.2 Å²	70.2	10%	0.098	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145.5	179.7	-172.8	0	0	0	0	112.4	V101 T102 K120 E121	V101-S118 PolarHBondContact O-OG 2.89Å; T102-S118 WeakPolarHBondContact CG2-OG 3.32Å; S118-K120 PolarHBondContact O-N 3.24Å; S118-K120 VanDerWaalsContact O-N 3.11Å; S118-K120 WeakPolarHBondContact OG-CB 3.29Å; S118-K120 WeakPolarHBondContact OG-CG 3.48Å; S118-K120 PolarHBondContact OG-N 3.07Å; S118-K120 VanDerWaalsContact OG-N 3.08Å; S118-E121 PolarHBondContact N-OE1 2.86Å; S118-E121 VanDerWaalsContact N-OE1 3.13Å; S118-E121 VanDerWaalsContact O-CB 3.27Å; S118-E121 WeakPolarHBondContact O-CB 3.3Å; S118-E121 WeakPolarHBondContact O-CG 3.36Å; S118-E121 PolarHBondContact O-N 2.82Å
119	T	98.1	Very high	95.9	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-5.5	165	53.8	0	0	0	0	113.9	Y100 V101 E121 L124 L128 T131 A136 V140	Y100-T119 WeakPolarHBondContact CA-OG1 3.48Å; Y100-T119 WeakPolarHBondContact CB-OG1 3.4Å; V101-T119 HydrophobicContact CB-CG2 4.02Å; V101-T119 PolarHBondContact N-OG1 3.41Å; V101-T119 PolarHBondContact O-N 3.4Å; V101-T119 PolarHBondContact O-OG1 3.44Å; T119-E121 VanDerWaalsContact C-N 3.32Å; T119-L124 HydrophobicContact CG2-CD2 4.23Å; T119-L128 HydrophobicContact CG2-CD1 3.77Å; T119-T131 PolarHBondContact OG1-O 2.94Å; T119-A136 HydrophobicContact CG2-CB 4.19Å; T119-V140 HydrophobicContact CG2-CG2 3.69Å
120	K	96.9	Very high	96.3	Very high	134 Å²	134	71.2 Å²	71.2	58%	0.583	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-27	166.8	-65.8	177.3	-177.6	177.5	0	112.4	Y100 S118 W122	Y100-K120 HydrophobicContact CD1-CG 3.72Å; Y100-K120 HydrophobicContact CD2-CD 4.47Å; Y100-K120 HydrophobicContact CD2-CG 4.02Å; Y100-K120 HydrophobicContact CE1-CG 4.09Å; Y100-K120 HydrophobicContact CE2-CG 4.36Å; Y100-K120 HydrophobicContact CG-CD 4.5Å; Y100-K120 HydrophobicContact CG-CG 3.69Å; S118-K120 PolarHBondContact O-N 3.24Å; S118-K120 VanDerWaalsContact O-N 3.11Å; S118-K120 WeakPolarHBondContact OG-CB 3.29Å; S118-K120 WeakPolarHBondContact OG-CG 3.48Å; S118-K120 PolarHBondContact OG-N 3.07Å; S118-K120 VanDerWaalsContact OG-N 3.08Å; K120-W122 PolarHBondContact O-N 3.02Å
121	E	97.6	Very high	96.6	Very high	50 Å²	50	67.9 Å²	67.9	23%	0.234	38%	0.384	C	S	.	.	S	Bend	trans	-66	127.7	178.7	-62.5	174.7	-152.8	0	0	109.6	C117 S118 T119 A123 L124 K125 R147	C117-E121 WeakPolarHBondContact CA-OE1 3.34Å; S118-E121 PolarHBondContact N-OE1 2.86Å; S118-E121 VanDerWaalsContact N-OE1 3.13Å; S118-E121 VanDerWaalsContact O-CB 3.27Å; S118-E121 WeakPolarHBondContact O-CB 3.3Å; S118-E121 WeakPolarHBondContact O-CG 3.36Å; S118-E121 PolarHBondContact O-N 2.82Å; T119-E121 VanDerWaalsContact C-N 3.32Å; E121-A123 PolarHBondContact O-N 2.95Å; E121-L124 PolarHBondContact O-N 3.4Å; E121-L124 VanDerWaalsContact O-N 3.16Å; E121-K125 WeakPolarHBondContact O-CB 3.44Å; E121-K125 PolarHBondContact O-N 2.83Å; E121-R147 IonicContact OE1-CZ 3.89Å; E121-R147 IonicContact OE1-NH1 2.93Å; E121-R147 PolarHBondContact OE1-NH1 3.1Å; E121-R147 IonicContact OE1-NH2 3.92Å; E121-R147 IonicContact OE2-CZ 3.37Å; E121-R147 IonicContact OE2-NH1 3.14Å; E121-R147 PolarHBondContact OE2-NH1 3.17Å; E121-R147 VanDerWaalsContact OE2-NH1 3.14Å; E121-R147 IonicContact OE2-NH2 2.68Å; E121-R147 PolarHBondContact OE2-NH2 2.88Å
122	W	96.7	Very high	96.7	Very high	177 Å²	177	69.6 Å²	69.6	67%	0.67	37%	0.37	S	S	*	.	H	α-helix	trans	-60.3	-36.3	-175.7	-177	79.6	0	0	0	112.6	K120 L124 K125 R126	K120-W122 PolarHBondContact O-N 3.02Å; W122-L124 VanDerWaalsContact C-N 3.28Å; W122-L124 PolarHBondContact O-N 3.49Å; W122-K125 PolarHBondContact O-N 3.44Å; W122-R126 VanDerWaalsContact CH2-CZ 3.49Å; W122-R126 PolarHBondContact O-N 3.13Å
123	A	96.9	Very high	96.7	Very high	54 Å²	54	66.5 Å²	66.5	45%	0.446	35%	0.353	S	S	.	.	H	α-helix	trans	-57.2	-41.2	178.6	0	0	0	0	0	112.6	E121	E121-A123 PolarHBondContact O-N 2.95Å
124	L	96.3	Very high	96.7	Very high	16 Å²	16	67.6 Å²	67.6	8%	0.084	36%	0.359	C	S	.	.	H	α-helix	trans	-83	-39.4	177.7	-172.8	60.5	0	0	0	111.5	T119 E121 W122 R126 E127 L128 A139 V140 V143	T119-L124 HydrophobicContact CG2-CD2 4.23Å; E121-L124 PolarHBondContact O-N 3.4Å; E121-L124 VanDerWaalsContact O-N 3.16Å; W122-L124 VanDerWaalsContact C-N 3.28Å; W122-L124 PolarHBondContact O-N 3.49Å; L124-R126 VanDerWaalsContact C-N 3.28Å; L124-R126 PolarHBondContact O-N 3.27Å; L124-E127 PolarHBondContact O-N 3.05Å; L124-L128 HydrophobicContact CD1-CD1 4.3Å; L124-L128 HydrophobicContact CD2-CD1 4.41Å; L124-L128 HydrophobicContact CG-CD1 3.83Å; L124-L128 HydrophobicContact CG-CG 4.45Å; L124-L128 WeakPolarHBondContact O-CG 3.49Å; L124-L128 PolarHBondContact O-N 3.18Å; L124-A139 HydrophobicContact CD1-CB 4.1Å; L124-V140 HydrophobicContact CD2-CG2 3.56Å; L124-V143 HydrophobicContact CD1-CG2 4.11Å
125	K	96.9	Very high	96.8	Very high	96 Å²	96	67 Å²	67	42%	0.417	36%	0.361	S	S	.	.	H	α-helix	trans	-60.2	-35.9	-177.4	-172.3	174.4	176.8	-177.5	0	112.9	E121 W122 E127 L128 T131	E121-K125 WeakPolarHBondContact O-CB 3.44Å; E121-K125 PolarHBondContact O-N 2.83Å; W122-K125 PolarHBondContact O-N 3.44Å; K125-E127 VanDerWaalsContact C-N 3.32Å; K125-E127 PolarHBondContact O-N 2.97Å; K125-L128 PolarHBondContact O-N 3.5Å; K125-T131 HydrophobicContact CD-CG2 4.45Å; K125-T131 HydrophobicContact CG-CG2 3.99Å
126	R	97.1	Very high	96.8	Very high	133 Å²	133	65.5 Å²	65.5	50%	0.502	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-31.9	-178.6	86.9	179.9	102.9	-179.6	4.6	113.2	W122 L124 L128	W122-R126 VanDerWaalsContact CH2-CZ 3.49Å; W122-R126 PolarHBondContact O-N 3.13Å; L124-R126 VanDerWaalsContact C-N 3.28Å; L124-R126 PolarHBondContact O-N 3.27Å; R126-L128 VanDerWaalsContact C-N 3.33Å
127	E	96.4	Very high	96.8	Very high	144 Å²	144	62.8 Å²	62.8	67%	0.673	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-13.6	-177.3	-58.1	-56.7	142.2	0	0	111.9	L124 K125	L124-E127 PolarHBondContact O-N 3.05Å; K125-E127 VanDerWaalsContact C-N 3.32Å; K125-E127 PolarHBondContact O-N 2.97Å
128	L	96.4	Very high	96.8	Very high	30 Å²	30	66.6 Å²	66.6	16%	0.157	35%	0.352	C	S	.	.			trans	-99.4	127.7	-175.5	-68.2	175.8	0	0	0	111.6	T119 L124 K125 R126 S130 A136 A139	T119-L128 HydrophobicContact CG2-CD1 3.77Å; L124-L128 HydrophobicContact CD1-CD1 4.3Å; L124-L128 HydrophobicContact CD2-CD1 4.41Å; L124-L128 HydrophobicContact CG-CD1 3.83Å; L124-L128 HydrophobicContact CG-CG 4.45Å; L124-L128 WeakPolarHBondContact O-CG 3.49Å; L124-L128 PolarHBondContact O-N 3.18Å; K125-L128 PolarHBondContact O-N 3.5Å; R126-L128 VanDerWaalsContact C-N 3.33Å; L128-S130 PolarHBondContact O-N 2.89Å; L128-A136 HydrophobicContact CD1-CB 3.92Å; L128-A136 HydrophobicContact CD2-CB 4.31Å; L128-A139 HydrophobicContact CD2-CB 3.88Å
129	G	94.6	Very high	96.9	Very high	93 Å²	93	66.8 Å²	66.8	96%	0.959	36%	0.355	S	S	*	.	S	Bend	trans	-67	-24.3	169.3	0	0	0	0	0	113.7
130	S	96.1	Very high	96.9	Very high	49 Å²	49	66.8 Å²	66.8	34%	0.343	36%	0.355	S	S	.	.			trans	-152	143.2	174.4	-174.3	0	0	0	0	110.9	L128 C133 A136	L128-S130 PolarHBondContact O-N 2.89Å; S130-C133 PolarHBondContact O-SG 2.85Å; S130-C133 VanDerWaalsContact O-SG 3.36Å; S130-A136 WeakPolarHBondContact O-CB 3.43Å
131	T	96.6	Very high	96.9	Very high	28 Å²	28	60.4 Å²	60.4	17%	0.172	33%	0.327	C	S	.	.	S	Bend	trans	-87.6	-0.6	-175.8	50.9	0	0	0	0	114.6	H99 V101 T119 K125	H99-T131 VanDerWaalsContact O-CB 3.29Å; H99-T131 WeakPolarHBondContact O-CB 3.25Å; H99-T131 PolarHBondContact O-OG1 2.96Å; V101-T131 PolarHBondContact N-O 3.4Å; T119-T131 PolarHBondContact OG1-O 2.94Å; K125-T131 HydrophobicContact CD-CG2 4.45Å; K125-T131 HydrophobicContact CG-CG2 3.99Å
132	R	94.6	Very high	97	Very high	132 Å²	132	62.3 Å²	62.3	50%	0.498	34%	0.336	S	S	.	.	S	Bend	trans	-125.5	-5.3	-175.7	72.8	174.9	-169.7	170.6	2.4	115.2	R96	R96-R132 PolarHBondContact NH1-O 3.04Å
133	C	95.8	Very high	97	Very high	45 Å²	45	55.7 Å²	55.7	30%	0.304	32%	0.315	S	S	.	.	S	Bend	trans	-73.8	171.8	-175.7	64	0	0	0	0	111.8	S130 A135 A136 S137	S130-C133 PolarHBondContact O-SG 2.85Å; S130-C133 VanDerWaalsContact O-SG 3.36Å; C133-A135 VanDerWaalsContact C-N 3.31Å; C133-A136 WeakPolarHBondContact O-CB 3.38Å; C133-A136 PolarHBondContact O-N 2.9Å; C133-A136 PolarHBondContact SG-N 2.79Å; C133-S137 PolarHBondContact O-N 3.18Å; C133-S137 PolarHBondContact O-OG 3.43Å
134	V	97.3	Very high	97.1	Very high	63 Å²	63	53.1 Å²	53.1	38%	0.382	29%	0.294	S	S	.	.	H	α-helix	trans	-62.1	-41.9	176	179.3	0	0	0	0	110.3	A136 S137 Q138 D168 S172	V134-A136 VanDerWaalsContact C-N 3.29Å; V134-A136 PolarHBondContact O-N 2.91Å; V134-S137 WeakPolarHBondContact O-CA 3.4Å; V134-S137 WeakPolarHBondContact O-CB 3.48Å; V134-S137 PolarHBondContact O-N 3.12Å; V134-Q138 PolarHBondContact O-N 3.01Å; V134-D168 HydrophobicContact CG1-CB 4.44Å; V134-D168 HydrophobicContact CG2-CB 4.25Å; V134-S172 VanDerWaalsContact CG1-OG 3.28Å; V134-S172 WeakPolarHBondContact CG1-OG 3.45Å
135	A	97.4	Very high	97.2	Very high	60 Å²	60	52.4 Å²	52.4	50%	0.496	29%	0.29	S	S	.	.	H	α-helix	trans	-59	-36.5	175.1	0	0	0	0	0	113	C133 S137 Q138 A139	C133-A135 VanDerWaalsContact C-N 3.31Å; A135-S137 VanDerWaalsContact C-N 3.29Å; A135-S137 PolarHBondContact O-N 2.72Å; A135-Q138 WeakPolarHBondContact O-CB 3.34Å; A135-Q138 PolarHBondContact O-N 2.88Å; A135-A139 WeakPolarHBondContact O-CB 3.32Å; A135-A139 PolarHBondContact O-N 2.83Å
136	A	97.8	Very high	97.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.5	-36.1	173.3	0	0	0	0	0	112.1	T119 L128 S130 C133 V134 V140	T119-A136 HydrophobicContact CG2-CB 4.19Å; L128-A136 HydrophobicContact CD1-CB 3.92Å; L128-A136 HydrophobicContact CD2-CB 4.31Å; S130-A136 WeakPolarHBondContact O-CB 3.43Å; C133-A136 WeakPolarHBondContact O-CB 3.38Å; C133-A136 PolarHBondContact O-N 2.9Å; C133-A136 PolarHBondContact SG-N 2.79Å; V134-A136 VanDerWaalsContact C-N 3.29Å; V134-A136 PolarHBondContact O-N 2.91Å; A136-V140 WeakPolarHBondContact O-CB 3.43Å; A136-V140 WeakPolarHBondContact O-CG2 3.42Å; A136-V140 PolarHBondContact O-N 2.78Å
137	S	97.8	Very high	97.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-69.5	-38.5	177.7	-50.9	0	0	0	0	110.9	C133 V134 A135 G141 A169 F173	C133-S137 PolarHBondContact O-N 3.18Å; C133-S137 PolarHBondContact O-OG 3.43Å; V134-S137 WeakPolarHBondContact O-CA 3.4Å; V134-S137 WeakPolarHBondContact O-CB 3.48Å; V134-S137 PolarHBondContact O-N 3.12Å; A135-S137 VanDerWaalsContact C-N 3.29Å; A135-S137 PolarHBondContact O-N 2.72Å; S137-G141 PolarHBondContact O-N 3.2Å; S137-G141 VanDerWaalsContact O-N 3.15Å; S137-A169 WeakPolarHBondContact CB-O 3.36Å; S137-F173 WeakPolarHBondContact O-CD2 3.48Å
138	Q	98.3	Very high	97.4	Very high	81 Å²	81	43.4 Å²	43.4	38%	0.379	25%	0.252	S	S	.	.	H	α-helix	trans	-62	-53.2	172	-173.3	-175.3	-31.7	0	0	111.6	V134 A135 V140 G141 E142 A176	V134-Q138 PolarHBondContact O-N 3.01Å; A135-Q138 WeakPolarHBondContact O-CB 3.34Å; A135-Q138 PolarHBondContact O-N 2.88Å; Q138-V140 VanDerWaalsContact C-N 3.32Å; Q138-V140 PolarHBondContact O-N 2.96Å; Q138-G141 CarbonylContact O-C 3.57Å; Q138-G141 WeakPolarHBondContact O-CA 3.28Å; Q138-G141 PolarHBondContact O-N 3.43Å; Q138-E142 WeakPolarHBondContact CG-OE1 3.21Å; Q138-E142 PolarHBondContact NE2-OE1 3.01Å; Q138-E142 PolarHBondContact O-N 3.36Å; Q138-A176 HydrophobicContact CG-CB 4.11Å
139	A	98.3	Very high	97.4	Very high	18 Å²	18	48.2 Å²	48.2	15%	0.149	27%	0.273	C	S	.	.	H	α-helix	trans	-60.9	-38.3	-179	0	0	0	0	0	112.7	L124 L128 A135 G141 E142 V143	L124-A139 HydrophobicContact CD1-CB 4.1Å; L128-A139 HydrophobicContact CD2-CB 3.88Å; A135-A139 WeakPolarHBondContact O-CB 3.32Å; A135-A139 PolarHBondContact O-N 2.83Å; A139-G141 VanDerWaalsContact C-N 3.28Å; A139-G141 PolarHBondContact O-N 3.33Å; A139-E142 PolarHBondContact O-N 3.45Å; A139-V143 WeakPolarHBondContact O-CG2 3.41Å; A139-V143 PolarHBondContact O-N 3.49Å
140	V	98.4	Very high	97.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59.8	-40.8	171.2	168.1	0	0	0	0	111.1	V101 A103 C117 T119 L124 A136 Q138 L144 F173	V101-V140 HydrophobicContact CB-CG2 4.34Å; V101-V140 HydrophobicContact CG1-CB 4.43Å; V101-V140 HydrophobicContact CG1-CG1 4.44Å; V101-V140 HydrophobicContact CG1-CG2 4.15Å; A103-V140 HydrophobicContact CB-CG1 3.49Å; A103-V140 VanDerWaalsContact CB-CG1 3.49Å; C117-V140 HydrophobicContact CB-CG1 4.28Å; T119-V140 HydrophobicContact CG2-CG2 3.69Å; L124-V140 HydrophobicContact CD2-CG2 3.56Å; A136-V140 WeakPolarHBondContact O-CB 3.43Å; A136-V140 WeakPolarHBondContact O-CG2 3.42Å; A136-V140 PolarHBondContact O-N 2.78Å; Q138-V140 VanDerWaalsContact C-N 3.32Å; Q138-V140 PolarHBondContact O-N 2.96Å; V140-L144 WeakPolarHBondContact O-CB 3.39Å; V140-L144 PolarHBondContact O-N 3.04Å; V140-F173 HydrophobicContact CG1-CE2 4.22Å
141	G	98.1	Very high	97.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.6	-44.8	176.6	0	0	0	0	0	112.9	S137 Q138 A139 L144 A145 F173 M177	S137-G141 PolarHBondContact O-N 3.2Å; S137-G141 VanDerWaalsContact O-N 3.15Å; Q138-G141 CarbonylContact O-C 3.57Å; Q138-G141 WeakPolarHBondContact O-CA 3.28Å; Q138-G141 PolarHBondContact O-N 3.43Å; A139-G141 VanDerWaalsContact C-N 3.28Å; A139-G141 PolarHBondContact O-N 3.33Å; G141-L144 PolarHBondContact O-N 3.3Å; G141-A145 VanDerWaalsContact O-CB 3.25Å; G141-A145 WeakPolarHBondContact O-CB 3.43Å; G141-A145 PolarHBondContact O-N 2.96Å; G141-F173 VanDerWaalsContact CA-CD2 3.48Å; G141-M177 VanDerWaalsContact O-SD 3.33Å
142	E	98.3	Very high	97.5	Very high	89 Å²	89	50.4 Å²	50.4	42%	0.416	27%	0.268	S	S	.	.	H	α-helix	trans	-61.7	-50.4	178.5	-67.8	170.9	-172.6	0	0	111.4	Q138 A139 L144 A145 Q146 A176	Q138-E142 WeakPolarHBondContact CG-OE1 3.21Å; Q138-E142 PolarHBondContact NE2-OE1 3.01Å; Q138-E142 PolarHBondContact O-N 3.36Å; A139-E142 PolarHBondContact O-N 3.45Å; E142-L144 PolarHBondContact O-N 3.05Å; E142-A145 PolarHBondContact O-N 3.02Å; E142-Q146 PolarHBondContact O-N 3.08Å; E142-A176 HydrophobicContact CG-CB 3.87Å
143	V	98.4	Very high	97.5	Very high	39 Å²	39	44.2 Å²	44.2	24%	0.236	25%	0.245	C	C	.	.	H	α-helix	trans	-64.6	-42.3	179.3	173.2	0	0	0	0	111.1	L124 A139 Q146 R147	L124-V143 HydrophobicContact CD1-CG2 4.11Å; A139-V143 WeakPolarHBondContact O-CG2 3.41Å; A139-V143 PolarHBondContact O-N 3.49Å; V143-Q146 PolarHBondContact O-N 2.89Å; V143-R147 WeakPolarHBondContact O-CG 3.46Å; V143-R147 PolarHBondContact O-N 3.27Å
144	L	98.3	Very high	97.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.8	-40.9	177.9	-174.2	66.1	0	0	0	111.4	L92 A103 V105 L115 C117 V140 G141 E142 Q146 R147 C148 F173 M177	L92-L144 HydrophobicContact CD1-CD2 3.63Å; A103-L144 HydrophobicContact CB-CD2 3.62Å; V105-L144 HydrophobicContact CG2-CD1 4.37Å; V105-L144 HydrophobicContact CG2-CD2 4.27Å; L115-L144 HydrophobicContact CB-CD1 4.17Å; C117-L144 HydrophobicContact CB-CB 3.95Å; C117-L144 HydrophobicContact CB-CD1 3.93Å; C117-L144 HydrophobicContact CB-CG 4.45Å; V140-L144 WeakPolarHBondContact O-CB 3.39Å; V140-L144 PolarHBondContact O-N 3.04Å; G141-L144 PolarHBondContact O-N 3.3Å; E142-L144 PolarHBondContact O-N 3.05Å; L144-Q146 VanDerWaalsContact C-N 3.33Å; L144-Q146 PolarHBondContact O-N 3.2Å; L144-R147 PolarHBondContact O-N 3.21Å; L144-C148 WeakPolarHBondContact O-CB 3.28Å; L144-C148 PolarHBondContact O-N 2.82Å; L144-C148 PolarHBondContact O-SG 3.46Å; L144-F173 HydrophobicContact CD2-CZ 4.35Å; L144-M177 HydrophobicContact CB-SD 4.12Å; L144-M177 HydrophobicContact CD2-CE 4.33Å; L144-M177 HydrophobicContact CD2-SD 4.15Å; L144-M177 HydrophobicContact CG-CE 4.48Å; L144-M177 HydrophobicContact CG-SD 4.24Å
145	A	98.3	Very high	97.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-42.2	176.8	0	0	0	0	0	111.6	G141 E142 C148 H149 M177 V182	G141-A145 VanDerWaalsContact O-CB 3.25Å; G141-A145 WeakPolarHBondContact O-CB 3.43Å; G141-A145 PolarHBondContact O-N 2.96Å; E142-A145 PolarHBondContact O-N 3.02Å; A145-C148 WeakPolarHBondContact O-CB 3.26Å; A145-C148 PolarHBondContact O-N 2.82Å; A145-H149 PolarHBondContact O-N 3.43Å; A145-M177 HydrophobicContact CB-SD 3.93Å; A145-V182 HydrophobicContact CB-CG2 4.09Å
146	Q	98	Very high	97.4	Very high	116 Å²	116	45.7 Å²	45.7	54%	0.542	23%	0.232	S	C	.	.	H	α-helix	trans	-60.9	-45.7	173.7	-173.3	-178.2	2.7	0	0	111.8	E142 V143 L144 C148 H149 Q150	E142-Q146 PolarHBondContact O-N 3.08Å; V143-Q146 PolarHBondContact O-N 2.89Å; L144-Q146 VanDerWaalsContact C-N 3.33Å; L144-Q146 PolarHBondContact O-N 3.2Å; Q146-C148 VanDerWaalsContact C-N 3.31Å; Q146-C148 PolarHBondContact O-N 2.99Å; Q146-H149 PolarHBondContact O-N 3.19Å; Q146-Q150 WeakPolarHBondContact O-CG 3.26Å; Q146-Q150 PolarHBondContact O-N 2.76Å
147	R	98.3	Very high	97.4	Very high	69 Å²	69	47.1 Å²	47.1	26%	0.26	24%	0.241	S	C	.	.	H	α-helix	trans	-60.3	-41	175	-71.6	177.7	-176	-178.4	4	111.7	L115 S116 E121 V143 L144 Q150 A151	L115-R147 HydrophobicContact CD1-CB 4.45Å; S116-R147 PolarHBondContact O-NH1 3.12Å; E121-R147 IonicContact OE1-CZ 3.89Å; E121-R147 IonicContact OE1-NH1 2.93Å; E121-R147 PolarHBondContact OE1-NH1 3.1Å; E121-R147 IonicContact OE1-NH2 3.92Å; E121-R147 IonicContact OE2-CZ 3.37Å; E121-R147 IonicContact OE2-NH1 3.14Å; E121-R147 PolarHBondContact OE2-NH1 3.17Å; E121-R147 VanDerWaalsContact OE2-NH1 3.14Å; E121-R147 IonicContact OE2-NH2 2.68Å; E121-R147 PolarHBondContact OE2-NH2 2.88Å; V143-R147 WeakPolarHBondContact O-CG 3.46Å; V143-R147 PolarHBondContact O-N 3.27Å; L144-R147 PolarHBondContact O-N 3.21Å; R147-Q150 PolarHBondContact O-N 2.92Å; R147-A151 WeakPolarHBondContact O-CB 3.2Å; R147-A151 PolarHBondContact O-N 3.14Å
148	C	97.9	Very high	97.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.8	-42.9	176.6	-68.3	0	0	0	0	111.4	L115 L144 A145 Q146 A151 G152 I153 M156 V182	L115-C148 HydrophobicContact CD1-CB 4.25Å; L144-C148 WeakPolarHBondContact O-CB 3.28Å; L144-C148 PolarHBondContact O-N 2.82Å; L144-C148 PolarHBondContact O-SG 3.46Å; A145-C148 WeakPolarHBondContact O-CB 3.26Å; A145-C148 PolarHBondContact O-N 2.82Å; Q146-C148 VanDerWaalsContact C-N 3.31Å; Q146-C148 PolarHBondContact O-N 2.99Å; C148-A151 CarbonylContact O-C 3.51Å; C148-A151 PolarHBondContact O-N 3.37Å; C148-G152 PolarHBondContact O-N 3.32Å; C148-G152 VanDerWaalsContact O-N 3.08Å; C148-I153 CarbonylContact C-O 2.9Å; C148-I153 HydrophobicContact CB-CB 4.44Å; C148-I153 WeakPolarHBondContact CB-O 3.45Å; C148-I153 PolarHBondContact O-N 2.77Å; C148-M156 HydrophobicContact CB-CE 4.38Å; C148-V182 HydrophobicContact CB-CG2 3.96Å
149	H	96.2	Very high	96.9	Very high	130 Å²	130	50.6 Å²	50.6	60%	0.602	25%	0.251	S	S	*	.	H	α-helix	trans	-62.2	-46.8	176.4	-169.4	78	0	0	0	111.7	A145 Q146 A151 G152	A145-H149 PolarHBondContact O-N 3.43Å; Q146-H149 PolarHBondContact O-N 3.19Å; H149-A151 VanDerWaalsContact C-N 3.29Å; H149-A151 PolarHBondContact O-N 3.29Å; H149-G152 PolarHBondContact O-N 3.08Å
150	Q	97.3	Very high	96.5	Very high	141 Å²	141	51.3 Å²	51.3	66%	0.659	25%	0.251	S	S	*	.	H	α-helix	trans	-61.8	-35.4	176.4	-70	171.3	-9.2	0	0	112.7	Q146 R147 G152	Q146-Q150 WeakPolarHBondContact O-CG 3.26Å; Q146-Q150 PolarHBondContact O-N 2.76Å; R147-Q150 PolarHBondContact O-N 2.92Å; Q150-G152 VanDerWaalsContact C-N 3.27Å; Q150-G152 PolarHBondContact O-N 3.02Å
151	A	96.2	Very high	96.2	Very high	37 Å²	37	53.7 Å²	53.7	31%	0.306	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-2.8	175.6	0	0	0	0	0	114	R65 L115 R147 C148 H149 I153	R65-A151 PolarHBondContact NH1-O 3.46Å; L115-A151 HydrophobicContact CD1-CB 3.95Å; L115-A151 HydrophobicContact CD2-CB 4.28Å; R147-A151 WeakPolarHBondContact O-CB 3.2Å; R147-A151 PolarHBondContact O-N 3.14Å; C148-A151 CarbonylContact O-C 3.51Å; C148-A151 PolarHBondContact O-N 3.37Å; H149-A151 VanDerWaalsContact C-N 3.29Å; H149-A151 PolarHBondContact O-N 3.29Å; A151-I153 VanDerWaalsContact C-N 3.32Å; A151-I153 HydrophobicContact CB-CD1 4.31Å; A151-I153 HydrophobicContact CB-CG1 4.32Å; A151-I153 PolarHBondContact O-N 3.14Å
152	G	95.8	Very high	95.8	Very high	39 Å²	39	57.8 Å²	57.8	40%	0.402	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	31.7	-175.4	0	0	0	0	0	113.6	R65 C148 H149 Q150	R65-G152 PolarHBondContact NH2-O 3.43Å; C148-G152 PolarHBondContact O-N 3.32Å; C148-G152 VanDerWaalsContact O-N 3.08Å; H149-G152 PolarHBondContact O-N 3.08Å; Q150-G152 VanDerWaalsContact C-N 3.27Å; Q150-G152 PolarHBondContact O-N 3.02Å
153	I	96.2	Very high	95.4	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.01	30%	0.302	C	S	.	.			trans	-104.1	101.9	173	-59.1	172.4	0	0	0	108	V114 L115 C148 A151 M156	V114-I153 HydrophobicContact CG1-CD1 4.05Å; L115-I153 HydrophobicContact CD1-CD1 3.95Å; L115-I153 HydrophobicContact CG-CD1 4.43Å; C148-I153 CarbonylContact C-O 2.9Å; C148-I153 HydrophobicContact CB-CB 4.44Å; C148-I153 WeakPolarHBondContact CB-O 3.45Å; C148-I153 PolarHBondContact O-N 2.77Å; A151-I153 VanDerWaalsContact C-N 3.32Å; A151-I153 HydrophobicContact CB-CD1 4.31Å; A151-I153 HydrophobicContact CB-CG1 4.32Å; A151-I153 PolarHBondContact O-N 3.14Å; I153-M156 HydrophobicContact CG2-CE 3.64Å
154	T	95.6	Very high	95	Very high	71 Å²	71	64.1 Å²	64.1	44%	0.436	31%	0.309	S	S	.	.			trans	-103.9	-19.1	-176.7	54.3	0	0	0	0	113.6	T183	T154-T183 PolarHBondContact O-N 3Å
155	R	95.8	Very high	94.6	Very high	127 Å²	127	67.9 Å²	67.9	48%	0.479	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-131.8	134	-174.6	-54.4	-171.4	-177.3	-171.5	-1.3	110.4	T183	R155-T183 WeakPolarHBondContact CA-O 3.34Å
156	M	96.6	Very high	94.3	Very high	0 Å²	0	77.1 Å²	77.1	0%	0	36%	0.359	C	S	.	.			trans	-156.5	156.8	178.8	57.7	-173.1	66.4	0	0	110.1	H90 L92 V105 C148 I153 M177 V182 T183 L184 S185	H90-M156 HydrophobicContact CB-CB 3.91Å; H90-M156 CarbonylContact O-C 3.55Å; H90-M156 WeakPolarHBondContact O-CA 3.29Å; H90-M156 WeakPolarHBondContact O-CB 3.44Å; L92-M156 HydrophobicContact CB-CG 4.22Å; L92-M156 HydrophobicContact CB-SD 3.68Å; L92-M156 HydrophobicContact CD1-SD 3.94Å; L92-M156 HydrophobicContact CD2-SD 4Å; L92-M156 HydrophobicContact CG-SD 4.09Å; V105-M156 HydrophobicContact CG1-CE 4.16Å; V105-M156 HydrophobicContact CG2-CE 3.99Å; V105-M156 HydrophobicContact CG2-SD 4.15Å; C148-M156 HydrophobicContact CB-CE 4.38Å; I153-M156 HydrophobicContact CG2-CE 3.64Å; M156-M177 HydrophobicContact CE-CE 4.35Å; M156-M177 HydrophobicContact SD-CE 3.89Å; M156-V182 HydrophobicContact CE-CG1 3.68Å; M156-V182 HydrophobicContact CG-CG1 3.93Å; M156-V182 HydrophobicContact SD-CG1 3.9Å; M156-T183 PolarHBondContact N-O 3.3Å; M156-T183 VanDerWaalsContact N-O 3.1Å; M156-L184 HydrophobicContact CG-CD2 4.09Å; M156-L184 CarbonylContact O-C 3.57Å; M156-L184 WeakPolarHBondContact O-CA 3.49Å; M156-L184 HydrophobicContact SD-CD2 4.42Å; M156-S185 PolarHBondContact O-N 2.94Å; M156-S185 VanDerWaalsContact O-N 3.12Å
157	V	96.4	Very high	94.2	Very high	30 Å²	30	73.9 Å²	73.9	18%	0.182	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	125.9	174.1	177.3	0	0	0	0	109.7	F88 H90 R91 L92 R159 E186	F88-V157 HydrophobicContact CB-CB 4.01Å; F88-V157 HydrophobicContact CB-CG2 3.71Å; H90-V157 PolarHBondContact O-N 3.15Å; R91-V157 WeakPolarHBondContact CA-O 3.33Å; L92-V157 PolarHBondContact N-O 3.33Å; V157-R159 HydrophobicContact CG1-CG 4.03Å; V157-E186 HydrophobicContact CG2-CB 4.13Å; V157-E186 HydrophobicContact CG2-CG 3.77Å
158	Y	95.8	Very high	94.1	Very high	17 Å²	17	75.8 Å²	75.8	7%	0.067	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	117.7	167	-177	-125.9	0	0	0	110.2	L92 F94 H160 Y165 V170 L184	L92-Y158 HydrophobicContact CB-CD2 3.98Å; L92-Y158 HydrophobicContact CD2-CD2 3.95Å; L92-Y158 HydrophobicContact CD2-CG 4.21Å; L92-Y158 HydrophobicContact CG-CD2 3.95Å; F94-Y158 HydrophobicContact CB-CE2 3.92Å; Y158-H160 HydrophobicContact CE1-CB 4.34Å; Y158-H160 HydrophobicContact CE2-CB 4.42Å; Y158-H160 AromaticContact CZ-CD2 3.86Å; Y158-H160 PolarHBondContact OH-CD2 2.94Å; Y158-Y165 HydrophobicContact CD1-CE2 4.06Å; Y158-Y165 HydrophobicContact CE1-CD2 4.27Å; Y158-Y165 AromaticContact CE1-CE2 3.88Å; Y158-Y165 HydrophobicContact CE1-CE2 3.88Å; Y158-V170 HydrophobicContact CE1-CG1 4.04Å; Y158-V170 VanDerWaalsContact OH-CG1 3.28Å; Y158-V170 WeakPolarHBondContact OH-CG1 3.47Å; Y158-L184 HydrophobicContact CD1-CD1 4.41Å
159	R	91.5	Very high	94	Very high	137 Å²	137	76.1 Å²	76.1	52%	0.517	37%	0.367	S	S	.	.			trans	-125.7	130.2	169.3	-72.8	-160.6	-177	-167.4	3.5	109.3	V157	V157-R159 HydrophobicContact CG1-CG 4.03Å
160	H	89.9	Confident	94.1	Very high	34 Å²	34	70 Å²	70	16%	0.157	34%	0.339	C	S	.	.			trans	-130.7	164.2	175.3	-149.5	-91.5	0	0	0	109.2	F94 Y158 Q164 Y165	F94-H160 PolarHBondContact O-NE2 2.97Å; Y158-H160 HydrophobicContact CE1-CB 4.34Å; Y158-H160 HydrophobicContact CE2-CB 4.42Å; Y158-H160 AromaticContact CZ-CD2 3.86Å; Y158-H160 PolarHBondContact OH-CD2 2.94Å; H160-Q164 WeakPolarHBondContact CE1-CB 3.41Å; H160-Q164 PolarHBondContact CE1-OE1 2.91Å; H160-Q164 WeakPolarHBondContact ND1-CB 3.38Å; H160-Q164 PolarHBondContact ND1-OE1 2.71Å; H160-Y165 HydrophobicContact CB-CD2 3.91Å
161	I	92.1	Very high	94	Very high	49 Å²	49	68 Å²	68	25%	0.251	33%	0.329	S	S	.	.			trans	-66.9	132.7	177.3	-53	178.3	0	0	0	109.2	W83 W163 Q164 Y165	W83-I161 HydrophobicContact CH2-CG1 3.65Å; W83-I161 HydrophobicContact CZ2-CG1 4.19Å; W83-I161 HydrophobicContact CZ3-CG1 4.14Å; I161-W163 HydrophobicContact CB-CZ2 4.48Å; I161-W163 HydrophobicContact CG2-CD2 3.48Å; I161-W163 VanDerWaalsContact CG2-CD2 3.48Å; I161-W163 HydrophobicContact CG2-CE3 3.61Å; I161-W163 HydrophobicContact CG2-CG 4.33Å; I161-W163 HydrophobicContact CG2-CH2 3.32Å; I161-W163 HydrophobicContact CG2-CZ2 3.19Å; I161-W163 HydrophobicContact CG2-CZ3 3.52Å; I161-W163 PolarHBondContact O-N 2.95Å; I161-Q164 PolarHBondContact O-N 2.94Å; I161-Y165 PolarHBondContact O-N 3.37Å
162	P	89.1	Confident	94.1	Very high	86 Å²	86	67.1 Å²	67.1	56%	0.558	32%	0.321	S	S	*	.	H	α-helix	trans	-53.9	-40.6	-168.7	-30.9	36	0	0	0	116	Y165	P162-Y165 VanDerWaalsContact O-CB 3.31Å; P162-Y165 WeakPolarHBondContact O-CB 3.46Å; P162-Y165 PolarHBondContact O-N 2.91Å
163	W	88.8	Confident	94.2	Very high	181 Å²	181	65.3 Å²	65.3	69%	0.686	30%	0.302	S	S	*	.	H	α-helix	trans	-70.7	-35.2	179.4	52.4	92	0	0	0	112.6	I161 Y165 R166	I161-W163 HydrophobicContact CB-CZ2 4.48Å; I161-W163 HydrophobicContact CG2-CD2 3.48Å; I161-W163 VanDerWaalsContact CG2-CD2 3.48Å; I161-W163 HydrophobicContact CG2-CE3 3.61Å; I161-W163 HydrophobicContact CG2-CG 4.33Å; I161-W163 HydrophobicContact CG2-CH2 3.32Å; I161-W163 HydrophobicContact CG2-CZ2 3.19Å; I161-W163 HydrophobicContact CG2-CZ3 3.52Å; I161-W163 PolarHBondContact O-N 2.95Å; W163-Y165 VanDerWaalsContact C-N 3.31Å; W163-R166 PolarHBondContact O-N 3.24Å
164	Q	90.8	Very high	94.3	Very high	80 Å²	80	68.9 Å²	68.9	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-73.4	-26.9	174.5	-69.1	170.4	-15.4	0	0	112	H160 I161 R166 S167 V170	H160-Q164 WeakPolarHBondContact CE1-CB 3.41Å; H160-Q164 PolarHBondContact CE1-OE1 2.91Å; H160-Q164 WeakPolarHBondContact ND1-CB 3.38Å; H160-Q164 PolarHBondContact ND1-OE1 2.71Å; I161-Q164 PolarHBondContact O-N 2.94Å; Q164-R166 PolarHBondContact O-N 3.37Å; Q164-S167 WeakPolarHBondContact O-CB 3.18Å; Q164-S167 PolarHBondContact O-N 3.37Å; Q164-S167 PolarHBondContact O-OG 2.83Å; Q164-V170 WeakPolarHBondContact O-CG2 3.41Å
165	Y	90.9	Very high	94.4	Very high	79 Å²	79	68.7 Å²	68.7	31%	0.31	31%	0.314	S	S	.	.	H	α-helix	trans	-61	-25.4	176.4	-159.9	-98.1	0	0	0	113	Y158 H160 I161 P162 W163 S167 V170 R174	Y158-Y165 HydrophobicContact CD1-CE2 4.06Å; Y158-Y165 HydrophobicContact CE1-CD2 4.27Å; Y158-Y165 AromaticContact CE1-CE2 3.88Å; Y158-Y165 HydrophobicContact CE1-CE2 3.88Å; H160-Y165 HydrophobicContact CB-CD2 3.91Å; I161-Y165 PolarHBondContact O-N 3.37Å; P162-Y165 VanDerWaalsContact O-CB 3.31Å; P162-Y165 WeakPolarHBondContact O-CB 3.46Å; P162-Y165 PolarHBondContact O-N 2.91Å; W163-Y165 VanDerWaalsContact C-N 3.31Å; Y165-S167 VanDerWaalsContact C-N 3.33Å; Y165-V170 HydrophobicContact CD2-CG1 4.31Å; Y165-R174 PolarHBondContact OH-NE 3.08Å; Y165-R174 PolarHBondContact OH-NH1 3.11Å; Y165-R174 PolarHBondContact OH-NH2 2.97Å
166	R	91.5	Very high	94.5	Very high	194 Å²	194	62.7 Å²	62.7	73%	0.732	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-13	176.2	-65.2	-177.7	178	137.3	-0.9	113.5	W163 Q164 Q171	W163-R166 PolarHBondContact O-N 3.24Å; Q164-R166 PolarHBondContact O-N 3.37Å; R166-Q171 PolarHBondContact O-NE2 3.41Å
167	S	95.6	Very high	94.6	Very high	48 Å²	48	62.7 Å²	62.7	34%	0.336	29%	0.292	S	S	.	.	S	Bend	trans	-68.2	141.5	-178.4	68.7	0	0	0	0	112.5	Q164 Y165 A169 V170 Q171	Q164-S167 WeakPolarHBondContact O-CB 3.18Å; Q164-S167 PolarHBondContact O-N 3.37Å; Q164-S167 PolarHBondContact O-OG 2.83Å; Y165-S167 VanDerWaalsContact C-N 3.33Å; S167-A169 PolarHBondContact O-N 3.02Å; S167-V170 PolarHBondContact O-N 3.06Å; S167-V170 WeakPolarHBondContact OG-CB 3.44Å; S167-V170 VanDerWaalsContact OG-CG2 3.28Å; S167-V170 WeakPolarHBondContact OG-CG2 3.3Å; S167-V170 PolarHBondContact OG-N 2.88Å; S167-Q171 WeakPolarHBondContact O-CG 3.48Å; S167-Q171 PolarHBondContact O-N 3.47Å
168	D	96.5	Very high	94.6	Very high	110 Å²	110	66.1 Å²	66.1	59%	0.588	31%	0.305	S	S	*	.	H	α-helix	trans	-59.5	-32.9	-179.2	-55.3	-24.5	0	0	0	112.5	V134 Q171 S172	V134-D168 HydrophobicContact CG1-CB 4.44Å; V134-D168 HydrophobicContact CG2-CB 4.25Å; D168-Q171 PolarHBondContact O-N 3.4Å; D168-S172 VanDerWaalsContact O-CB 3.32Å; D168-S172 WeakPolarHBondContact O-CB 3.38Å; D168-S172 PolarHBondContact O-N 3.12Å; D168-S172 PolarHBondContact O-OG 2.88Å
169	A	96.4	Very high	94.8	Very high	6 Å²	6	72.1 Å²	72.1	5%	0.05	33%	0.333	C	S	.	.	H	α-helix	trans	-62.8	-44.4	174.7	0	0	0	0	0	112.2	S137 S167 S172 F173	S137-A169 WeakPolarHBondContact CB-O 3.36Å; S167-A169 PolarHBondContact O-N 3.02Å; A169-S172 WeakPolarHBondContact CA-OG 3.31Å; A169-S172 PolarHBondContact O-OG 3.37Å; A169-F173 VanDerWaalsContact O-CB 3.3Å; A169-F173 WeakPolarHBondContact O-CB 3.49Å; A169-F173 PolarHBondContact O-N 2.98Å; A169-F173 VanDerWaalsContact O-N 3.13Å
170	V	96.8	Very high	95	Very high	3 Å²	3	67.3 Å²	67.3	2%	0.018	33%	0.326	C	S	.	.	H	α-helix	trans	-71.2	-37.6	177.1	170.7	0	0	0	0	110.9	F94 Y158 Q164 Y165 S167 R174	F94-V170 HydrophobicContact CD1-CG2 3.85Å; F94-V170 HydrophobicContact CE1-CG2 3.79Å; Y158-V170 HydrophobicContact CE1-CG1 4.04Å; Y158-V170 VanDerWaalsContact OH-CG1 3.28Å; Y158-V170 WeakPolarHBondContact OH-CG1 3.47Å; Q164-V170 WeakPolarHBondContact O-CG2 3.41Å; Y165-V170 HydrophobicContact CD2-CG1 4.31Å; S167-V170 PolarHBondContact O-N 3.06Å; S167-V170 WeakPolarHBondContact OG-CB 3.44Å; S167-V170 VanDerWaalsContact OG-CG2 3.28Å; S167-V170 WeakPolarHBondContact OG-CG2 3.3Å; S167-V170 PolarHBondContact OG-N 2.88Å; V170-R174 WeakPolarHBondContact O-CB 3.31Å; V170-R174 PolarHBondContact O-N 3.28Å
171	Q	96.8	Very high	95.3	Very high	97 Å²	97	68 Å²	68	45%	0.453	34%	0.342	S	S	.	.	H	α-helix	trans	-65	-50.3	177.8	-66.8	-173	30.5	0	0	111.7	R166 S167 D168 F173 R174 T175	R166-Q171 PolarHBondContact O-NE2 3.41Å; S167-Q171 WeakPolarHBondContact O-CG 3.48Å; S167-Q171 PolarHBondContact O-N 3.47Å; D168-Q171 PolarHBondContact O-N 3.4Å; Q171-F173 PolarHBondContact O-N 3.21Å; Q171-R174 WeakPolarHBondContact O-CB 3.39Å; Q171-R174 PolarHBondContact O-N 3.41Å; Q171-T175 PolarHBondContact O-N 2.85Å; Q171-T175 PolarHBondContact O-OG1 3.16Å; Q171-T175 VanDerWaalsContact O-OG1 3.05Å
172	S	97.9	Very high	95.6	Very high	20 Å²	20	65.8 Å²	65.8	14%	0.14	33%	0.331	C	S	.	.	H	α-helix	trans	-59	-47	177.2	53	0	0	0	0	112.3	V134 D168 A169 R174 T175 A176	V134-S172 VanDerWaalsContact CG1-OG 3.28Å; V134-S172 WeakPolarHBondContact CG1-OG 3.45Å; D168-S172 VanDerWaalsContact O-CB 3.32Å; D168-S172 WeakPolarHBondContact O-CB 3.38Å; D168-S172 PolarHBondContact O-N 3.12Å; D168-S172 PolarHBondContact O-OG 2.88Å; A169-S172 WeakPolarHBondContact CA-OG 3.31Å; A169-S172 PolarHBondContact O-OG 3.37Å; S172-R174 VanDerWaalsContact C-N 3.33Å; S172-R174 PolarHBondContact O-N 2.78Å; S172-T175 PolarHBondContact O-N 3.4Å; S172-A176 WeakPolarHBondContact O-CB 3.47Å; S172-A176 PolarHBondContact O-N 2.94Å
173	F	98	Very high	96	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-57	-45.1	173.8	170.5	-101.8	0	0	0	112.2	L92 F94 A103 S137 V140 G141 L144 A169 Q171 T175 A176 M177	L92-F173 HydrophobicContact CD1-CZ 4.15Å; L92-F173 HydrophobicContact CD2-CE1 3.7Å; L92-F173 HydrophobicContact CD2-CZ 3.88Å; L92-F173 HydrophobicContact CG-CE1 4.28Å; L92-F173 HydrophobicContact CG-CZ 4.26Å; F94-F173 HydrophobicContact CB-CD1 4.16Å; F94-F173 HydrophobicContact CB-CE1 3.85Å; F94-F173 HydrophobicContact CB-CZ 4.37Å; F94-F173 HydrophobicContact CD2-CB 4.32Å; F94-F173 AromaticContact CD2-CD1 3.66Å; F94-F173 HydrophobicContact CD2-CD1 3.66Å; F94-F173 AromaticContact CD2-CD2 3.73Å; F94-F173 HydrophobicContact CD2-CD2 3.73Å; F94-F173 AromaticContact CD2-CE1 3.82Å; F94-F173 HydrophobicContact CD2-CE1 3.82Å; F94-F173 AromaticContact CD2-CE2 3.89Å; F94-F173 HydrophobicContact CD2-CE2 3.89Å; F94-F173 AromaticContact CD2-CG 3.61Å; F94-F173 HydrophobicContact CD2-CG 3.61Å; F94-F173 AromaticContact CD2-CZ 3.93Å; F94-F173 HydrophobicContact CD2-CZ 3.93Å; F94-F173 HydrophobicContact CE2-CB 4Å; F94-F173 HydrophobicContact CE2-CD1 4.22Å; F94-F173 AromaticContact CE2-CD2 3.83Å; F94-F173 HydrophobicContact CE2-CD2 3.83Å; F94-F173 HydrophobicContact CE2-CE2 4.38Å; F94-F173 AromaticContact CE2-CG 3.74Å; F94-F173 HydrophobicContact CE2-CG 3.74Å; F94-F173 AromaticContact CG-CD1 3.96Å; F94-F173 HydrophobicContact CG-CD1 3.96Å; F94-F173 HydrophobicContact CG-CE1 4.08Å; F94-F173 HydrophobicContact CG-CG 4.32Å; F94-F173 HydrophobicContact CZ-CB 4.41Å; A103-F173 HydrophobicContact CB-CE2 3.67Å; A103-F173 HydrophobicContact CB-CZ 3.79Å; S137-F173 WeakPolarHBondContact O-CD2 3.48Å; V140-F173 HydrophobicContact CG1-CE2 4.22Å; G141-F173 VanDerWaalsContact CA-CD2 3.48Å; L144-F173 HydrophobicContact CD2-CZ 4.35Å; A169-F173 VanDerWaalsContact O-CB 3.3Å; A169-F173 WeakPolarHBondContact O-CB 3.49Å; A169-F173 PolarHBondContact O-N 2.98Å; A169-F173 VanDerWaalsContact O-N 3.13Å; Q171-F173 PolarHBondContact O-N 3.21Å; F173-T175 PolarHBondContact O-N 3.1Å; F173-A176 PolarHBondContact O-N 2.67Å; F173-M177 HydrophobicContact CE1-CG 4.15Å; F173-M177 HydrophobicContact CE2-CG 4.07Å; F173-M177 HydrophobicContact CE2-SD 4.38Å; F173-M177 HydrophobicContact CZ-CG 3.87Å; F173-M177 HydrophobicContact CZ-SD 4.29Å; F173-M177 WeakPolarHBondContact O-CG 3.4Å; F173-M177 PolarHBondContact O-N 3.11Å
174	R	97.1	Very high	96.4	Very high	77 Å²	77	57.4 Å²	57.4	29%	0.291	30%	0.298	S	S	.	.	H	α-helix	trans	-65.2	-39.7	180	-169.5	-168.2	173.8	-157.3	-1.7	111.9	Y165 V170 Q171 S172 K178 L184	Y165-R174 PolarHBondContact OH-NE 3.08Å; Y165-R174 PolarHBondContact OH-NH1 3.11Å; Y165-R174 PolarHBondContact OH-NH2 2.97Å; V170-R174 WeakPolarHBondContact O-CB 3.31Å; V170-R174 PolarHBondContact O-N 3.28Å; Q171-R174 WeakPolarHBondContact O-CB 3.39Å; Q171-R174 PolarHBondContact O-N 3.41Å; S172-R174 VanDerWaalsContact C-N 3.33Å; S172-R174 PolarHBondContact O-N 2.78Å; R174-K178 WeakPolarHBondContact O-CG 3.36Å; R174-K178 PolarHBondContact O-N 3.2Å; R174-L184 HydrophobicContact CB-CD1 4.38Å; R174-L184 HydrophobicContact CG-CD1 3.31Å
175	T	98.1	Very high	96.6	Very high	67 Å²	67	57 Å²	57	41%	0.411	30%	0.304	S	S	.	.	H	α-helix	trans	-64.5	-49.3	177	-61.5	0	0	0	0	110.2	Q171 S172 F173 M177 K178 E179	Q171-T175 PolarHBondContact O-N 2.85Å; Q171-T175 PolarHBondContact O-OG1 3.16Å; Q171-T175 VanDerWaalsContact O-OG1 3.05Å; S172-T175 PolarHBondContact O-N 3.4Å; F173-T175 PolarHBondContact O-N 3.1Å; T175-M177 VanDerWaalsContact C-N 3.32Å; T175-M177 PolarHBondContact O-N 3.33Å; T175-K178 WeakPolarHBondContact O-CB 3.29Å; T175-K178 PolarHBondContact O-N 3.44Å; T175-E179 HydrophobicContact CG2-CG 4.29Å; T175-E179 VanDerWaalsContact CG2-OE1 3.29Å; T175-E179 WeakPolarHBondContact CG2-OE1 3.41Å; T175-E179 WeakPolarHBondContact O-CG 3.22Å; T175-E179 PolarHBondContact O-N 2.85Å
176	A	98.2	Very high	96.7	Very high	2 Å²	2	54.7 Å²	54.7	2%	0.017	30%	0.296	C	S	.	.	H	α-helix	trans	-55.3	-43.6	175.5	0	0	0	0	0	113	Q138 E142 S172 F173 K178 E179 G180	Q138-A176 HydrophobicContact CG-CB 4.11Å; E142-A176 HydrophobicContact CG-CB 3.87Å; S172-A176 WeakPolarHBondContact O-CB 3.47Å; S172-A176 PolarHBondContact O-N 2.94Å; F173-A176 PolarHBondContact O-N 2.67Å; A176-K178 VanDerWaalsContact C-N 3.33Å; A176-K178 PolarHBondContact O-N 3.17Å; A176-E179 PolarHBondContact O-N 3.37Å; A176-G180 PolarHBondContact O-N 2.98Å
177	M	98.1	Very high	96.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-40.3	176.5	-74.6	-67.2	-66.3	0	0	112.7	L92 G141 L144 A145 M156 F173 T175 V182 L184	L92-M177 HydrophobicContact CD1-CE 4.36Å; L92-M177 HydrophobicContact CD2-CE 3.99Å; L92-M177 HydrophobicContact CD2-CG 4.37Å; G141-M177 VanDerWaalsContact O-SD 3.33Å; L144-M177 HydrophobicContact CB-SD 4.12Å; L144-M177 HydrophobicContact CD2-CE 4.33Å; L144-M177 HydrophobicContact CD2-SD 4.15Å; L144-M177 HydrophobicContact CG-CE 4.48Å; L144-M177 HydrophobicContact CG-SD 4.24Å; A145-M177 HydrophobicContact CB-SD 3.93Å; M156-M177 HydrophobicContact CE-CE 4.35Å; M156-M177 HydrophobicContact SD-CE 3.89Å; F173-M177 HydrophobicContact CE1-CG 4.15Å; F173-M177 HydrophobicContact CE2-CG 4.07Å; F173-M177 HydrophobicContact CE2-SD 4.38Å; F173-M177 HydrophobicContact CZ-CG 3.87Å; F173-M177 HydrophobicContact CZ-SD 4.29Å; F173-M177 WeakPolarHBondContact O-CG 3.4Å; F173-M177 PolarHBondContact O-N 3.11Å; T175-M177 VanDerWaalsContact C-N 3.32Å; T175-M177 PolarHBondContact O-N 3.33Å; M177-V182 HydrophobicContact CE-CB 4Å; M177-V182 HydrophobicContact CE-CG1 3.88Å; M177-V182 HydrophobicContact CE-CG2 4.02Å; M177-V182 WeakPolarHBondContact O-CB 3.43Å; M177-V182 PolarHBondContact O-N 2.85Å; M177-L184 HydrophobicContact CB-CD2 4.3Å
178	K	98.1	Very high	96.8	Very high	102 Å²	102	55.7 Å²	55.7	44%	0.443	30%	0.297	S	S	.	.	H	α-helix	trans	-71	-42.2	178.5	-71.7	174.5	176.6	-174.8	0	112	R174 T175 A176 G180 G181 L184	R174-K178 WeakPolarHBondContact O-CG 3.36Å; R174-K178 PolarHBondContact O-N 3.2Å; T175-K178 WeakPolarHBondContact O-CB 3.29Å; T175-K178 PolarHBondContact O-N 3.44Å; A176-K178 VanDerWaalsContact C-N 3.33Å; A176-K178 PolarHBondContact O-N 3.17Å; K178-G180 VanDerWaalsContact C-N 3.28Å; K178-G180 PolarHBondContact O-N 3.03Å; K178-G181 PolarHBondContact O-N 3.07Å; K178-L184 HydrophobicContact CG-CD1 4.37Å
179	E	98.1	Very high	96.7	Very high	143 Å²	143	51.8 Å²	51.8	67%	0.668	28%	0.275	S	S	*	.	H	α-helix	trans	-63.3	-36.7	176.3	-72.6	173.9	175.1	0	0	111.2	T175 A176 G181	T175-E179 HydrophobicContact CG2-CG 4.29Å; T175-E179 VanDerWaalsContact CG2-OE1 3.29Å; T175-E179 WeakPolarHBondContact CG2-OE1 3.41Å; T175-E179 WeakPolarHBondContact O-CG 3.22Å; T175-E179 PolarHBondContact O-N 2.85Å; A176-E179 PolarHBondContact O-N 3.37Å; E179-G181 PolarHBondContact O-N 3.5Å; E179-G181 VanDerWaalsContact O-N 3.08Å
180	G	96.9	Very high	96.6	Very high	35 Å²	35	58 Å²	58	36%	0.361	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	9.1	170.2	0	0	0	0	0	115.1	A176 K178	A176-G180 PolarHBondContact O-N 2.98Å; K178-G180 VanDerWaalsContact C-N 3.28Å; K178-G180 PolarHBondContact O-N 3.03Å
181	G	96.7	Very high	96.3	Very high	49 Å²	49	64.6 Å²	64.6	51%	0.505	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	10.7	173	0	0	0	0	0	115.4	K178 E179	K178-G181 PolarHBondContact O-N 3.07Å; E179-G181 PolarHBondContact O-N 3.5Å; E179-G181 VanDerWaalsContact O-N 3.08Å
182	V	97.8	Very high	95.9	Very high	3 Å²	3	66.4 Å²	66.4	2%	0.018	34%	0.341	C	S	.	.			trans	-91.4	123.4	177.6	-176.2	0	0	0	0	110.7	A145 C148 M156 M177 L184	A145-V182 HydrophobicContact CB-CG2 4.09Å; C148-V182 HydrophobicContact CB-CG2 3.96Å; M156-V182 HydrophobicContact CE-CG1 3.68Å; M156-V182 HydrophobicContact CG-CG1 3.93Å; M156-V182 HydrophobicContact SD-CG1 3.9Å; M177-V182 HydrophobicContact CE-CB 4Å; M177-V182 HydrophobicContact CE-CG1 3.88Å; M177-V182 HydrophobicContact CE-CG2 4.02Å; M177-V182 WeakPolarHBondContact O-CB 3.43Å; M177-V182 PolarHBondContact O-N 2.85Å; V182-L184 HydrophobicContact CG1-CD2 4.3Å
183	T	97.3	Very high	95.1	Very high	66 Å²	66	68.6 Å²	68.6	41%	0.405	37%	0.367	S	S	.	.	B	Isolated β-bridge	trans	-86.2	115.8	174.4	-54	0	0	0	0	110	T154 R155 M156 S185	T154-T183 PolarHBondContact O-N 3Å; R155-T183 WeakPolarHBondContact CA-O 3.34Å; M156-T183 PolarHBondContact N-O 3.3Å; M156-T183 VanDerWaalsContact N-O 3.1Å; T183-S185 WeakPolarHBondContact CG2-OG 3.45Å; T183-S185 PolarHBondContact O-N 2.94Å
184	L	96.3	Very high	93	Very high	25 Å²	25	80 Å²	80	13%	0.131	43%	0.428	C	S	.	.	S	Bend	trans	-79.9	27.4	-179.5	-57.8	178.2	0	0	0	113.8	L92 M156 Y158 R174 M177 K178 V182	L92-L184 HydrophobicContact CD2-CD2 3.66Å; M156-L184 HydrophobicContact CG-CD2 4.09Å; M156-L184 CarbonylContact O-C 3.57Å; M156-L184 WeakPolarHBondContact O-CA 3.49Å; M156-L184 HydrophobicContact SD-CD2 4.42Å; Y158-L184 HydrophobicContact CD1-CD1 4.41Å; R174-L184 HydrophobicContact CB-CD1 4.38Å; R174-L184 HydrophobicContact CG-CD1 3.31Å; M177-L184 HydrophobicContact CB-CD2 4.3Å; K178-L184 HydrophobicContact CG-CD1 4.37Å; V182-L184 HydrophobicContact CG1-CD2 4.3Å
185	S	94.8	Very high	92.8	Very high	72 Å²	72	80.2 Å²	80.2	50%	0.503	44%	0.435	S	S	.	.	S	Bend	trans	-141.7	143.7	171.7	60.9	0	0	0	0	109.2	M156 T183	M156-S185 PolarHBondContact O-N 2.94Å; M156-S185 VanDerWaalsContact O-N 3.12Å; T183-S185 WeakPolarHBondContact CG2-OG 3.45Å; T183-S185 PolarHBondContact O-N 2.94Å
186	E	94.8	Very high	92.5	Very high	29 Å²	29	80.9 Å²	80.9	14%	0.136	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-99.7	152.7	177.3	-73.6	-177.1	173.9	0	0	111.8	K75 F88 Y89 H90 V157	K75-E186 WeakPolarHBondContact CE-OE2 3.41Å; K75-E186 IonicContact NZ-OE2 2.71Å; K75-E186 PolarHBondContact NZ-OE2 2.87Å; F88-E186 VanDerWaalsContact CA-OE2 3.29Å; F88-E186 WeakPolarHBondContact CA-OE2 3.3Å; Y89-E186 WeakPolarHBondContact CA-OE1 3.38Å; Y89-E186 VanDerWaalsContact N-CD 3.3Å; Y89-E186 PolarHBondContact N-OE1 3.17Å; Y89-E186 PolarHBondContact N-OE2 2.89Å; H90-E186 PolarHBondContact N-OE1 2.91Å; H90-E186 VanDerWaalsContact O-OE1 3.08Å; V157-E186 HydrophobicContact CG2-CB 4.13Å; V157-E186 HydrophobicContact CG2-CG 3.77Å
187	P	94.5	Very high	92.2	Very high	39 Å²	39	85.3 Å²	85.3	25%	0.253	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-63	153	171.7	28.6	-33.8	0	0	0	110.8	A71 K75	A71-P187 HydrophobicContact CB-CB 4.26Å; A71-P187 HydrophobicContact CB-CG 3.98Å; K75-P187 PolarHBondContact NZ-O 3.39Å
188	R	93.7	Very high	91.9	Very high	225 Å²	225	90.3 Å²	90.3	85%	0.849	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-65.6	141.4	168.2	-66.8	-178.9	67.5	173	0.4	108.7	K190	R188-K190 PolarHBondContact O-N 3.24Å
189	Q	94.2	Very high	91.5	Very high	27 Å²	27	89.6 Å²	89.6	13%	0.126	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-61.7	127.8	173.1	-174.4	-177.8	-5.3	0	0	109.1	A71 L72 A73 R77	A71-Q189 CarbonylContact O-C 3.56Å; A71-Q189 VanDerWaalsContact O-CA 3.3Å; A71-Q189 WeakPolarHBondContact O-CA 3.48Å; L72-Q189 PolarHBondContact O-NE2 2.65Å; L72-Q189 VanDerWaalsContact O-NE2 3.1Å; A73-Q189 WeakPolarHBondContact O-CG 3.42Å; A73-Q189 PolarHBondContact O-NE2 3.23Å; R77-Q189 VanDerWaalsContact NH2-CD 3.29Å
190	K	94.5	Very high	91	Very high	137 Å²	137	86 Å²	86	60%	0.596	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-80.2	142.4	172.6	-66.5	179.3	-179.7	178.6	0	108.9	A71 L72 R188	A71-K190 HydrophobicContact CB-CG 4.47Å; A71-K190 PolarHBondContact O-N 2.91Å; L72-K190 HydrophobicContact CD2-CB 3.91Å; R188-K190 PolarHBondContact O-N 3.24Å
191	F	91.6	Very high	90.6	Very high	141 Å²	141	89.6 Å²	89.6	62%	0.618	49%	0.486	S	S	*	.			trans	-114.2	130.5	171.7	-55.3	-95.5	0	0	0	107.3	R77	R77-F191 VanDerWaalsContact NH1-CE1 3.28Å
192	I	88.1	Confident	90.1	Very high	136 Å²	136	92.8 Å²	92.8	70%	0.697	48%	0.484	S	S	*	.			trans	-90.1	111.6	167.9	-59.3	167.8	0	0	0	103.9	L72	L72-I192 HydrophobicContact CD1-CD1 3.95Å; L72-I192 HydrophobicContact CD2-CD1 3.79Å; L72-I192 HydrophobicContact CD2-CG1 3.91Å
193	G	81.3	Confident	89.5	Confident	65 Å²	65	100.3 Å²	100.3	67%	0.67	52%	0.523	S	S	*	.			trans	-71.3	152.8	169.8	0	0	0	0	0	109.6
194	N	53.1	Low	88.8	Confident	241 Å²	241	103.4 Å²	103.4	100%	1.289	53%	0.534	S	S	*	.			trans	-80	0	165	-69.2	-14.7	0	0	0	110.2

Retrieved 194 of 194 residues in 841.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).