A0A3Q0KHA9_SCHMA Loading...

28S ribosomal protein S24

AlphaFold DB , UniProt , Accession A0A3Q0KHA9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 166 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	41	Very low	37.7	Very low	230 Å²	230	184 Å²	184	100%	1.133	86%	0.856	S	S	*	*				0	118.2	0	-156.1	170.9	-173.3	0	0	106.6
2	F	37.3	Very low	37.9	Very low	209 Å²	209	183.7 Å²	183.7	92%	0.917	86%	0.861	S	S	*	*			trans	64.8	121.4	-165.4	-61.7	-74.1	0	0	0	117.9
3	A	38.2	Very low	37.8	Very low	96 Å²	96	176.4 Å²	176.4	79%	0.793	84%	0.843	S	S	*	*			trans	-108.5	156	-164.3	0	0	0	0	0	111.4
4	R	35.3	Very low	37.4	Very low	216 Å²	216	175 Å²	175	82%	0.815	84%	0.843	S	S	*	*			trans	-46.8	129	166.1	-85.9	169.4	157.5	168.7	-5.9	113
5	L	42.3	Very low	37.3	Very low	168 Å²	168	169 Å²	169	88%	0.88	83%	0.833	S	S	*	*			trans	-134.5	96	150.4	-68.2	169.8	0	0	0	104.2
6	R	37.4	Very low	37.4	Very low	200 Å²	200	171.4 Å²	171.4	76%	0.755	83%	0.832	S	S	*	*				31.7	121	77.7	-95.8	-168.4	-106.9	-154.7	-0.7	113.7
7	N	37.5	Very low	37.7	Very low	139 Å²	139	169.2 Å²	169.2	74%	0.743	83%	0.831	S	S	*	*			trans	97.7	77.4	170.1	-51.8	-15.7	0	0	0	116.1
8	Y	38.2	Very low	38.3	Very low	245 Å²	245	167.2 Å²	167.2	96%	0.961	82%	0.822	S	S	*	*			trans	-130.9	53.7	141.9	-112	-88.4	0	0	0	107.5
9	E	35.5	Very low	38.9	Very low	162 Å²	162	164.9 Å²	164.9	76%	0.757	81%	0.814	S	S	*	*			trans	-90.7	143.1	159.2	-77.1	-173.7	165.9	0	0	107.5
10	R	32.9	Very low	39.7	Very low	226 Å²	226	165.5 Å²	165.5	85%	0.853	82%	0.815	S	S	*	*			trans	87.4	115.9	175.3	-52.3	172	-179.2	179	-1.6	113.5
11	V	39.4	Very low	40.8	Very low	133 Å²	133	165.1 Å²	165.1	81%	0.806	81%	0.808	S	S	*	*	S	Bend	trans	157.3	-0.5	145.3	166.8	0	0	0	0	112
12	I	40.1	Very low	41.9	Very low	180 Å²	180	159.9 Å²	159.9	92%	0.923	79%	0.789	S	S	*	*			trans	-115.6	59.1	164.8	-45.3	177.8	0	0	0	109.5
13	S	36.6	Very low	43	Very low	89 Å²	89	157.8 Å²	157.8	62%	0.622	78%	0.782	S	S	*	*			trans	-98.5	137.5	155.7	48.8	0	0	0	0	106.9
14	D	31.5	Very low	44.3	Very low	157 Å²	157	159.6 Å²	159.6	84%	0.84	78%	0.783	S	S	*	*	S	Bend	trans	81.1	73.3	170	-48.2	-26.7	0	0	0	117.1
15	A	36.1	Very low	45.5	Very low	85 Å²	85	152 Å²	152	70%	0.702	77%	0.772	S	S	*	*	S	Bend	trans	176.4	128.9	132.1	0	0	0	0	0	110.1
16	Y	39.7	Very low	46.4	Very low	208 Å²	208	151.4 Å²	151.4	82%	0.816	77%	0.77	S	S	*	*			trans	71.1	79.2	176	-69	-85.8	0	0	0	116.7	I18	Y16-I18 PolarHBondContact O-N 3.16Å
17	V	42.3	Very low	47.5	Very low	133 Å²	133	146.6 Å²	146.6	81%	0.806	76%	0.763	S	S	*	*			trans	-63.8	83.9	146.5	-179.9	0	0	0	0	107.4	N19	V17-N19 VanDerWaalsContact C-N 3.31Å; V17-N19 PolarHBondContact O-N 3.26Å; V17-N19 VanDerWaalsContact O-N 3.07Å
18	I	49.2	Very low	48.5	Very low	133 Å²	133	145.8 Å²	145.8	68%	0.682	76%	0.757	S	S	*	*			trans	-68.8	100.5	158.2	-64.7	170.4	0	0	0	104.3	Y16 Q20	Y16-I18 PolarHBondContact O-N 3.16Å; I18-Q20 VanDerWaalsContact C-N 3.32Å; I18-Q20 PolarHBondContact O-N 3.07Å
19	N	49.8	Very low	49.6	Very low	124 Å²	124	143.1 Å²	143.1	66%	0.663	75%	0.751	S	S	*	*			trans	-54	98.5	168.5	-100.7	-32.1	0	0	0	108.4	V17 K21	V17-N19 VanDerWaalsContact C-N 3.31Å; V17-N19 PolarHBondContact O-N 3.26Å; V17-N19 VanDerWaalsContact O-N 3.07Å; N19-K21 HydrophobicContact CB-CG 4.49Å; N19-K21 PolarHBondContact O-N 2.79Å
20	Q	54.8	Low	51.2	Low	177 Å²	177	142.6 Å²	142.6	83%	0.827	75%	0.746	S	S	*	*			trans	-67	87	164	-81.1	-174.7	-21.6	0	0	107.4	I18 V22	I18-Q20 VanDerWaalsContact C-N 3.32Å; I18-Q20 PolarHBondContact O-N 3.07Å; Q20-V22 PolarHBondContact O-N 2.87Å; Q20-V22 VanDerWaalsContact O-N 3.11Å
21	K	61.1	Low	53	Low	157 Å²	157	136.8 Å²	136.8	68%	0.683	73%	0.732	S	S	*	*			trans	-73.4	97.4	166.9	-67.9	-176.1	179.5	-179.6	0	107.6	N19 H23	N19-K21 HydrophobicContact CB-CG 4.49Å; N19-K21 PolarHBondContact O-N 2.79Å; K21-H23 PolarHBondContact O-N 2.81Å; K21-H23 VanDerWaalsContact O-N 3.15Å
22	V	64.1	Low	54.7	Low	120 Å²	120	134.1 Å²	134.1	73%	0.727	72%	0.716	S	S	*	*			trans	-70.6	104.4	164.5	-178.9	0	0	0	0	106.9	Q20 T24	Q20-V22 PolarHBondContact O-N 2.87Å; Q20-V22 VanDerWaalsContact O-N 3.11Å; V22-T24 HydrophobicContact CG1-CG2 4.2Å; V22-T24 PolarHBondContact O-N 3.11Å
23	H	60.6	Low	56.8	Low	165 Å²	165	135.3 Å²	135.3	76%	0.764	71%	0.709	S	S	*	*			trans	-71.6	111.6	171.2	-73.1	-83.4	0	0	0	108.7	K21	K21-H23 PolarHBondContact O-N 2.81Å; K21-H23 VanDerWaalsContact O-N 3.15Å
24	T	65.8	Low	59.3	Low	134 Å²	134	133.8 Å²	133.8	82%	0.822	70%	0.702	S	S	*	*			trans	-94.4	8.6	178.2	51.2	0	0	0	0	113.6	V22	V22-T24 HydrophobicContact CG1-CG2 4.2Å; V22-T24 PolarHBondContact O-N 3.11Å
25	G	61.9	Low	61.9	Low	56 Å²	56	128.9 Å²	128.9	58%	0.577	69%	0.688	S	S	*	*	S	Bend	trans	-78.4	147.3	173.4	0	0	0	0	0	111.5	T27	G25-T27 PolarHBondContact O-N 3.15Å; G25-T27 VanDerWaalsContact O-N 3.16Å
26	N	60.3	Low	64.6	Low	156 Å²	156	126.9 Å²	126.9	83%	0.834	67%	0.667	S	S	*	*			trans	-47.6	126	170.9	-71.3	1.6	0	0	0	109.3	I28	N26-I28 VanDerWaalsContact C-N 3.29Å; N26-I28 PolarHBondContact O-N 2.89Å
27	T	59.8	Low	67	Low	99 Å²	99	119.6 Å²	119.6	61%	0.607	64%	0.644	S	S	*	*			trans	-62.1	97.1	170.7	46.6	0	0	0	0	107.5	G25 F29	G25-T27 PolarHBondContact O-N 3.15Å; G25-T27 VanDerWaalsContact O-N 3.16Å; T27-F29 VanDerWaalsContact C-N 3.31Å; T27-F29 WeakPolarHBondContact O-CD2 3.13Å; T27-F29 PolarHBondContact O-N 2.76Å; T27-F29 WeakPolarHBondContact OG1-CE2 3.15Å; T27-F29 WeakPolarHBondContact OG1-CZ 3.19Å
28	I	59.2	Low	69.3	Low	123 Å²	123	122.1 Å²	122.1	63%	0.631	64%	0.639	S	S	*	*			trans	-69.2	98.3	172.3	-61	175.9	0	0	0	105.4	N26 K30	N26-I28 VanDerWaalsContact C-N 3.29Å; N26-I28 PolarHBondContact O-N 2.89Å; I28-K30 HydrophobicContact CG2-CB 3.88Å; I28-K30 HydrophobicContact CG2-CD 3.45Å; I28-K30 VanDerWaalsContact CG2-CD 3.45Å; I28-K30 HydrophobicContact CG2-CG 3.45Å; I28-K30 VanDerWaalsContact CG2-CG 3.45Å; I28-K30 PolarHBondContact O-N 3.43Å
29	F	61.9	Low	71.2	Confident	189 Å²	189	125.5 Å²	125.5	83%	0.829	64%	0.643	S	S	*	*			trans	-70	44.9	176	-63.3	-75.2	0	0	0	112	T27	T27-F29 VanDerWaalsContact C-N 3.31Å; T27-F29 WeakPolarHBondContact O-CD2 3.13Å; T27-F29 PolarHBondContact O-N 2.76Å; T27-F29 WeakPolarHBondContact OG1-CE2 3.15Å; T27-F29 WeakPolarHBondContact OG1-CZ 3.19Å
30	K	67.4	Low	73.2	Confident	151 Å²	151	122 Å²	122	66%	0.657	63%	0.627	S	S	*	*			trans	-90.2	109.4	170.7	-70.1	176.3	-170.3	177.6	0	107.4	I28 T32	I28-K30 HydrophobicContact CG2-CB 3.88Å; I28-K30 HydrophobicContact CG2-CD 3.45Å; I28-K30 VanDerWaalsContact CG2-CD 3.45Å; I28-K30 HydrophobicContact CG2-CG 3.45Å; I28-K30 VanDerWaalsContact CG2-CG 3.45Å; I28-K30 PolarHBondContact O-N 3.43Å; K30-T32 VanDerWaalsContact C-N 3.26Å; K30-T32 HydrophobicContact CB-CG2 3.84Å; K30-T32 PolarHBondContact O-N 2.83Å
31	N	72	Confident	75	Confident	103 Å²	103	125.2 Å²	125.2	55%	0.551	63%	0.631	S	S	*	*			trans	-67.9	89.1	167.3	-175.5	5.7	0	0	0	109.3	A34	N31-A34 PolarHBondContact OD1-N 2.85Å
32	T	74.4	Confident	76.5	Confident	78 Å²	78	124.2 Å²	124.2	48%	0.479	63%	0.633	S	S	.	*			trans	-100.4	-0.1	179.5	54	0	0	0	0	113	K30	K30-T32 VanDerWaalsContact C-N 3.26Å; K30-T32 HydrophobicContact CB-CG2 3.84Å; K30-T32 PolarHBondContact O-N 2.83Å
33	R	84.8	Confident	77.7	Confident	205 Å²	205	124.5 Å²	124.5	77%	0.774	63%	0.627	S	S	*	*	S	Bend	trans	-116.9	-48.2	-169.8	-68.2	-169.6	-80.8	-172.4	-3.7	113.2	G35	R33-G35 PolarHBondContact O-N 2.86Å
34	A	88.5	Confident	79.3	Confident	56 Å²	56	120.3 Å²	120.3	46%	0.463	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.9	116.7	-175.3	0	0	0	0	0	110	N31 V36 P55	N31-A34 PolarHBondContact OD1-N 2.85Å; A34-V36 PolarHBondContact O-N 2.78Å; A34-V36 VanDerWaalsContact O-N 3.17Å; A34-P55 VanDerWaalsContact O-CG 3.23Å; A34-P55 WeakPolarHBondContact O-CG 3.25Å
35	G	86.9	Confident	80.5	Confident	54 Å²	54	118 Å²	118	56%	0.557	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	59	25.8	176.5	0	0	0	0	0	115	R33 P55	R33-G35 PolarHBondContact O-N 2.86Å; G35-P55 WeakPolarHBondContact O-CD 3.36Å
36	V	91.3	Very high	82.1	Confident	43 Å²	43	117.1 Å²	117.1	26%	0.261	58%	0.58	S	S	.	*			trans	-123.4	116.2	177.8	178.8	0	0	0	0	109.1	A34 K54	A34-V36 PolarHBondContact O-N 2.78Å; A34-V36 VanDerWaalsContact O-N 3.17Å; V36-K54 HydrophobicContact CG2-CG 4.28Å
37	V	91.5	Very high	83.7	Confident	56 Å²	56	110 Å²	110	34%	0.339	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-74.5	133	173.1	-171.3	0	0	0	0	109.7	L47	V37-L47 HydrophobicContact CB-CD1 4.26Å; V37-L47 HydrophobicContact CB-CD2 3.99Å; V37-L47 HydrophobicContact CG1-CD2 3.85Å; V37-L47 HydrophobicContact CG2-CD2 3.9Å
38	R	89.8	Confident	85.3	Confident	185 Å²	185	106.4 Å²	106.4	70%	0.698	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-72.5	144.9	179.4	-69.4	-175.2	175.6	179.4	-0.8	110.4
39	R	89.2	Confident	87	Confident	204 Å²	204	105.2 Å²	105.2	77%	0.77	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-70.3	138	175.1	-57.9	-162.3	174.9	166.4	-1.8	111.5	V166	R39-V166 WeakPolarHBondContact CA-OXT 3.48Å; R39-V166 HydrophobicContact CB-CG1 4.1Å; R39-V166 HydrophobicContact CG-CG1 3.85Å
40	T	91.9	Very high	88.5	Confident	52 Å²	52	97.6 Å²	97.6	32%	0.319	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-90.1	148.4	170.1	-40.6	0	0	0	0	108.5	D42 Q43 V166	T40-D42 VanDerWaalsContact C-N 3.28Å; T40-D42 PolarHBondContact O-N 3.07Å; T40-Q43 PolarHBondContact O-N 3.5Å; T40-V166 VanDerWaalsContact CB-O 3.25Å; T40-V166 WeakPolarHBondContact CB-O 3.32Å; T40-V166 PolarHBondContact N-OXT 3.23Å; T40-V166 PolarHBondContact OG1-O 3.2Å
41	R	92.1	Very high	89.8	Confident	243 Å²	243	94.2 Å²	94.2	92%	0.917	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-41.2	177.2	-70.3	-178.4	177	171.3	-1.4	111.7
42	D	92.7	Very high	90.8	Very high	136 Å²	136	90.7 Å²	90.7	73%	0.727	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	3.7	-171.9	-49.2	-26.4	0	0	0	112.9	T40 S44	T40-D42 VanDerWaalsContact C-N 3.28Å; T40-D42 PolarHBondContact O-N 3.07Å; D42-S44 PolarHBondContact O-N 3.27Å
43	Q	90.3	Very high	91.8	Very high	126 Å²	126	88.2 Å²	88.2	59%	0.589	43%	0.429	S	S	*	.			trans	50.6	40.3	-174.6	-56.1	179	15.6	0	0	112.5	T40 Y165	T40-Q43 PolarHBondContact O-N 3.5Å; Q43-Y165 WeakPolarHBondContact O-CB 3.41Å
44	S	93	Very high	92.2	Very high	77 Å²	77	83.3 Å²	83.3	54%	0.538	41%	0.414	S	S	.	.			trans	-89.6	-14.2	-175.3	57.1	0	0	0	0	113.2	D42 P46	D42-S44 PolarHBondContact O-N 3.27Å; S44-P46 WeakPolarHBondContact O-CD 3.23Å
45	H	92.5	Very high	92.4	Very high	86 Å²	86	82.5 Å²	82.5	40%	0.398	40%	0.404	S	S	.	.			trans	-88.1	117.3	-173.3	-166.5	59.6	0	0	0	111.4	Y165 V166	H45-Y165 WeakPolarHBondContact O-CA 3.34Å; H45-V166 WeakPolarHBondContact CB-O 3.42Å; H45-V166 PolarHBondContact N-O 3.17Å; H45-V166 PolarHBondContact O-N 2.85Å
46	P	94.3	Very high	92.6	Very high	38 Å²	38	86.2 Å²	86.2	25%	0.247	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	130.4	179	31.7	-33.5	0	0	0	111.1	S44 I162 Y165	S44-P46 WeakPolarHBondContact O-CD 3.23Å; P46-I162 HydrophobicContact CB-CB 4.43Å; P46-I162 HydrophobicContact CB-CD1 3.58Å; P46-I162 HydrophobicContact CB-CG1 3.84Å; P46-I162 HydrophobicContact CB-CG2 3.72Å; P46-I162 HydrophobicContact CG-CD1 4.36Å; P46-Y165 HydrophobicContact CB-CD1 4.1Å; P46-Y165 HydrophobicContact CB-CE1 3.75Å
47	L	93.9	Very high	92.8	Very high	7 Å²	7	86.3 Å²	86.3	4%	0.037	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	137.7	174.4	-59.7	-172.8	0	0	0	111.1	V37 Q51 A52 F163 R164 V166	V37-L47 HydrophobicContact CB-CD1 4.26Å; V37-L47 HydrophobicContact CB-CD2 3.99Å; V37-L47 HydrophobicContact CG1-CD2 3.85Å; V37-L47 HydrophobicContact CG2-CD2 3.9Å; L47-Q51 HydrophobicContact CB-CB 4.3Å; L47-Q51 HydrophobicContact CD2-CB 4.27Å; L47-A52 HydrophobicContact CB-CB 4.21Å; L47-A52 HydrophobicContact CD1-CB 4.32Å; L47-F163 PolarHBondContact O-N 2.68Å; L47-R164 WeakPolarHBondContact CB-O 3.32Å; L47-R164 PolarHBondContact N-O 3.17Å; L47-R164 PolarHBondContact O-N 3.03Å; L47-V166 HydrophobicContact CD1-CB 3.79Å; L47-V166 HydrophobicContact CD1-CG1 4.29Å; L47-V166 HydrophobicContact CD1-CG2 3.41Å; L47-V166 VanDerWaalsContact CD1-CG2 3.41Å; L47-V166 HydrophobicContact CG-CB 4.14Å; L47-V166 HydrophobicContact CG-CG2 4.06Å
48	T	94.6	Very high	93	Very high	22 Å²	22	87.1 Å²	87.1	14%	0.135	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	163.8	164.4	67.3	0	0	0	0	110.3	E50 Q51 A52 V161	T48-E50 PolarHBondContact O-N 2.93Å; T48-Q51 VanDerWaalsContact N-OE1 3.13Å; T48-Q51 PolarHBondContact O-N 3.36Å; T48-Q51 WeakPolarHBondContact OG1-CG 3.49Å; T48-Q51 PolarHBondContact OG1-N 2.83Å; T48-Q51 PolarHBondContact OG1-OE1 2.98Å; T48-A52 WeakPolarHBondContact O-CB 3.47Å; T48-A52 PolarHBondContact O-N 3.29Å; T48-V161 HydrophobicContact CG2-CG1 3.85Å
49	Y	95	Very high	93.2	Very high	99 Å²	99	80.8 Å²	80.8	39%	0.388	40%	0.398	S	S	.	.	H	α-helix	trans	-52.9	-45.3	177.8	-177.8	-93.8	0	0	0	112	Q51 A52 K53 M61 F163	Y49-Q51 PolarHBondContact O-N 3.1Å; Y49-A52 PolarHBondContact O-N 3.16Å; Y49-K53 HydrophobicContact CE1-CG 4.15Å; Y49-K53 VanDerWaalsContact CZ-CE 3.42Å; Y49-K53 PolarHBondContact O-N 3.37Å; Y49-K53 WeakPolarHBondContact OH-CE 3.33Å; Y49-M61 WeakPolarHBondContact CE1-O 3.45Å; Y49-M61 PolarHBondContact OH-O 3.38Å; Y49-F163 HydrophobicContact CD2-CD1 4.35Å; Y49-F163 AromaticContact CD2-CD2 3.8Å; Y49-F163 HydrophobicContact CD2-CD2 3.8Å; Y49-F163 HydrophobicContact CD2-CE1 4.44Å; Y49-F163 AromaticContact CD2-CE2 3.9Å; Y49-F163 HydrophobicContact CD2-CE2 3.9Å; Y49-F163 HydrophobicContact CD2-CG 4.03Å; Y49-F163 HydrophobicContact CD2-CZ 4.23Å; Y49-F163 HydrophobicContact CE2-CE2 4.27Å; Y49-F163 HydrophobicContact CE2-CZ 4.38Å
50	E	93.2	Very high	93.5	Very high	29 Å²	29	78.2 Å²	78.2	14%	0.136	40%	0.398	C	S	.	.	H	α-helix	trans	-64.9	-39	-177.8	-174.3	52.7	-148.9	0	0	112.7	T48 K62 N65 E104	T48-E50 PolarHBondContact O-N 2.93Å; E50-K62 WeakPolarHBondContact OE1-CD 3.45Å; E50-K62 IonicContact OE1-NZ 2.82Å; E50-K62 PolarHBondContact OE1-NZ 3.15Å; E50-N65 PolarHBondContact OE1-ND2 3.22Å; E50-E104 VanDerWaalsContact CG-CD 3.47Å; E50-E104 HydrophobicContact CG-CG 4.06Å; E50-E104 WeakPolarHBondContact CG-OE1 3.4Å
51	Q	93.7	Very high	93.7	Very high	80 Å²	80	79.9 Å²	79.9	37%	0.374	40%	0.403	S	S	.	.	H	α-helix	trans	-72.3	-31.1	176.4	-68.8	171.2	-22.7	0	0	113	L47 T48 Y49 K53	L47-Q51 HydrophobicContact CB-CB 4.3Å; L47-Q51 HydrophobicContact CD2-CB 4.27Å; T48-Q51 VanDerWaalsContact N-OE1 3.13Å; T48-Q51 PolarHBondContact O-N 3.36Å; T48-Q51 WeakPolarHBondContact OG1-CG 3.49Å; T48-Q51 PolarHBondContact OG1-N 2.83Å; T48-Q51 PolarHBondContact OG1-OE1 2.98Å; Y49-Q51 PolarHBondContact O-N 3.1Å; Q51-K53 VanDerWaalsContact C-N 3.34Å
52	A	93.8	Very high	93.8	Very high	29 Å²	29	69.6 Å²	69.6	24%	0.24	37%	0.366	C	S	.	.	H	α-helix	trans	-73.7	-24.9	-178.2	0	0	0	0	0	113	L47 T48 Y49 F163	L47-A52 HydrophobicContact CB-CB 4.21Å; L47-A52 HydrophobicContact CD1-CB 4.32Å; T48-A52 WeakPolarHBondContact O-CB 3.47Å; T48-A52 PolarHBondContact O-N 3.29Å; Y49-A52 PolarHBondContact O-N 3.16Å; A52-F163 HydrophobicContact CB-CD1 3.76Å; A52-F163 HydrophobicContact CB-CE1 4.32Å
53	K	94.3	Very high	93.9	Very high	25 Å²	25	65.8 Å²	65.8	11%	0.109	35%	0.349	C	S	.	.	S	Bend	trans	-87.9	135	179.1	-59.1	-51.2	-178.8	-175.3	0	111.6	Y49 Q51 M61 K62	Y49-K53 HydrophobicContact CE1-CG 4.15Å; Y49-K53 VanDerWaalsContact CZ-CE 3.42Å; Y49-K53 PolarHBondContact O-N 3.37Å; Y49-K53 WeakPolarHBondContact OH-CE 3.33Å; Q51-K53 VanDerWaalsContact C-N 3.34Å; K53-M61 HydrophobicContact CD-CB 3.95Å; K53-M61 HydrophobicContact CD-CE 4.44Å; K53-M61 HydrophobicContact CD-SD 3.93Å; K53-M61 HydrophobicContact CG-CB 4.22Å; K53-K62 HydrophobicContact CB-CB 4.11Å; K53-K62 HydrophobicContact CB-CD 3.97Å; K53-K62 HydrophobicContact CB-CG 3.94Å; K53-K62 HydrophobicContact CG-CB 4.26Å
54	K	92.7	Very high	94.1	Very high	102 Å²	102	66.6 Å²	66.6	44%	0.443	35%	0.347	S	S	.	.			trans	-77	160.2	-178.5	-60.3	-179.8	-177	173.1	0	111.4	V36 H56 Q57	V36-K54 HydrophobicContact CG2-CG 4.28Å; K54-H56 VanDerWaalsContact C-N 3.34Å; K54-H56 VanDerWaalsContact CB-CE1 3.49Å; K54-H56 WeakPolarHBondContact CB-CE1 3.42Å; K54-H56 WeakPolarHBondContact CD-CE1 3.36Å; K54-H56 PolarHBondContact O-N 2.97Å; K54-Q57 HydrophobicContact CB-CG 4.31Å; K54-Q57 WeakPolarHBondContact O-CB 3.45Å; K54-Q57 PolarHBondContact O-N 3.47Å
55	P	93.6	Very high	94.3	Very high	40 Å²	40	64.4 Å²	64.4	26%	0.26	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-61.6	-35	-177.4	-26.7	36.1	0	0	0	114.9	A34 G35 Q57 I58	A34-P55 VanDerWaalsContact O-CG 3.23Å; A34-P55 WeakPolarHBondContact O-CG 3.25Å; G35-P55 WeakPolarHBondContact O-CD 3.36Å; P55-Q57 PolarHBondContact O-N 3.23Å; P55-Q57 VanDerWaalsContact O-N 3.1Å; P55-I58 WeakPolarHBondContact O-CB 3.4Å; P55-I58 WeakPolarHBondContact O-CD1 3.43Å; P55-I58 WeakPolarHBondContact O-CG1 3.19Å; P55-I58 PolarHBondContact O-N 3.27Å; P55-I58 VanDerWaalsContact O-N 3.16Å
56	H	92.2	Very high	94.5	Very high	132 Å²	132	62.1 Å²	62.1	61%	0.611	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-70.2	-3.8	176.6	60.2	-101.3	0	0	0	113.6	K54	K54-H56 VanDerWaalsContact C-N 3.34Å; K54-H56 VanDerWaalsContact CB-CE1 3.49Å; K54-H56 WeakPolarHBondContact CB-CE1 3.42Å; K54-H56 WeakPolarHBondContact CD-CE1 3.36Å; K54-H56 PolarHBondContact O-N 2.97Å
57	Q	94.5	Very high	94.5	Very high	45 Å²	45	66 Å²	66	21%	0.21	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-98.8	4.4	176.3	-53.3	-177.9	-60.4	0	0	112.1	K54 P55 L60 M61 K62	K54-Q57 HydrophobicContact CB-CG 4.31Å; K54-Q57 WeakPolarHBondContact O-CB 3.45Å; K54-Q57 PolarHBondContact O-N 3.47Å; P55-Q57 PolarHBondContact O-N 3.23Å; P55-Q57 VanDerWaalsContact O-N 3.1Å; Q57-L60 PolarHBondContact O-N 3.32Å; Q57-L60 VanDerWaalsContact O-N 3.15Å; Q57-M61 HydrophobicContact CB-CB 4.2Å; Q57-M61 HydrophobicContact CB-CG 4.26Å; Q57-M61 PolarHBondContact NE2-SD 3.28Å; Q57-M61 PolarHBondContact O-N 2.85Å; Q57-K62 PolarHBondContact O-N 3.49Å; Q57-K62 VanDerWaalsContact O-N 3.17Å
58	I	95.5	Very high	94.6	Very high	73 Å²	73	67.5 Å²	67.5	37%	0.374	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-64.4	130.3	169.4	-62.1	168.3	0	0	0	108.8	P55 L60 K62	P55-I58 WeakPolarHBondContact O-CB 3.4Å; P55-I58 WeakPolarHBondContact O-CD1 3.43Å; P55-I58 WeakPolarHBondContact O-CG1 3.19Å; P55-I58 PolarHBondContact O-N 3.27Å; P55-I58 VanDerWaalsContact O-N 3.16Å; I58-L60 VanDerWaalsContact C-N 3.31Å; I58-K62 CarbonylContact C-O 3.57Å; I58-K62 WeakPolarHBondContact CA-O 3.45Å; I58-K62 HydrophobicContact CB-CG 4.43Å; I58-K62 HydrophobicContact CG1-CD 3.82Å; I58-K62 HydrophobicContact CG1-CG 3.83Å
59	G	94.1	Very high	94.5	Very high	51 Å²	51	71 Å²	71	53%	0.526	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	-6.9	-173.2	0	0	0	0	0	114.6	K62	G59-K62 PolarHBondContact N-O 2.93Å
60	L	96.1	Very high	94.4	Very high	151 Å²	151	66.7 Å²	66.7	79%	0.791	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	-63.5	179.1	-68.2	167.2	0	0	0	111.7	Q57 I58	Q57-L60 PolarHBondContact O-N 3.32Å; Q57-L60 VanDerWaalsContact O-N 3.15Å; I58-L60 VanDerWaalsContact C-N 3.31Å
61	M	95.4	Very high	94.4	Very high	86 Å²	86	70.7 Å²	70.7	42%	0.424	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-29.9	-179.7	-56.2	-168.4	91.1	0	0	112	Y49 K53 Q57	Y49-M61 WeakPolarHBondContact CE1-O 3.45Å; Y49-M61 PolarHBondContact OH-O 3.38Å; K53-M61 HydrophobicContact CD-CB 3.95Å; K53-M61 HydrophobicContact CD-CE 4.44Å; K53-M61 HydrophobicContact CD-SD 3.93Å; K53-M61 HydrophobicContact CG-CB 4.22Å; Q57-M61 HydrophobicContact CB-CB 4.2Å; Q57-M61 HydrophobicContact CB-CG 4.26Å; Q57-M61 PolarHBondContact NE2-SD 3.28Å; Q57-M61 PolarHBondContact O-N 2.85Å
62	K	94.3	Very high	94.4	Very high	28 Å²	28	72 Å²	72	12%	0.122	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-125	157	177	65	157.4	171.3	-179.6	0	111.6	E50 K53 Q57 I58 G59	E50-K62 WeakPolarHBondContact OE1-CD 3.45Å; E50-K62 IonicContact OE1-NZ 2.82Å; E50-K62 PolarHBondContact OE1-NZ 3.15Å; K53-K62 HydrophobicContact CB-CB 4.11Å; K53-K62 HydrophobicContact CB-CD 3.97Å; K53-K62 HydrophobicContact CB-CG 3.94Å; K53-K62 HydrophobicContact CG-CB 4.26Å; Q57-K62 PolarHBondContact O-N 3.49Å; Q57-K62 VanDerWaalsContact O-N 3.17Å; I58-K62 CarbonylContact C-O 3.57Å; I58-K62 WeakPolarHBondContact CA-O 3.45Å; I58-K62 HydrophobicContact CB-CG 4.43Å; I58-K62 HydrophobicContact CG1-CD 3.82Å; I58-K62 HydrophobicContact CG1-CG 3.83Å; G59-K62 PolarHBondContact N-O 2.93Å
63	S	95.1	Very high	94.4	Very high	55 Å²	55	80.3 Å²	80.3	39%	0.385	41%	0.412	S	S	.	.			trans	-107.3	-167.9	-176.4	-159.6	0	0	0	0	111.3	W67	S63-W67 WeakPolarHBondContact OG-CZ2 3.43Å
64	W	95.5	Very high	94.3	Very high	143 Å²	143	82.3 Å²	82.3	54%	0.542	44%	0.44	S	S	.	.			trans	-91.1	141.9	176.4	-59.7	-87.5	0	0	0	111.7	S66 W67	W64-S66 VanDerWaalsContact C-N 3.34Å; W64-W67 AromaticContact CE3-CH2 3.56Å; W64-W67 HydrophobicContact CE3-CH2 3.56Å; W64-W67 AromaticContact CE3-CZ2 3.87Å; W64-W67 HydrophobicContact CE3-CZ2 3.87Å; W64-W67 AromaticContact CE3-CZ3 3.94Å; W64-W67 HydrophobicContact CE3-CZ3 3.94Å; W64-W67 AromaticContact CZ3-CH2 3.8Å; W64-W67 HydrophobicContact CZ3-CH2 3.8Å; W64-W67 HydrophobicContact CZ3-CZ2 4.49Å; W64-W67 HydrophobicContact CZ3-CZ3 4.16Å; W64-W67 PolarHBondContact O-NE1 3.17Å
65	N	95.8	Very high	94.2	Very high	31 Å²	31	81.9 Å²	81.9	17%	0.166	44%	0.44	C	S	.	.	S	Bend	trans	-86	-8.9	177.8	-58.2	-31	0	0	0	112.7	E50 R90 E104 I106 I107	E50-N65 PolarHBondContact OE1-ND2 3.22Å; N65-R90 PolarHBondContact O-NH2 3.01Å; N65-E104 PolarHBondContact ND2-OE2 2.88Å; N65-I106 HydrophobicContact CB-CD1 4.05Å; N65-I106 WeakPolarHBondContact O-CA 3.5Å; N65-I106 VanDerWaalsContact OD1-CD1 3.32Å; N65-I106 WeakPolarHBondContact OD1-CD1 3.48Å; N65-I107 PolarHBondContact O-N 3.45Å
66	S	96.3	Very high	93.7	Very high	39 Å²	39	86.9 Å²	86.9	27%	0.273	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	123.1	172.1	45.5	0	0	0	0	109.6	W64 D86 I107	W64-S66 VanDerWaalsContact C-N 3.34Å; S66-D86 WeakPolarHBondContact CB-OD2 3.47Å; S66-I107 CarbonylContact C-O 3.58Å; S66-I107 WeakPolarHBondContact CA-O 3.23Å
67	W	96	Very high	93.2	Very high	120 Å²	120	90.2 Å²	90.2	46%	0.455	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	117.8	174.5	-66.6	84.2	0	0	0	109.3	S63 W64 I107 R109	S63-W67 WeakPolarHBondContact OG-CZ2 3.43Å; W64-W67 AromaticContact CE3-CH2 3.56Å; W64-W67 HydrophobicContact CE3-CH2 3.56Å; W64-W67 AromaticContact CE3-CZ2 3.87Å; W64-W67 HydrophobicContact CE3-CZ2 3.87Å; W64-W67 AromaticContact CE3-CZ3 3.94Å; W64-W67 HydrophobicContact CE3-CZ3 3.94Å; W64-W67 AromaticContact CZ3-CH2 3.8Å; W64-W67 HydrophobicContact CZ3-CH2 3.8Å; W64-W67 HydrophobicContact CZ3-CZ2 4.49Å; W64-W67 HydrophobicContact CZ3-CZ3 4.16Å; W64-W67 PolarHBondContact O-NE1 3.17Å; W67-I107 PolarHBondContact N-O 3.14Å; W67-R109 PolarHBondContact O-N 3.01Å
68	N	94.2	Very high	92.9	Very high	37 Å²	37	94.2 Å²	94.2	20%	0.198	49%	0.485	C	S	.	.			trans	-150.3	172.8	178.9	63.2	39.9	0	0	0	109.5	S70 V82	N68-S70 PolarHBondContact OD1-N 2.61Å; N68-S70 PolarHBondContact OD1-OG 2.66Å; N68-S70 VanDerWaalsContact OD1-OG 3.13Å; N68-V82 HydrophobicContact CB-CG1 4.02Å; N68-V82 VanDerWaalsContact ND2-CG1 3.26Å; N68-V82 WeakPolarHBondContact ND2-CG1 3.44Å
69	T	94.3	Very high	92.7	Very high	96 Å²	96	92.8 Å²	92.8	59%	0.589	48%	0.48	S	S	*	.	S	Bend	trans	-98.4	-8.6	177.1	53.8	0	0	0	0	113.1	N71 L72	T69-N71 PolarHBondContact O-N 2.82Å; T69-N71 VanDerWaalsContact O-N 3.12Å; T69-L72 HydrophobicContact CG2-CD1 4.25Å; T69-L72 WeakPolarHBondContact O-CB 3.39Å; T69-L72 WeakPolarHBondContact O-CG 3.49Å; T69-L72 PolarHBondContact O-N 3.48Å; T69-L72 VanDerWaalsContact O-N 3.15Å
70	S	92.7	Very high	92.7	Very high	8 Å²	8	94.1 Å²	94.1	6%	0.056	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-6.4	-170.5	63.4	0	0	0	0	115	N68 T79	N68-S70 PolarHBondContact OD1-N 2.61Å; N68-S70 PolarHBondContact OD1-OG 2.66Å; N68-S70 VanDerWaalsContact OD1-OG 3.13Å; S70-T79 PolarHBondContact O-OG1 3.19Å
71	N	92.9	Very high	92.6	Very high	114 Å²	114	91.4 Å²	91.4	61%	0.61	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	8.1	177.6	-65.9	-15.6	0	0	0	112	T69 T79	T69-N71 PolarHBondContact O-N 2.82Å; T69-N71 VanDerWaalsContact O-N 3.12Å; N71-T79 WeakPolarHBondContact OD1-CG2 3.22Å
72	L	94.2	Very high	92.6	Very high	107 Å²	107	88.3 Å²	88.3	56%	0.56	45%	0.451	S	S	*	.	S	Bend	trans	-75.3	153.3	174.6	-64.3	175.6	0	0	0	110.1	T69 G74 E75	T69-L72 HydrophobicContact CG2-CD1 4.25Å; T69-L72 WeakPolarHBondContact O-CB 3.39Å; T69-L72 WeakPolarHBondContact O-CG 3.49Å; T69-L72 PolarHBondContact O-N 3.48Å; T69-L72 VanDerWaalsContact O-N 3.15Å; L72-G74 PolarHBondContact O-N 3.18Å; L72-E75 HydrophobicContact CB-CG 4.23Å; L72-E75 PolarHBondContact O-N 3.22Å; L72-E75 VanDerWaalsContact O-N 3.17Å
73	E	93.7	Very high	92.6	Very high	203 Å²	203	90.7 Å²	90.7	95%	0.949	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	124.3	175.5	-174.3	174.6	-168.8	0	0	110.3
74	G	92.1	Very high	92.6	Very high	68 Å²	68	93.9 Å²	93.9	70%	0.701	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.2	-5	-178.4	0	0	0	0	0	115.7	L72	L72-G74 PolarHBondContact O-N 3.18Å
75	E	90.2	Very high	92.7	Very high	93 Å²	93	90.5 Å²	90.5	44%	0.435	47%	0.47	S	S	.	.			trans	-102.8	89.8	-179.8	-67.7	-66.9	158.5	0	0	111.9	L72	L72-E75 HydrophobicContact CB-CG 4.23Å; L72-E75 PolarHBondContact O-N 3.22Å; L72-E75 VanDerWaalsContact O-N 3.17Å
76	D	83.7	Confident	92.7	Very high	144 Å²	144	89.4 Å²	89.4	77%	0.77	46%	0.464	S	S	*	.			trans	-102.2	-11.5	-176.1	-65.7	-28.8	0	0	0	114.6	Y78	D76-Y78 PolarHBondContact O-N 3.31Å
77	R	80.4	Confident	92.7	Very high	203 Å²	203	93 Å²	93	77%	0.766	48%	0.476	S	S	*	.	S	Bend	trans	-78.8	-22	-161.1	-66.8	-175.4	-171.7	-170.5	3.1	115.3
78	Y	88.4	Confident	92.8	Very high	129 Å²	129	90.7 Å²	90.7	51%	0.506	47%	0.47	S	S	.	.	S	Bend	trans	-136.8	5.5	-166	-58.2	-67.7	0	0	0	114.8	D76 S80 E81 V82	D76-Y78 PolarHBondContact O-N 3.31Å; Y78-S80 PolarHBondContact O-N 3.2Å; Y78-E81 VanDerWaalsContact CD1-OE2 3.31Å; Y78-E81 WeakPolarHBondContact CD1-OE2 3.32Å; Y78-E81 PolarHBondContact O-N 2.7Å; Y78-V82 WeakPolarHBondContact O-CB 3.09Å; Y78-V82 WeakPolarHBondContact O-CG2 3.12Å; Y78-V82 PolarHBondContact O-N 3.35Å
79	T	92.4	Very high	92.9	Very high	43 Å²	43	89 Å²	89	26%	0.264	46%	0.46	S	S	.	.	H	α-helix	trans	-60.4	-43.7	-172.5	-46.2	0	0	0	0	112.9	S70 N71 T83	S70-T79 PolarHBondContact O-OG1 3.19Å; N71-T79 WeakPolarHBondContact OD1-CG2 3.22Å; T79-T83 WeakPolarHBondContact O-CB 3.11Å; T79-T83 PolarHBondContact O-N 3.21Å; T79-T83 VanDerWaalsContact O-N 3.08Å; T79-T83 PolarHBondContact O-OG1 3.28Å
80	S	93.6	Very high	93.1	Very high	79 Å²	79	86.7 Å²	86.7	55%	0.552	44%	0.441	S	S	*	.	H	α-helix	trans	-65	-48	178.8	52.4	0	0	0	0	111.6	Y78 T83 L84	Y78-S80 PolarHBondContact O-N 3.2Å; S80-T83 PolarHBondContact O-N 3.35Å; S80-L84 WeakPolarHBondContact O-CG 3.46Å; S80-L84 PolarHBondContact O-N 3.22Å
81	E	93.7	Very high	93.3	Very high	94 Å²	94	89.8 Å²	89.8	44%	0.439	46%	0.46	S	S	.	.	H	α-helix	trans	-63.1	-46.5	-179.3	-62	173.4	-179.2	0	0	111.5	Y78 T83 L84 H85	Y78-E81 VanDerWaalsContact CD1-OE2 3.31Å; Y78-E81 WeakPolarHBondContact CD1-OE2 3.32Å; Y78-E81 PolarHBondContact O-N 2.7Å; E81-T83 VanDerWaalsContact C-N 3.28Å; E81-T83 PolarHBondContact O-N 2.79Å; E81-L84 PolarHBondContact O-N 2.92Å; E81-H85 WeakPolarHBondContact O-CB 3.32Å; E81-H85 PolarHBondContact O-CD2 3.16Å; E81-H85 VanDerWaalsContact O-CD2 3.29Å; E81-H85 VanDerWaalsContact O-CG 3.25Å; E81-H85 PolarHBondContact O-N 3.21Å
82	V	94.6	Very high	93.5	Very high	21 Å²	21	86 Å²	86	13%	0.127	44%	0.438	C	S	.	.	H	α-helix	trans	-60.5	-41.3	177	172	0	0	0	0	110.8	N68 Y78 H85 D86	N68-V82 HydrophobicContact CB-CG1 4.02Å; N68-V82 VanDerWaalsContact ND2-CG1 3.26Å; N68-V82 WeakPolarHBondContact ND2-CG1 3.44Å; Y78-V82 WeakPolarHBondContact O-CB 3.09Å; Y78-V82 WeakPolarHBondContact O-CG2 3.12Å; Y78-V82 PolarHBondContact O-N 3.35Å; V82-H85 PolarHBondContact O-N 2.98Å; V82-D86 VanDerWaalsContact O-CB 3.24Å; V82-D86 WeakPolarHBondContact O-CB 3.39Å; V82-D86 PolarHBondContact O-N 3.04Å
83	T	94.8	Very high	93.6	Very high	77 Å²	77	80.9 Å²	80.9	47%	0.472	41%	0.411	S	S	.	.	H	α-helix	trans	-65	-41.3	177.3	-56.7	0	0	0	0	111.7	T79 S80 E81 D86 Q87	T79-T83 WeakPolarHBondContact O-CB 3.11Å; T79-T83 PolarHBondContact O-N 3.21Å; T79-T83 VanDerWaalsContact O-N 3.08Å; T79-T83 PolarHBondContact O-OG1 3.28Å; S80-T83 PolarHBondContact O-N 3.35Å; E81-T83 VanDerWaalsContact C-N 3.28Å; E81-T83 PolarHBondContact O-N 2.79Å; T83-D86 WeakPolarHBondContact O-CB 3.45Å; T83-D86 PolarHBondContact O-N 2.98Å; T83-Q87 PolarHBondContact O-N 3.3Å
84	L	95.9	Very high	93.7	Very high	122 Å²	122	75.6 Å²	75.6	64%	0.639	39%	0.389	S	S	*	.	H	α-helix	trans	-65.4	-44.2	175.8	-72.8	174.3	0	0	0	111.8	S80 E81 D86 Q87 F88	S80-L84 WeakPolarHBondContact O-CG 3.46Å; S80-L84 PolarHBondContact O-N 3.22Å; E81-L84 PolarHBondContact O-N 2.92Å; L84-D86 VanDerWaalsContact C-N 3.28Å; L84-D86 PolarHBondContact O-N 2.74Å; L84-Q87 PolarHBondContact O-N 2.94Å; L84-F88 WeakPolarHBondContact O-CB 3.19Å; L84-F88 PolarHBondContact O-N 3.38Å
85	H	95.9	Very high	93.8	Very high	73 Å²	73	75.1 Å²	75.1	34%	0.338	39%	0.385	S	S	.	.	H	α-helix	trans	-61.2	-41	175.5	-68.8	-174.6	0	0	0	111.1	E81 V82 F88 I89 L144	E81-H85 WeakPolarHBondContact O-CB 3.32Å; E81-H85 PolarHBondContact O-CD2 3.16Å; E81-H85 VanDerWaalsContact O-CD2 3.29Å; E81-H85 VanDerWaalsContact O-CG 3.25Å; E81-H85 PolarHBondContact O-N 3.21Å; V82-H85 PolarHBondContact O-N 2.98Å; H85-F88 PolarHBondContact O-N 2.99Å; H85-I89 WeakPolarHBondContact O-CB 3.13Å; H85-I89 WeakPolarHBondContact O-CD1 3.36Å; H85-I89 VanDerWaalsContact O-CG1 3.23Å; H85-I89 WeakPolarHBondContact O-CG1 3.39Å; H85-I89 PolarHBondContact O-N 2.97Å; H85-L144 HydrophobicContact CB-CD2 4.24Å
86	D	96.7	Very high	94.1	Very high	7 Å²	7	71.8 Å²	71.8	4%	0.037	37%	0.371	C	S	.	.	H	α-helix	trans	-59.7	-46.5	175.4	-95.7	-10.4	0	0	0	112.7	S66 V82 T83 L84 F88 R90 I107 R109	S66-D86 WeakPolarHBondContact CB-OD2 3.47Å; V82-D86 VanDerWaalsContact O-CB 3.24Å; V82-D86 WeakPolarHBondContact O-CB 3.39Å; V82-D86 PolarHBondContact O-N 3.04Å; T83-D86 WeakPolarHBondContact O-CB 3.45Å; T83-D86 PolarHBondContact O-N 2.98Å; L84-D86 VanDerWaalsContact C-N 3.28Å; L84-D86 PolarHBondContact O-N 2.74Å; D86-F88 VanDerWaalsContact C-N 3.35Å; D86-R90 WeakPolarHBondContact O-CG 3.42Å; D86-R90 PolarHBondContact O-N 3.22Å; D86-R90 PolarHBondContact O-NH1 2.95Å; D86-R90 IonicContact OD1-NH1 4Å; D86-I107 HydrophobicContact CB-CD1 4.39Å; D86-I107 WeakPolarHBondContact OD1-CD1 3.15Å; D86-I107 WeakPolarHBondContact OD1-CG2 3.15Å; D86-R109 IonicContact OD1-CZ 2.69Å; D86-R109 IonicContact OD1-NH1 3.01Å; D86-R109 PolarHBondContact OD1-NH1 3.26Å; D86-R109 IonicContact OD1-NH2 2.65Å; D86-R109 PolarHBondContact OD1-NH2 3.37Å; D86-R109 IonicContact OD2-CZ 3.96Å; D86-R109 IonicContact OD2-NH1 3.09Å; D86-R109 PolarHBondContact OD2-NH1 3.19Å; D86-R109 IonicContact OD2-NH2 3.06Å
87	Q	97	Very high	94.6	Very high	114 Å²	114	65 Å²	65	53%	0.533	33%	0.334	S	S	.	.	H	α-helix	trans	-65.9	-41.7	176.6	-175.2	59.5	17.2	0	0	111.1	T83 L84 R90 T91	T83-Q87 PolarHBondContact O-N 3.3Å; L84-Q87 PolarHBondContact O-N 2.94Å; Q87-R90 PolarHBondContact O-N 2.78Å; Q87-T91 WeakPolarHBondContact O-CG2 3.48Å; Q87-T91 PolarHBondContact O-N 3.14Å; Q87-T91 PolarHBondContact O-OG1 3.3Å
88	F	97.2	Very high	95.1	Very high	73 Å²	73	59.3 Å²	59.3	32%	0.32	32%	0.323	S	S	.	.	H	α-helix	trans	-58.3	-51.3	177.1	176.4	-107.5	0	0	0	111.8	L84 H85 D86 R90 T91 F92 L140 I143 L144	L84-F88 WeakPolarHBondContact O-CB 3.19Å; L84-F88 PolarHBondContact O-N 3.38Å; H85-F88 PolarHBondContact O-N 2.99Å; D86-F88 VanDerWaalsContact C-N 3.35Å; F88-R90 VanDerWaalsContact C-N 3.29Å; F88-R90 PolarHBondContact O-N 3.21Å; F88-T91 WeakPolarHBondContact CA-OG1 3.37Å; F88-T91 PolarHBondContact O-N 3.3Å; F88-T91 VanDerWaalsContact O-N 3.14Å; F88-T91 PolarHBondContact O-OG1 3.15Å; F88-F92 HydrophobicContact CZ-CD2 4.33Å; F88-F92 WeakPolarHBondContact O-CB 3.48Å; F88-F92 PolarHBondContact O-N 3.18Å; F88-L140 HydrophobicContact CD1-CD2 4.36Å; F88-L140 HydrophobicContact CE1-CD2 3.77Å; F88-I143 HydrophobicContact CE1-CD1 4.36Å; F88-I143 HydrophobicContact CE1-CG2 3.92Å; F88-I143 HydrophobicContact CZ-CD1 4.03Å; F88-I143 HydrophobicContact CZ-CG2 4.2Å; F88-L144 HydrophobicContact CD1-CD2 4.4Å
89	I	97.4	Very high	95.1	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-56.2	-44.2	178.3	-69.8	163.4	0	0	0	110.8	H85 F92 I93 I107 I114 V116 L144	H85-I89 WeakPolarHBondContact O-CB 3.13Å; H85-I89 WeakPolarHBondContact O-CD1 3.36Å; H85-I89 VanDerWaalsContact O-CG1 3.23Å; H85-I89 WeakPolarHBondContact O-CG1 3.39Å; H85-I89 PolarHBondContact O-N 2.97Å; I89-F92 PolarHBondContact O-N 3.28Å; I89-I93 HydrophobicContact CG2-CD1 3.68Å; I89-I93 HydrophobicContact CG2-CG1 4.42Å; I89-I93 WeakPolarHBondContact O-CG1 3.24Å; I89-I93 PolarHBondContact O-N 3.27Å; I89-I107 HydrophobicContact CB-CD1 3.97Å; I89-I107 HydrophobicContact CD1-CD1 4.33Å; I89-I107 HydrophobicContact CG2-CD1 3.78Å; I89-I107 HydrophobicContact CG2-CG1 4.3Å; I89-I114 HydrophobicContact CD1-CD1 4.33Å; I89-I114 HydrophobicContact CD1-CG2 4.15Å; I89-V116 HydrophobicContact CG2-CG1 4.08Å; I89-V116 HydrophobicContact CG2-CG2 3.94Å; I89-L144 HydrophobicContact CD1-CD1 3.88Å; I89-L144 HydrophobicContact CG1-CD1 3.99Å
90	R	97.1	Very high	95.2	Very high	48 Å²	48	59 Å²	59	18%	0.181	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-44.9	178.3	-71.8	-177.9	-174.7	79.3	-3.4	112.2	N65 D86 Q87 F88 F92 N94 V105 I107	N65-R90 PolarHBondContact O-NH2 3.01Å; D86-R90 WeakPolarHBondContact O-CG 3.42Å; D86-R90 PolarHBondContact O-N 3.22Å; D86-R90 PolarHBondContact O-NH1 2.95Å; D86-R90 IonicContact OD1-NH1 4Å; Q87-R90 PolarHBondContact O-N 2.78Å; F88-R90 VanDerWaalsContact C-N 3.29Å; F88-R90 PolarHBondContact O-N 3.21Å; R90-F92 VanDerWaalsContact C-N 3.35Å; R90-N94 WeakPolarHBondContact O-CB 3.29Å; R90-N94 VanDerWaalsContact O-CG 3.3Å; R90-N94 PolarHBondContact O-N 3.01Å; R90-N94 VanDerWaalsContact O-N 3.15Å; R90-N94 PolarHBondContact O-ND2 2.75Å; R90-V105 HydrophobicContact CG-CB 4.24Å; R90-I107 HydrophobicContact CG-CD1 4.3Å
91	T	96.6	Very high	95.2	Very high	74 Å²	74	56.4 Å²	56.4	45%	0.454	31%	0.309	S	S	.	.	H	α-helix	trans	-65.8	-39.1	177.3	54	0	0	0	0	112.1	Q87 F88 G95	Q87-T91 WeakPolarHBondContact O-CG2 3.48Å; Q87-T91 PolarHBondContact O-N 3.14Å; Q87-T91 PolarHBondContact O-OG1 3.3Å; F88-T91 WeakPolarHBondContact CA-OG1 3.37Å; F88-T91 PolarHBondContact O-N 3.3Å; F88-T91 VanDerWaalsContact O-N 3.14Å; F88-T91 PolarHBondContact O-OG1 3.15Å; T91-G95 PolarHBondContact O-N 2.7Å
92	F	97.1	Very high	95.2	Very high	34 Å²	34	53.4 Å²	53.4	15%	0.149	30%	0.295	C	S	.	.	H	α-helix	trans	-66.4	-45.1	-179.7	-176.1	-97	0	0	0	112	F88 I89 R90 G95 T96 Y135 T136 M139 L140	F88-F92 HydrophobicContact CZ-CD2 4.33Å; F88-F92 WeakPolarHBondContact O-CB 3.48Å; F88-F92 PolarHBondContact O-N 3.18Å; I89-F92 PolarHBondContact O-N 3.28Å; R90-F92 VanDerWaalsContact C-N 3.35Å; F92-G95 PolarHBondContact O-N 3.08Å; F92-T96 WeakPolarHBondContact O-CB 3.42Å; F92-T96 PolarHBondContact O-N 3.06Å; F92-T96 PolarHBondContact O-OG1 2.65Å; F92-Y135 HydrophobicContact CZ-CE1 4.12Å; F92-T136 HydrophobicContact CE1-CG2 3.73Å; F92-T136 HydrophobicContact CZ-CG2 4.46Å; F92-M139 HydrophobicContact CZ-CB 3.99Å; F92-L140 HydrophobicContact CB-CD2 4.38Å; F92-L140 HydrophobicContact CD1-CD1 3.9Å; F92-L140 HydrophobicContact CD1-CD2 3.59Å; F92-L140 HydrophobicContact CD1-CG 3.76Å; F92-L140 HydrophobicContact CE1-CD1 4.1Å; F92-L140 HydrophobicContact CE1-CD2 3.91Å; F92-L140 HydrophobicContact CE1-CG 3.69Å; F92-L140 HydrophobicContact CG-CD2 3.92Å; F92-L140 HydrophobicContact CZ-CG 4.48Å
93	I	96.9	Very high	95	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.6	-43.9	178.4	-68.8	171.7	0	0	0	110.7	I89 G95 T96 F97 V101 V105 V116 F118	I89-I93 HydrophobicContact CG2-CD1 3.68Å; I89-I93 HydrophobicContact CG2-CG1 4.42Å; I89-I93 WeakPolarHBondContact O-CG1 3.24Å; I89-I93 PolarHBondContact O-N 3.27Å; I93-G95 VanDerWaalsContact C-N 3.26Å; I93-G95 PolarHBondContact O-N 3.32Å; I93-T96 PolarHBondContact O-N 2.69Å; I93-F97 HydrophobicContact CG2-CD2 4.03Å; I93-F97 PolarHBondContact O-N 2.92Å; I93-V101 HydrophobicContact CG2-CG2 4.05Å; I93-V105 HydrophobicContact CB-CG2 4.41Å; I93-V105 HydrophobicContact CD1-CG1 3.73Å; I93-V105 HydrophobicContact CD1-CG2 4.45Å; I93-V105 HydrophobicContact CG2-CG2 4.01Å; I93-V116 HydrophobicContact CD1-CB 4.26Å; I93-V116 HydrophobicContact CD1-CG1 3.29Å; I93-F118 HydrophobicContact CD1-CD1 4.26Å; I93-F118 HydrophobicContact CD1-CE1 4.16Å; I93-F118 HydrophobicContact CG2-CD1 4.02Å; I93-F118 HydrophobicContact CG2-CE1 3.87Å; I93-F118 HydrophobicContact CG2-CE2 4.44Å; I93-F118 HydrophobicContact CG2-CG 4.37Å; I93-F118 HydrophobicContact CG2-CZ 4.09Å
94	N	95.3	Very high	94.9	Very high	91 Å²	91	54 Å²	54	49%	0.487	29%	0.294	S	S	.	.	H	α-helix	trans	-64.2	-32.3	176.3	-73.2	-24.8	0	0	0	112.6	R90	R90-N94 WeakPolarHBondContact O-CB 3.29Å; R90-N94 VanDerWaalsContact O-CG 3.3Å; R90-N94 PolarHBondContact O-N 3.01Å; R90-N94 VanDerWaalsContact O-N 3.15Å; R90-N94 PolarHBondContact O-ND2 2.75Å
95	G	95.6	Very high	94.9	Very high	59 Å²	59	48.4 Å²	48.4	61%	0.608	27%	0.265	S	S	*	.	H	α-helix	trans	-74	-37.9	174	0	0	0	0	0	113.5	T91 F92 I93	T91-G95 PolarHBondContact O-N 2.7Å; F92-G95 PolarHBondContact O-N 3.08Å; I93-G95 VanDerWaalsContact C-N 3.26Å; I93-G95 PolarHBondContact O-N 3.32Å
96	T	95.2	Very high	95	Very high	23 Å²	23	47.3 Å²	47.3	14%	0.141	26%	0.261	C	S	.	.	H	α-helix	trans	-77.2	-34.2	-178	-50.1	0	0	0	0	112.5	F92 I93 P98 L132 Y135 T136	F92-T96 WeakPolarHBondContact O-CB 3.42Å; F92-T96 PolarHBondContact O-N 3.06Å; F92-T96 PolarHBondContact O-OG1 2.65Å; I93-T96 PolarHBondContact O-N 2.69Å; T96-P98 WeakPolarHBondContact O-CD 3.4Å; T96-L132 HydrophobicContact CG2-CD2 4.01Å; T96-Y135 HydrophobicContact CG2-CD1 4.04Å; T96-Y135 HydrophobicContact CG2-CE1 4.06Å; T96-T136 HydrophobicContact CG2-CG2 3.35Å
97	F	93.9	Very high	95	Very high	1 Å²	1	47 Å²	47	0%	0.004	26%	0.259	C	S	.	.	S	Bend	trans	-113.8	69.1	-179.8	-62.4	-79.8	0	0	0	111	I93 L99 L100 V101 F118 L120 L132 T136	I93-F97 HydrophobicContact CG2-CD2 4.03Å; I93-F97 PolarHBondContact O-N 2.92Å; F97-L99 PolarHBondContact O-N 2.84Å; F97-L100 HydrophobicContact CB-CB 4.31Å; F97-L100 HydrophobicContact CB-CD1 4.29Å; F97-L100 HydrophobicContact CD1-CD1 4.26Å; F97-L100 PolarHBondContact O-N 2.83Å; F97-V101 HydrophobicContact CB-CG2 3.7Å; F97-F118 HydrophobicContact CD2-CE2 4.26Å; F97-F118 AromaticContact CD2-CZ 3.97Å; F97-F118 HydrophobicContact CD2-CZ 3.97Å; F97-F118 HydrophobicContact CE2-CE2 4.33Å; F97-F118 AromaticContact CE2-CZ 3.67Å; F97-F118 HydrophobicContact CE2-CZ 3.67Å; F97-F118 HydrophobicContact CZ-CZ 4.16Å; F97-L120 HydrophobicContact CB-CD1 4.12Å; F97-L120 HydrophobicContact CD1-CD1 3.69Å; F97-L120 HydrophobicContact CD1-CD2 4.38Å; F97-L120 HydrophobicContact CE1-CD1 4.37Å; F97-L120 HydrophobicContact CE1-CD2 4.34Å; F97-L120 HydrophobicContact CG-CD1 4.06Å; F97-L132 HydrophobicContact CD1-CD1 4.07Å; F97-L132 HydrophobicContact CE1-CB 3.58Å; F97-L132 HydrophobicContact CE1-CD1 3.89Å; F97-L132 HydrophobicContact CE1-CG 4.38Å; F97-L132 HydrophobicContact CZ-CB 3.84Å; F97-T136 HydrophobicContact CE2-CG2 3.92Å; F97-T136 HydrophobicContact CZ-CG2 4.33Å
98	P	91	Very high	95.1	Very high	83 Å²	83	45.1 Å²	45.1	54%	0.539	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	120.7	-171.2	26.6	-35.5	0	0	0	111.3	T96 L100	T96-P98 WeakPolarHBondContact O-CD 3.4Å; P98-L100 PolarHBondContact O-N 3.27Å
99	L	89.3	Confident	95	Very high	154 Å²	154	43.9 Å²	43.9	81%	0.806	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.8	3.9	178.9	-51.9	173.1	0	0	0	115.9	F97 Q102	F97-L99 PolarHBondContact O-N 2.84Å; L99-Q102 PolarHBondContact O-NE2 3.17Å; L99-Q102 VanDerWaalsContact O-NE2 3.16Å
100	L	93.7	Very high	94.9	Very high	13 Å²	13	48.9 Å²	48.9	7%	0.068	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-33.4	-179.3	-58.3	168.5	0	0	0	112.1	F97 P98 Q102 L120 L121 R123 I124	F97-L100 HydrophobicContact CB-CB 4.31Å; F97-L100 HydrophobicContact CB-CD1 4.29Å; F97-L100 HydrophobicContact CD1-CD1 4.26Å; F97-L100 PolarHBondContact O-N 2.83Å; P98-L100 PolarHBondContact O-N 3.27Å; L100-Q102 PolarHBondContact O-N 3.12Å; L100-Q102 PolarHBondContact O-NE2 3.39Å; L100-L120 HydrophobicContact CB-CD1 3.4Å; L100-L120 VanDerWaalsContact CB-CD1 3.4Å; L100-L120 HydrophobicContact CB-CG 4.38Å; L100-L120 HydrophobicContact CD1-CD1 4.15Å; L100-L120 HydrophobicContact CG-CD1 4.42Å; L100-L121 WeakPolarHBondContact O-CB 3.26Å; L100-L121 PolarHBondContact O-N 3.15Å; L100-R123 HydrophobicContact CD2-CB 3.95Å; L100-I124 HydrophobicContact CD1-CD1 3.29Å; L100-I124 HydrophobicContact CD1-CG1 4.02Å; L100-I124 HydrophobicContact CD2-CD1 4.19Å; L100-I124 HydrophobicContact CD2-CG1 4.12Å; L100-I124 HydrophobicContact CG-CD1 4.32Å
101	V	94.7	Very high	94.6	Very high	23 Å²	23	53.5 Å²	53.5	14%	0.139	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-67.7	117.9	178	-177	0	0	0	0	109.1	I93 F97 S103 V105 F118 L119	I93-V101 HydrophobicContact CG2-CG2 4.05Å; F97-V101 HydrophobicContact CB-CG2 3.7Å; V101-S103 VanDerWaalsContact CG1-O 3.22Å; V101-S103 WeakPolarHBondContact CG1-O 3.39Å; V101-V105 HydrophobicContact CG1-CG2 4.48Å; V101-F118 HydrophobicContact CG1-CB 4.33Å; V101-F118 HydrophobicContact CG1-CD2 4.39Å; V101-F118 HydrophobicContact CG2-CD2 4.12Å; V101-F118 HydrophobicContact CG2-CE2 4.34Å; V101-L119 WeakPolarHBondContact CA-O 3.36Å
102	Q	92.7	Very high	94.4	Very high	32 Å²	32	55 Å²	55	15%	0.15	31%	0.309	C	S	.	.			trans	-101.7	-18.3	-178.6	-61.3	-52.8	-55.1	0	0	113.6	L99 L100 L119 L121 V161	L99-Q102 PolarHBondContact O-NE2 3.17Å; L99-Q102 VanDerWaalsContact O-NE2 3.16Å; L100-Q102 PolarHBondContact O-N 3.12Å; L100-Q102 PolarHBondContact O-NE2 3.39Å; Q102-L119 PolarHBondContact N-O 3.13Å; Q102-L121 HydrophobicContact CG-CB 3.99Å; Q102-L121 HydrophobicContact CG-CD1 4.45Å; Q102-V161 HydrophobicContact CB-CG1 4.46Å; Q102-V161 HydrophobicContact CB-CG2 3.98Å
103	S	90.1	Very high	94.4	Very high	31 Å²	31	55.4 Å²	55.4	22%	0.217	31%	0.314	C	S	.	.	S	Bend	trans	-110.3	166.9	178.4	70.5	0	0	0	0	111.8	V101 L119	V101-S103 VanDerWaalsContact CG1-O 3.22Å; V101-S103 WeakPolarHBondContact CG1-O 3.39Å; S103-L119 PolarHBondContact OG-N 2.85Å
104	E	93.3	Very high	94.4	Very high	79 Å²	79	55.9 Å²	55.9	37%	0.369	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-63.6	149.3	161.5	-62.1	-164	-167.6	0	0	110.1	E50 N65	E50-E104 VanDerWaalsContact CG-CD 3.47Å; E50-E104 HydrophobicContact CG-CG 4.06Å; E50-E104 WeakPolarHBondContact CG-OE1 3.4Å; N65-E104 PolarHBondContact ND2-OE2 2.88Å
105	V	96.5	Very high	94.5	Very high	5 Å²	5	55.7 Å²	55.7	3%	0.03	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-81.4	122.6	178.9	177.9	0	0	0	0	108.9	R90 I93 V101 I107 V116 F118	R90-V105 HydrophobicContact CG-CB 4.24Å; I93-V105 HydrophobicContact CB-CG2 4.41Å; I93-V105 HydrophobicContact CD1-CG1 3.73Å; I93-V105 HydrophobicContact CD1-CG2 4.45Å; I93-V105 HydrophobicContact CG2-CG2 4.01Å; V101-V105 HydrophobicContact CG1-CG2 4.48Å; V105-I107 HydrophobicContact CG1-CG1 4.12Å; V105-V116 HydrophobicContact CG1-CG1 3.26Å; V105-F118 HydrophobicContact CG2-CB 4.31Å
106	I	97.4	Very high	94.6	Very high	49 Å²	49	52.9 Å²	52.9	25%	0.251	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	121.2	177.9	-53.4	-58.4	0	0	0	109	N65 K108 V116 A117	N65-I106 HydrophobicContact CB-CD1 4.05Å; N65-I106 WeakPolarHBondContact O-CA 3.5Å; N65-I106 VanDerWaalsContact OD1-CD1 3.32Å; N65-I106 WeakPolarHBondContact OD1-CD1 3.48Å; I106-K108 HydrophobicContact CG2-CG 4.42Å; I106-V116 WeakPolarHBondContact O-CA 3.38Å; I106-A117 HydrophobicContact CB-CB 4.35Å; I106-A117 PolarHBondContact N-O 2.81Å; I106-A117 PolarHBondContact O-N 2.83Å
107	I	97.7	Very high	94.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.8	-179.3	-55.9	174.7	0	0	0	108.6	N65 S66 W67 D86 I89 R90 V105 I114 V116	N65-I107 PolarHBondContact O-N 3.45Å; S66-I107 CarbonylContact C-O 3.58Å; S66-I107 WeakPolarHBondContact CA-O 3.23Å; W67-I107 PolarHBondContact N-O 3.14Å; D86-I107 HydrophobicContact CB-CD1 4.39Å; D86-I107 WeakPolarHBondContact OD1-CD1 3.15Å; D86-I107 WeakPolarHBondContact OD1-CG2 3.15Å; I89-I107 HydrophobicContact CB-CD1 3.97Å; I89-I107 HydrophobicContact CD1-CD1 4.33Å; I89-I107 HydrophobicContact CG2-CD1 3.78Å; I89-I107 HydrophobicContact CG2-CG1 4.3Å; R90-I107 HydrophobicContact CG-CD1 4.3Å; V105-I107 HydrophobicContact CG1-CG1 4.12Å; I107-I114 HydrophobicContact CG2-CG2 3.76Å; I107-V116 HydrophobicContact CG1-CG1 4.23Å
108	K	97.5	Very high	94.8	Very high	75 Å²	75	52.9 Å²	52.9	33%	0.326	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	120.8	176	-52.8	168.2	-170	159.7	0	108.7	I106 R115 E151	I106-K108 HydrophobicContact CG2-CG 4.42Å; K108-R115 HydrophobicContact CB-CB 4.26Å; K108-R115 PolarHBondContact N-O 3.37Å; K108-R115 PolarHBondContact O-N 2.87Å; K108-E151 IonicContact NZ-OE2 3.92Å; K108-E151 PolarHBondContact NZ-OE2 2.82Å
109	R	95.7	Very high	95	Very high	47 Å²	47	50.8 Å²	50.8	18%	0.177	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126.5	172.9	-65.9	-171.5	173.5	70.8	3.5	110	W67 D86 I114	W67-R109 PolarHBondContact O-N 3.01Å; D86-R109 IonicContact OD1-CZ 2.69Å; D86-R109 IonicContact OD1-NH1 3.01Å; D86-R109 PolarHBondContact OD1-NH1 3.26Å; D86-R109 IonicContact OD1-NH2 2.65Å; D86-R109 PolarHBondContact OD1-NH2 3.37Å; D86-R109 IonicContact OD2-CZ 3.96Å; D86-R109 IonicContact OD2-NH1 3.09Å; D86-R109 PolarHBondContact OD2-NH1 3.19Å; D86-R109 IonicContact OD2-NH2 3.06Å; R109-I114 HydrophobicContact CG-CG1 4.3Å
110	Q	94.7	Very high	95.3	Very high	106 Å²	106	43.5 Å²	43.5	50%	0.495	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	110.8	174.5	-69	-178.9	-29.3	0	0	107.9	N112 V113 R115	Q110-N112 PolarHBondContact O-N 3.27Å; Q110-V113 PolarHBondContact N-O 3.36Å; Q110-V113 WeakPolarHBondContact O-CB 3.33Å; Q110-V113 PolarHBondContact O-N 3.34Å; Q110-R115 VanDerWaalsContact OE1-NE 3.15Å
111	C	91.4	Very high	95.3	Very high	144 Å²	144	43.2 Å²	43.2	97%	0.973	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	-130.7	-173	-54.4	0	0	0	0	110.7	V113	C111-V113 VanDerWaalsContact C-N 3.25Å; C111-V113 PolarHBondContact O-N 2.84Å
112	N	93.2	Very high	95.2	Very high	106 Å²	106	48.8 Å²	48.8	57%	0.567	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.4	19.9	177	-165.3	26.1	0	0	0	113.9	Q110 C146 V147	Q110-N112 PolarHBondContact O-N 3.27Å; N112-C146 VanDerWaalsContact OD1-CB 3.3Å; N112-C146 WeakPolarHBondContact OD1-CB 3.47Å; N112-V147 PolarHBondContact O-N 2.95Å; N112-V147 VanDerWaalsContact O-N 3.17Å
113	V	96.5	Very high	95	Very high	42 Å²	42	55.9 Å²	55.9	26%	0.255	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.5	-179.7	-173.2	0	0	0	0	109.6	Q110 C111 R115 V147 K149	Q110-V113 PolarHBondContact N-O 3.36Å; Q110-V113 WeakPolarHBondContact O-CB 3.33Å; Q110-V113 PolarHBondContact O-N 3.34Å; C111-V113 VanDerWaalsContact C-N 3.25Å; C111-V113 PolarHBondContact O-N 2.84Å; V113-R115 HydrophobicContact CG1-CG 4.33Å; V113-V147 CarbonylContact C-O 3.58Å; V113-V147 WeakPolarHBondContact CA-O 3.49Å; V113-V147 HydrophobicContact CG1-CG1 4.47Å; V113-V147 HydrophobicContact CG2-CB 4.36Å; V113-K149 HydrophobicContact CG1-CD 4.45Å; V113-K149 HydrophobicContact CG1-CG 4.46Å
114	I	97.2	Very high	95	Very high	10 Å²	10	56.8 Å²	56.8	5%	0.051	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	113.6	171.9	-52.6	-173.5	0	0	0	108.1	I89 I107 R109 V116 L144 C146 V147 V148 K149	I89-I114 HydrophobicContact CD1-CD1 4.33Å; I89-I114 HydrophobicContact CD1-CG2 4.15Å; I107-I114 HydrophobicContact CG2-CG2 3.76Å; R109-I114 HydrophobicContact CG-CG1 4.3Å; I114-V116 HydrophobicContact CG2-CG2 3.88Å; I114-L144 HydrophobicContact CD1-CD1 4.13Å; I114-C146 WeakPolarHBondContact CD1-SG 3.27Å; I114-V147 PolarHBondContact N-O 3.29Å; I114-V148 HydrophobicContact CB-CG2 4.36Å; I114-V148 WeakPolarHBondContact O-CA 3.36Å; I114-K149 PolarHBondContact O-N 2.95Å
115	R	97.8	Very high	95	Very high	87 Å²	87	55.4 Å²	55.4	33%	0.328	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	125.5	171.9	-61.1	167.6	178.3	-117.8	5.8	108.7	K108 Q110 V113 K149 E151	K108-R115 HydrophobicContact CB-CB 4.26Å; K108-R115 PolarHBondContact N-O 3.37Å; K108-R115 PolarHBondContact O-N 2.87Å; Q110-R115 VanDerWaalsContact OE1-NE 3.15Å; V113-R115 HydrophobicContact CG1-CG 4.33Å; R115-K149 CarbonylContact C-O 3.56Å; R115-K149 VanDerWaalsContact CA-O 3.31Å; R115-K149 WeakPolarHBondContact CA-O 3.32Å; R115-E151 WeakPolarHBondContact CD-OE1 3.46Å; R115-E151 IonicContact CZ-OE1 3.87Å; R115-E151 IonicContact NH1-OE1 2.9Å; R115-E151 PolarHBondContact NH1-OE1 3.34Å
116	V	97.6	Very high	94.9	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118.8	179.4	-169.6	0	0	0	0	109.6	I89 I93 V105 I106 I107 I114 F118 V148 K149 L150 E151	I89-V116 HydrophobicContact CG2-CG1 4.08Å; I89-V116 HydrophobicContact CG2-CG2 3.94Å; I93-V116 HydrophobicContact CD1-CB 4.26Å; I93-V116 HydrophobicContact CD1-CG1 3.29Å; V105-V116 HydrophobicContact CG1-CG1 3.26Å; I106-V116 WeakPolarHBondContact O-CA 3.38Å; I107-V116 HydrophobicContact CG1-CG1 4.23Å; I114-V116 HydrophobicContact CG2-CG2 3.88Å; V116-F118 HydrophobicContact CG1-CD1 4.45Å; V116-V148 HydrophobicContact CG2-CG1 4.3Å; V116-K149 PolarHBondContact N-O 2.87Å; V116-L150 HydrophobicContact CB-CD2 3.65Å; V116-L150 HydrophobicContact CG1-CD2 4.36Å; V116-L150 HydrophobicContact CG2-CD2 4.29Å; V116-L150 CarbonylContact O-C 3.58Å; V116-L150 WeakPolarHBondContact O-CA 3.44Å; V116-E151 PolarHBondContact O-N 2.77Å
117	A	97.1	Very high	94.8	Very high	18 Å²	18	60.3 Å²	60.3	15%	0.149	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	136.2	-176.9	0	0	0	0	0	111	I106 E151	I106-A117 HydrophobicContact CB-CB 4.35Å; I106-A117 PolarHBondContact N-O 2.81Å; I106-A117 PolarHBondContact O-N 2.83Å; A117-E151 VanDerWaalsContact CA-O 3.29Å; A117-E151 WeakPolarHBondContact CA-O 3.28Å; A117-E151 HydrophobicContact CB-CB 3.88Å
118	F	96.1	Very high	94.6	Very high	7 Å²	7	65.5 Å²	65.5	3%	0.031	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	159.7	174.6	58.5	-90.5	0	0	0	111.3	I93 F97 V101 V105 V116 L120 L150 E151 V152 Q153	I93-F118 HydrophobicContact CD1-CD1 4.26Å; I93-F118 HydrophobicContact CD1-CE1 4.16Å; I93-F118 HydrophobicContact CG2-CD1 4.02Å; I93-F118 HydrophobicContact CG2-CE1 3.87Å; I93-F118 HydrophobicContact CG2-CE2 4.44Å; I93-F118 HydrophobicContact CG2-CG 4.37Å; I93-F118 HydrophobicContact CG2-CZ 4.09Å; F97-F118 HydrophobicContact CD2-CE2 4.26Å; F97-F118 AromaticContact CD2-CZ 3.97Å; F97-F118 HydrophobicContact CD2-CZ 3.97Å; F97-F118 HydrophobicContact CE2-CE2 4.33Å; F97-F118 AromaticContact CE2-CZ 3.67Å; F97-F118 HydrophobicContact CE2-CZ 3.67Å; F97-F118 HydrophobicContact CZ-CZ 4.16Å; V101-F118 HydrophobicContact CG1-CB 4.33Å; V101-F118 HydrophobicContact CG1-CD2 4.39Å; V101-F118 HydrophobicContact CG2-CD2 4.12Å; V101-F118 HydrophobicContact CG2-CE2 4.34Å; V105-F118 HydrophobicContact CG2-CB 4.31Å; V116-F118 HydrophobicContact CG1-CD1 4.45Å; F118-L120 HydrophobicContact CD2-CB 4.42Å; F118-L120 HydrophobicContact CE2-CB 4.18Å; F118-L120 HydrophobicContact CE2-CD1 4.1Å; F118-L150 HydrophobicContact CE1-CD1 4.29Å; F118-L150 HydrophobicContact CE1-CD2 4.24Å; F118-L150 HydrophobicContact CZ-CD1 4.47Å; F118-E151 PolarHBondContact N-O 3.28Å; F118-V152 HydrophobicContact CE1-CG2 4Å; F118-V152 HydrophobicContact CE2-CG1 4Å; F118-V152 HydrophobicContact CE2-CG2 4.04Å; F118-V152 HydrophobicContact CZ-CG1 4.39Å; F118-V152 HydrophobicContact CZ-CG2 3.58Å; F118-Q153 PolarHBondContact O-N 3.03Å; F118-Q153 VanDerWaalsContact O-N 3.14Å
119	L	95.6	Very high	94.5	Very high	38 Å²	38	62.5 Å²	62.5	20%	0.199	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	121.1	175.2	-60.6	-173.9	0	0	0	110.6	V101 Q102 S103 Q153 V155 V161	V101-L119 WeakPolarHBondContact CA-O 3.36Å; Q102-L119 PolarHBondContact N-O 3.13Å; S103-L119 PolarHBondContact OG-N 2.85Å; L119-Q153 WeakPolarHBondContact CA-O 3.22Å; L119-Q153 HydrophobicContact CD2-CB 3.74Å; L119-Q153 HydrophobicContact CD2-CG 3.95Å; L119-V155 HydrophobicContact CB-CG2 3.85Å; L119-V155 HydrophobicContact CD1-CG2 4.11Å; L119-V155 HydrophobicContact CD2-CG2 4.14Å; L119-V155 HydrophobicContact CG-CG2 4.25Å; L119-V161 HydrophobicContact CD1-CG1 4.04Å; L119-V161 HydrophobicContact CD1-CG2 4.15Å
120	L	95.2	Very high	94.4	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.005	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129	179.5	-170.9	73.1	0	0	0	110.9	F97 L100 F118 V129 V152 Q153 M154 V155	F97-L120 HydrophobicContact CB-CD1 4.12Å; F97-L120 HydrophobicContact CD1-CD1 3.69Å; F97-L120 HydrophobicContact CD1-CD2 4.38Å; F97-L120 HydrophobicContact CE1-CD1 4.37Å; F97-L120 HydrophobicContact CE1-CD2 4.34Å; F97-L120 HydrophobicContact CG-CD1 4.06Å; L100-L120 HydrophobicContact CB-CD1 3.4Å; L100-L120 VanDerWaalsContact CB-CD1 3.4Å; L100-L120 HydrophobicContact CB-CG 4.38Å; L100-L120 HydrophobicContact CD1-CD1 4.15Å; L100-L120 HydrophobicContact CG-CD1 4.42Å; F118-L120 HydrophobicContact CD2-CB 4.42Å; F118-L120 HydrophobicContact CE2-CB 4.18Å; F118-L120 HydrophobicContact CE2-CD1 4.1Å; L120-V129 HydrophobicContact CD2-CG1 3.88Å; L120-V129 HydrophobicContact CD2-CG2 4.13Å; L120-V152 HydrophobicContact CB-CG1 3.52Å; L120-V152 HydrophobicContact CD2-CG1 3.97Å; L120-V152 HydrophobicContact CG-CG1 4.35Å; L120-Q153 PolarHBondContact N-O 3.31Å; L120-M154 HydrophobicContact CB-SD 4.04Å; L120-M154 HydrophobicContact CD2-CE 4.14Å; L120-M154 HydrophobicContact CD2-SD 3.83Å; L120-M154 HydrophobicContact CG-CE 4.48Å; L120-M154 HydrophobicContact CG-SD 4.3Å; L120-M154 CarbonylContact O-C 3.56Å; L120-M154 WeakPolarHBondContact O-CA 3.3Å; L120-V155 PolarHBondContact O-N 2.95Å
121	L	94.4	Very high	94.5	Very high	7 Å²	7	65.9 Å²	65.9	4%	0.037	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	131.6	176	-170	66.3	0	0	0	111.3	L100 Q102 R123	L100-L121 WeakPolarHBondContact O-CB 3.26Å; L100-L121 PolarHBondContact O-N 3.15Å; Q102-L121 HydrophobicContact CG-CB 3.99Å; Q102-L121 HydrophobicContact CG-CD1 4.45Å; L121-R123 HydrophobicContact CD2-CG 3.84Å; L121-R123 HydrophobicContact CG-CG 4.02Å; L121-R123 PolarHBondContact O-N 2.88Å
122	K	90.6	Very high	94.7	Very high	141 Å²	141	60.6 Å²	60.6	61%	0.613	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	66.9	179.4	-167.1	-175	176.8	-179.3	0	112.3	M154 V155	K122-M154 HydrophobicContact CB-CE 4.01Å; K122-M154 HydrophobicContact CG-CE 4.15Å; K122-V155 WeakPolarHBondContact CB-O 3.33Å; K122-V155 PolarHBondContact N-O 3.43Å
123	R	90.4	Very high	94.9	Very high	181 Å²	181	57.4 Å²	57.4	68%	0.683	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-19.9	173.2	-75.8	-175.4	176.8	177.1	1.6	114.2	L100 L121	L100-R123 HydrophobicContact CD2-CB 3.95Å; L121-R123 HydrophobicContact CD2-CG 3.84Å; L121-R123 HydrophobicContact CG-CG 4.02Å; L121-R123 PolarHBondContact O-N 2.88Å
124	I	89.8	Confident	94.9	Very high	49 Å²	49	56.8 Å²	56.8	25%	0.251	30%	0.303	S	S	.	.	S	Bend	trans	-105.7	153.8	-171.8	-66.3	-165.3	0	0	0	110.4	L100 E128 V129	L100-I124 HydrophobicContact CD1-CD1 3.29Å; L100-I124 HydrophobicContact CD1-CG1 4.02Å; L100-I124 HydrophobicContact CD2-CD1 4.19Å; L100-I124 HydrophobicContact CD2-CG1 4.12Å; L100-I124 HydrophobicContact CG-CD1 4.32Å; I124-E128 HydrophobicContact CG2-CB 3.28Å; I124-E128 HydrophobicContact CG2-CG 4.2Å; I124-E128 VanDerWaalsContact CG2-OE2 3.28Å; I124-E128 WeakPolarHBondContact CG2-OE2 3.39Å; I124-V129 HydrophobicContact CB-CG2 4.02Å; I124-V129 HydrophobicContact CG2-CG2 3.92Å
125	S	93.4	Very high	94.9	Very high	50 Å²	50	61.1 Å²	61.1	35%	0.35	32%	0.32	S	S	.	.			trans	-60.6	145.3	174.7	75.9	0	0	0	0	110.9	G127 E128 V129	S125-G127 PolarHBondContact O-N 2.89Å; S125-E128 PolarHBondContact O-N 2.88Å; S125-E128 WeakPolarHBondContact OG-CB 3.48Å; S125-E128 VanDerWaalsContact OG-CD 3.24Å; S125-E128 WeakPolarHBondContact OG-CG 3.37Å; S125-E128 PolarHBondContact OG-N 2.82Å; S125-E128 PolarHBondContact OG-OE1 2.95Å; S125-V129 WeakPolarHBondContact O-CG2 3.31Å; S125-V129 PolarHBondContact O-N 3.42Å
126	P	93.3	Very high	94.9	Very high	107 Å²	107	57 Å²	57	70%	0.695	30%	0.304	S	S	*	.	H	α-helix	trans	-60.7	-29	-179.5	23.9	-33.6	0	0	0	112.8	V129 S130	P126-V129 PolarHBondContact O-N 2.8Å; P126-S130 PolarHBondContact O-N 3.45Å; P126-S130 PolarHBondContact O-OG 3.33Å; P126-S130 VanDerWaalsContact O-OG 3.08Å
127	G	95.4	Very high	94.9	Very high	51 Å²	51	59.6 Å²	59.6	53%	0.526	32%	0.316	S	S	.	.	H	α-helix	trans	-66.2	-46.1	176	0	0	0	0	0	112.8	S125 S130 F131	S125-G127 PolarHBondContact O-N 2.89Å; G127-S130 PolarHBondContact O-N 2.91Å; G127-F131 WeakPolarHBondContact O-CB 3.41Å; G127-F131 PolarHBondContact O-N 3.05Å
128	E	94	Very high	94.9	Very high	108 Å²	108	64.5 Å²	64.5	51%	0.505	34%	0.336	S	S	.	.	H	α-helix	trans	-64.6	-39.1	174.8	-76.9	161.9	-116.5	0	0	111.9	I124 S125 F131 L132	I124-E128 HydrophobicContact CG2-CB 3.28Å; I124-E128 HydrophobicContact CG2-CG 4.2Å; I124-E128 VanDerWaalsContact CG2-OE2 3.28Å; I124-E128 WeakPolarHBondContact CG2-OE2 3.39Å; S125-E128 PolarHBondContact O-N 2.88Å; S125-E128 WeakPolarHBondContact OG-CB 3.48Å; S125-E128 VanDerWaalsContact OG-CD 3.24Å; S125-E128 WeakPolarHBondContact OG-CG 3.37Å; S125-E128 PolarHBondContact OG-N 2.82Å; S125-E128 PolarHBondContact OG-OE1 2.95Å; E128-F131 PolarHBondContact O-N 3.21Å; E128-L132 WeakPolarHBondContact O-CB 3.42Å; E128-L132 WeakPolarHBondContact O-CG 3.31Å; E128-L132 PolarHBondContact O-N 2.94Å
129	V	94.3	Very high	95	Very high	13 Å²	13	67.2 Å²	67.2	8%	0.079	35%	0.35	C	S	.	.	H	α-helix	trans	-61.2	-48.8	175.3	173.5	0	0	0	0	110.6	L120 I124 S125 P126 F131 L132 I133 M154	L120-V129 HydrophobicContact CD2-CG1 3.88Å; L120-V129 HydrophobicContact CD2-CG2 4.13Å; I124-V129 HydrophobicContact CB-CG2 4.02Å; I124-V129 HydrophobicContact CG2-CG2 3.92Å; S125-V129 WeakPolarHBondContact O-CG2 3.31Å; S125-V129 PolarHBondContact O-N 3.42Å; P126-V129 PolarHBondContact O-N 2.8Å; V129-F131 VanDerWaalsContact C-N 3.31Å; V129-F131 PolarHBondContact O-N 3.18Å; V129-L132 PolarHBondContact O-N 2.83Å; V129-I133 HydrophobicContact CG1-CD1 3.68Å; V129-I133 HydrophobicContact CG1-CG1 4.35Å; V129-I133 WeakPolarHBondContact O-CB 3.43Å; V129-I133 VanDerWaalsContact O-CG1 3.25Å; V129-I133 WeakPolarHBondContact O-CG1 3.34Å; V129-I133 PolarHBondContact O-N 2.82Å; V129-M154 HydrophobicContact CG1-SD 4.39Å; V129-M154 HydrophobicContact CG2-CE 4.41Å
130	S	95.1	Very high	95.1	Very high	80 Å²	80	65.4 Å²	65.4	56%	0.559	34%	0.34	S	S	*	.	H	α-helix	trans	-61.2	-39.4	177.1	-64.4	0	0	0	0	112.4	P126 G127 I133 G134	P126-S130 PolarHBondContact O-N 3.45Å; P126-S130 PolarHBondContact O-OG 3.33Å; P126-S130 VanDerWaalsContact O-OG 3.08Å; G127-S130 PolarHBondContact O-N 2.91Å; S130-I133 PolarHBondContact O-N 2.8Å; S130-G134 PolarHBondContact O-N 3.03Å
131	F	96.5	Very high	95.2	Very high	143 Å²	143	66.8 Å²	66.8	63%	0.627	35%	0.35	S	S	*	.	H	α-helix	trans	-61.8	-49	174.8	173.8	-96.5	0	0	0	111.8	G127 E128 V129 I133 G134 Y135	G127-F131 WeakPolarHBondContact O-CB 3.41Å; G127-F131 PolarHBondContact O-N 3.05Å; E128-F131 PolarHBondContact O-N 3.21Å; V129-F131 VanDerWaalsContact C-N 3.31Å; V129-F131 PolarHBondContact O-N 3.18Å; F131-I133 VanDerWaalsContact C-N 3.33Å; F131-I133 PolarHBondContact O-N 2.9Å; F131-G134 PolarHBondContact O-N 3.42Å; F131-Y135 WeakPolarHBondContact O-CB 3.27Å; F131-Y135 PolarHBondContact O-N 3.3Å
132	L	95.9	Very high	95.3	Very high	34 Å²	34	72.2 Å²	72.2	18%	0.178	38%	0.378	C	S	.	.	H	α-helix	trans	-64.5	-38.4	179.3	-71.1	174.1	0	0	0	111.8	T96 F97 E128 V129 Y135 T136	T96-L132 HydrophobicContact CG2-CD2 4.01Å; F97-L132 HydrophobicContact CD1-CD1 4.07Å; F97-L132 HydrophobicContact CE1-CB 3.58Å; F97-L132 HydrophobicContact CE1-CD1 3.89Å; F97-L132 HydrophobicContact CE1-CG 4.38Å; F97-L132 HydrophobicContact CZ-CB 3.84Å; E128-L132 WeakPolarHBondContact O-CB 3.42Å; E128-L132 WeakPolarHBondContact O-CG 3.31Å; E128-L132 PolarHBondContact O-N 2.94Å; V129-L132 PolarHBondContact O-N 2.83Å; L132-Y135 PolarHBondContact O-N 2.87Å; L132-T136 WeakPolarHBondContact O-CB 3.28Å; L132-T136 VanDerWaalsContact O-CG2 3.28Å; L132-T136 WeakPolarHBondContact O-CG2 3.34Å; L132-T136 PolarHBondContact O-N 2.9Å; L132-T136 PolarHBondContact O-OG1 2.97Å
133	I	96.4	Very high	95.6	Very high	38 Å²	38	70 Å²	70	20%	0.195	37%	0.372	C	S	.	.	H	α-helix	trans	-60.6	-51	174.6	-69.8	168.8	0	0	0	110.2	V129 S130 F131 Y135 T136 E137 L150 V152	V129-I133 HydrophobicContact CG1-CD1 3.68Å; V129-I133 HydrophobicContact CG1-CG1 4.35Å; V129-I133 WeakPolarHBondContact O-CB 3.43Å; V129-I133 VanDerWaalsContact O-CG1 3.25Å; V129-I133 WeakPolarHBondContact O-CG1 3.34Å; V129-I133 PolarHBondContact O-N 2.82Å; S130-I133 PolarHBondContact O-N 2.8Å; F131-I133 VanDerWaalsContact C-N 3.33Å; F131-I133 PolarHBondContact O-N 2.9Å; I133-Y135 PolarHBondContact O-N 3.46Å; I133-T136 WeakPolarHBondContact CA-OG1 3.49Å; I133-T136 PolarHBondContact O-N 2.72Å; I133-T136 PolarHBondContact O-OG1 2.89Å; I133-E137 WeakPolarHBondContact O-CG 3.37Å; I133-E137 PolarHBondContact O-N 2.71Å; I133-L150 HydrophobicContact CG2-CB 4.32Å; I133-L150 HydrophobicContact CG2-CD1 4.43Å; I133-V152 HydrophobicContact CD1-CB 4.19Å; I133-V152 HydrophobicContact CD1-CG2 3.9Å; I133-V152 HydrophobicContact CG1-CG2 4Å
134	G	97.3	Very high	95.8	Very high	30 Å²	30	62.5 Å²	62.5	31%	0.309	35%	0.346	S	S	.	.	H	α-helix	trans	-61.8	-43.6	177.6	0	0	0	0	0	113	S130 F131 T136 E137 E138	S130-G134 PolarHBondContact O-N 3.03Å; F131-G134 PolarHBondContact O-N 3.42Å; G134-T136 VanDerWaalsContact C-N 3.34Å; G134-T136 PolarHBondContact O-N 3.44Å; G134-E137 PolarHBondContact O-N 3.32Å; G134-E138 WeakPolarHBondContact O-CB 3.48Å; G134-E138 WeakPolarHBondContact O-CG 3.27Å; G134-E138 PolarHBondContact O-N 3.01Å
135	Y	97.3	Very high	96.1	Very high	100 Å²	100	70.9 Å²	70.9	39%	0.392	37%	0.374	S	S	.	.	H	α-helix	trans	-56.9	-47.3	175.6	166.2	-101.2	0	0	0	111.9	F92 T96 F131 L132 I133 M139	F92-Y135 HydrophobicContact CZ-CE1 4.12Å; T96-Y135 HydrophobicContact CG2-CD1 4.04Å; T96-Y135 HydrophobicContact CG2-CE1 4.06Å; F131-Y135 WeakPolarHBondContact O-CB 3.27Å; F131-Y135 PolarHBondContact O-N 3.3Å; L132-Y135 PolarHBondContact O-N 2.87Å; I133-Y135 PolarHBondContact O-N 3.46Å; Y135-M139 HydrophobicContact CD2-CG 3.79Å; Y135-M139 HydrophobicContact CE1-CG 4.33Å; Y135-M139 HydrophobicContact CE2-CG 3.4Å; Y135-M139 VanDerWaalsContact CE2-CG 3.4Å; Y135-M139 HydrophobicContact CE2-SD 4.12Å; Y135-M139 HydrophobicContact CG-CG 4.4Å; Y135-M139 VanDerWaalsContact O-CB 3.27Å; Y135-M139 WeakPolarHBondContact O-CB 2.98Å; Y135-M139 WeakPolarHBondContact O-CG 3.41Å; Y135-M139 PolarHBondContact O-N 3.46Å
136	T	97.3	Very high	96.1	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-70.6	-39.8	-177.5	46.6	0	0	0	0	112.5	F92 T96 F97 L132 I133 G134 L140 L150	F92-T136 HydrophobicContact CE1-CG2 3.73Å; F92-T136 HydrophobicContact CZ-CG2 4.46Å; T96-T136 HydrophobicContact CG2-CG2 3.35Å; F97-T136 HydrophobicContact CE2-CG2 3.92Å; F97-T136 HydrophobicContact CZ-CG2 4.33Å; L132-T136 WeakPolarHBondContact O-CB 3.28Å; L132-T136 VanDerWaalsContact O-CG2 3.28Å; L132-T136 WeakPolarHBondContact O-CG2 3.34Å; L132-T136 PolarHBondContact O-N 2.9Å; L132-T136 PolarHBondContact O-OG1 2.97Å; I133-T136 WeakPolarHBondContact CA-OG1 3.49Å; I133-T136 PolarHBondContact O-N 2.72Å; I133-T136 PolarHBondContact O-OG1 2.89Å; G134-T136 VanDerWaalsContact C-N 3.34Å; G134-T136 PolarHBondContact O-N 3.44Å; T136-L140 VanDerWaalsContact O-CB 3.27Å; T136-L140 WeakPolarHBondContact O-CB 3.38Å; T136-L140 VanDerWaalsContact O-CG 3.27Å; T136-L140 WeakPolarHBondContact O-CG 3.49Å; T136-L140 PolarHBondContact O-N 2.9Å; T136-L150 WeakPolarHBondContact OG1-CD1 3.32Å
137	E	97.7	Very high	96.3	Very high	55 Å²	55	67.6 Å²	67.6	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-61.2	-48.2	174.7	-73.7	-174.5	154.9	0	0	111.7	I133 G134 S141 K149 L150	I133-E137 WeakPolarHBondContact O-CG 3.37Å; I133-E137 PolarHBondContact O-N 2.71Å; G134-E137 PolarHBondContact O-N 3.32Å; E137-S141 WeakPolarHBondContact O-CB 3.25Å; E137-S141 PolarHBondContact O-N 3.28Å; E137-S141 PolarHBondContact O-OG 2.9Å; E137-K149 WeakPolarHBondContact OE1-CA 3.45Å; E137-L150 HydrophobicContact CG-CB 4.22Å; E137-L150 HydrophobicContact CG-CD1 4.38Å; E137-L150 HydrophobicContact CG-CG 3.81Å; E137-L150 PolarHBondContact OE1-N 2.89Å
138	E	97.9	Very high	96.4	Very high	121 Å²	121	65.4 Å²	65.4	57%	0.565	33%	0.327	S	S	*	.	H	α-helix	trans	-66.4	-49	179.8	-73	-63	145.4	0	0	112	G134 L140 S141 L142	G134-E138 WeakPolarHBondContact O-CB 3.48Å; G134-E138 WeakPolarHBondContact O-CG 3.27Å; G134-E138 PolarHBondContact O-N 3.01Å; E138-L140 PolarHBondContact O-N 3.47Å; E138-S141 PolarHBondContact O-N 3.45Å; E138-L142 WeakPolarHBondContact O-CG 3.4Å; E138-L142 PolarHBondContact O-N 3.33Å
139	M	97.5	Very high	96.6	Very high	64 Å²	64	65.4 Å²	65.4	32%	0.315	33%	0.325	S	S	.	.	H	α-helix	trans	-61.2	-46.5	-179.8	-74.3	-64.6	104.7	0	0	112.3	F92 Y135 S141 L142 I143	F92-M139 HydrophobicContact CZ-CB 3.99Å; Y135-M139 HydrophobicContact CD2-CG 3.79Å; Y135-M139 HydrophobicContact CE1-CG 4.33Å; Y135-M139 HydrophobicContact CE2-CG 3.4Å; Y135-M139 VanDerWaalsContact CE2-CG 3.4Å; Y135-M139 HydrophobicContact CE2-SD 4.12Å; Y135-M139 HydrophobicContact CG-CG 4.4Å; Y135-M139 VanDerWaalsContact O-CB 3.27Å; Y135-M139 WeakPolarHBondContact O-CB 2.98Å; Y135-M139 WeakPolarHBondContact O-CG 3.41Å; Y135-M139 PolarHBondContact O-N 3.46Å; M139-S141 VanDerWaalsContact C-N 3.32Å; M139-S141 PolarHBondContact O-N 3.47Å; M139-L142 HydrophobicContact CE-CD1 3.94Å; M139-L142 PolarHBondContact O-N 2.95Å; M139-I143 VanDerWaalsContact O-CG1 3.28Å; M139-I143 WeakPolarHBondContact O-CG1 3.5Å; M139-I143 PolarHBondContact O-N 3.4Å
140	L	97.4	Very high	96.7	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-67.3	-35.8	178.8	-70.6	175.7	0	0	0	111.6	F88 F92 T136 E138 I143 L144 V148	F88-L140 HydrophobicContact CD1-CD2 4.36Å; F88-L140 HydrophobicContact CE1-CD2 3.77Å; F92-L140 HydrophobicContact CB-CD2 4.38Å; F92-L140 HydrophobicContact CD1-CD1 3.9Å; F92-L140 HydrophobicContact CD1-CD2 3.59Å; F92-L140 HydrophobicContact CD1-CG 3.76Å; F92-L140 HydrophobicContact CE1-CD1 4.1Å; F92-L140 HydrophobicContact CE1-CD2 3.91Å; F92-L140 HydrophobicContact CE1-CG 3.69Å; F92-L140 HydrophobicContact CG-CD2 3.92Å; F92-L140 HydrophobicContact CZ-CG 4.48Å; T136-L140 VanDerWaalsContact O-CB 3.27Å; T136-L140 WeakPolarHBondContact O-CB 3.38Å; T136-L140 VanDerWaalsContact O-CG 3.27Å; T136-L140 WeakPolarHBondContact O-CG 3.49Å; T136-L140 PolarHBondContact O-N 2.9Å; E138-L140 PolarHBondContact O-N 3.47Å; L140-I143 PolarHBondContact O-N 2.99Å; L140-L144 WeakPolarHBondContact O-CB 3.32Å; L140-L144 PolarHBondContact O-N 3.49Å; L140-V148 HydrophobicContact CB-CB 4.13Å; L140-V148 HydrophobicContact CB-CG1 4.12Å; L140-V148 HydrophobicContact CB-CG2 3.85Å; L140-V148 HydrophobicContact CD1-CG1 4.06Å
141	S	97.2	Very high	96.8	Very high	31 Å²	31	65.1 Å²	65.1	22%	0.217	31%	0.314	C	S	.	.	H	α-helix	trans	-64.6	-40.1	177	-61.6	0	0	0	0	112.1	E137 E138 M139 R145 C146 V148	E137-S141 WeakPolarHBondContact O-CB 3.25Å; E137-S141 PolarHBondContact O-N 3.28Å; E137-S141 PolarHBondContact O-OG 2.9Å; E138-S141 PolarHBondContact O-N 3.45Å; M139-S141 VanDerWaalsContact C-N 3.32Å; M139-S141 PolarHBondContact O-N 3.47Å; S141-R145 WeakPolarHBondContact O-CA 3.46Å; S141-R145 PolarHBondContact O-N 3.35Å; S141-C146 VanDerWaalsContact CA-O 3.22Å; S141-C146 WeakPolarHBondContact CA-O 3.28Å; S141-C146 WeakPolarHBondContact CB-O 3.2Å; S141-C146 PolarHBondContact OG-O 3.37Å; S141-V148 PolarHBondContact OG-N 3.41Å; S141-V148 VanDerWaalsContact OG-N 3.12Å
142	L	97.2	Very high	96.7	Very high	120 Å²	120	59.9 Å²	59.9	63%	0.628	29%	0.294	S	S	*	.	H	α-helix	trans	-66.9	-43.4	175.7	-70.7	172.5	0	0	0	112.7	E138 M139	E138-L142 WeakPolarHBondContact O-CG 3.4Å; E138-L142 PolarHBondContact O-N 3.33Å; M139-L142 HydrophobicContact CE-CD1 3.94Å; M139-L142 PolarHBondContact O-N 2.95Å
143	I	96.3	Very high	96.7	Very high	95 Å²	95	64.5 Å²	64.5	49%	0.487	32%	0.315	S	S	.	.	H	α-helix	trans	-70.1	-48	-177.2	-68	168.1	0	0	0	111.2	F88 M139 L140	F88-I143 HydrophobicContact CE1-CD1 4.36Å; F88-I143 HydrophobicContact CE1-CG2 3.92Å; F88-I143 HydrophobicContact CZ-CD1 4.03Å; F88-I143 HydrophobicContact CZ-CG2 4.2Å; M139-I143 VanDerWaalsContact O-CG1 3.28Å; M139-I143 WeakPolarHBondContact O-CG1 3.5Å; M139-I143 PolarHBondContact O-N 3.4Å; L140-I143 PolarHBondContact O-N 2.99Å
144	L	94.5	Very high	96.6	Very high	24 Å²	24	66.7 Å²	66.7	13%	0.126	33%	0.325	C	S	.	.	H	α-helix	trans	-87.8	-8.6	-173.5	-61.3	175.6	0	0	0	113.3	H85 F88 I89 I114 L140 C146 V148	H85-L144 HydrophobicContact CB-CD2 4.24Å; F88-L144 HydrophobicContact CD1-CD2 4.4Å; I89-L144 HydrophobicContact CD1-CD1 3.88Å; I89-L144 HydrophobicContact CG1-CD1 3.99Å; I114-L144 HydrophobicContact CD1-CD1 4.13Å; L140-L144 WeakPolarHBondContact O-CB 3.32Å; L140-L144 PolarHBondContact O-N 3.49Å; L144-C146 WeakPolarHBondContact CB-SG 3.37Å; L144-C146 PolarHBondContact O-N 3.08Å; L144-V148 HydrophobicContact CD1-CG2 4.48Å
145	R	95.5	Very high	96.5	Very high	225 Å²	225	66 Å²	66	85%	0.849	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	30.2	-175.9	-55.8	-177.8	176.3	176.2	-1	113.6	S141	S141-R145 WeakPolarHBondContact O-CA 3.46Å; S141-R145 PolarHBondContact O-N 3.35Å
146	C	94.8	Very high	96.2	Very high	15 Å²	15	67.8 Å²	67.8	10%	0.101	33%	0.33	C	S	.	.	S	Bend	trans	-133.8	158.8	178.9	64.3	0	0	0	0	109.8	N112 I114 S141 L144 V148	N112-C146 VanDerWaalsContact OD1-CB 3.3Å; N112-C146 WeakPolarHBondContact OD1-CB 3.47Å; I114-C146 WeakPolarHBondContact CD1-SG 3.27Å; S141-C146 VanDerWaalsContact CA-O 3.22Å; S141-C146 WeakPolarHBondContact CA-O 3.28Å; S141-C146 WeakPolarHBondContact CB-O 3.2Å; S141-C146 PolarHBondContact OG-O 3.37Å; L144-C146 WeakPolarHBondContact CB-SG 3.37Å; L144-C146 PolarHBondContact O-N 3.08Å; C146-V148 PolarHBondContact O-N 2.87Å
147	V	97.2	Very high	96	Very high	72 Å²	72	69.4 Å²	69.4	44%	0.436	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	119.4	177.6	178.3	0	0	0	0	109.1	N112 V113 I114 K149	N112-V147 PolarHBondContact O-N 2.95Å; N112-V147 VanDerWaalsContact O-N 3.17Å; V113-V147 CarbonylContact C-O 3.58Å; V113-V147 WeakPolarHBondContact CA-O 3.49Å; V113-V147 HydrophobicContact CG1-CG1 4.47Å; V113-V147 HydrophobicContact CG2-CB 4.36Å; I114-V147 PolarHBondContact N-O 3.29Å; V147-K149 HydrophobicContact CG1-CG 4.39Å
148	V	97.6	Very high	95.7	Very high	5 Å²	5	72.2 Å²	72.2	3%	0.03	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	131.2	176.3	-175.7	0	0	0	0	109.9	I114 V116 L140 S141 L144 C146	I114-V148 HydrophobicContact CB-CG2 4.36Å; I114-V148 WeakPolarHBondContact O-CA 3.36Å; V116-V148 HydrophobicContact CG2-CG1 4.3Å; L140-V148 HydrophobicContact CB-CB 4.13Å; L140-V148 HydrophobicContact CB-CG1 4.12Å; L140-V148 HydrophobicContact CB-CG2 3.85Å; L140-V148 HydrophobicContact CD1-CG1 4.06Å; S141-V148 PolarHBondContact OG-N 3.41Å; S141-V148 VanDerWaalsContact OG-N 3.12Å; L144-V148 HydrophobicContact CD1-CG2 4.48Å; C146-V148 PolarHBondContact O-N 2.87Å
149	K	97.3	Very high	95.4	Very high	109 Å²	109	71.6 Å²	71.6	47%	0.474	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	129.2	175.8	-68.4	-170.5	174.2	-173.8	0	110.1	V113 I114 R115 V116 E137 V147	V113-K149 HydrophobicContact CG1-CD 4.45Å; V113-K149 HydrophobicContact CG1-CG 4.46Å; I114-K149 PolarHBondContact O-N 2.95Å; R115-K149 CarbonylContact C-O 3.56Å; R115-K149 VanDerWaalsContact CA-O 3.31Å; R115-K149 WeakPolarHBondContact CA-O 3.32Å; V116-K149 PolarHBondContact N-O 2.87Å; E137-K149 WeakPolarHBondContact OE1-CA 3.45Å; V147-K149 HydrophobicContact CG1-CG 4.39Å
150	L	97.3	Very high	95.1	Very high	20 Å²	20	73.6 Å²	73.6	11%	0.105	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	124.7	176.2	-66.2	-167	0	0	0	111.4	V116 F118 I133 T136 E137 V152	V116-L150 HydrophobicContact CB-CD2 3.65Å; V116-L150 HydrophobicContact CG1-CD2 4.36Å; V116-L150 HydrophobicContact CG2-CD2 4.29Å; V116-L150 CarbonylContact O-C 3.58Å; V116-L150 WeakPolarHBondContact O-CA 3.44Å; F118-L150 HydrophobicContact CE1-CD1 4.29Å; F118-L150 HydrophobicContact CE1-CD2 4.24Å; F118-L150 HydrophobicContact CZ-CD1 4.47Å; I133-L150 HydrophobicContact CG2-CB 4.32Å; I133-L150 HydrophobicContact CG2-CD1 4.43Å; T136-L150 WeakPolarHBondContact OG1-CD1 3.32Å; E137-L150 HydrophobicContact CG-CB 4.22Å; E137-L150 HydrophobicContact CG-CD1 4.38Å; E137-L150 HydrophobicContact CG-CG 3.81Å; E137-L150 PolarHBondContact OE1-N 2.89Å; L150-V152 HydrophobicContact CB-CG2 4.03Å
151	E	96.5	Very high	94.9	Very high	66 Å²	66	74.8 Å²	74.8	31%	0.308	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	76.5	173	-66.5	178.2	174.7	0	0	108.1	K108 R115 V116 A117 F118	K108-E151 IonicContact NZ-OE2 3.92Å; K108-E151 PolarHBondContact NZ-OE2 2.82Å; R115-E151 WeakPolarHBondContact CD-OE1 3.46Å; R115-E151 IonicContact CZ-OE1 3.87Å; R115-E151 IonicContact NH1-OE1 2.9Å; R115-E151 PolarHBondContact NH1-OE1 3.34Å; V116-E151 PolarHBondContact O-N 2.77Å; A117-E151 VanDerWaalsContact CA-O 3.29Å; A117-E151 WeakPolarHBondContact CA-O 3.28Å; A117-E151 HydrophobicContact CB-CB 3.88Å; F118-E151 PolarHBondContact N-O 3.28Å
152	V	95.3	Very high	94.8	Very high	34 Å²	34	75 Å²	75	21%	0.206	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	127.3	-177.7	-173	0	0	0	0	110.7	F118 L120 I133 L150 M154	F118-V152 HydrophobicContact CE1-CG2 4Å; F118-V152 HydrophobicContact CE2-CG1 4Å; F118-V152 HydrophobicContact CE2-CG2 4.04Å; F118-V152 HydrophobicContact CZ-CG1 4.39Å; F118-V152 HydrophobicContact CZ-CG2 3.58Å; L120-V152 HydrophobicContact CB-CG1 3.52Å; L120-V152 HydrophobicContact CD2-CG1 3.97Å; L120-V152 HydrophobicContact CG-CG1 4.35Å; I133-V152 HydrophobicContact CD1-CB 4.19Å; I133-V152 HydrophobicContact CD1-CG2 3.9Å; I133-V152 HydrophobicContact CG1-CG2 4Å; L150-V152 HydrophobicContact CB-CG2 4.03Å; V152-M154 HydrophobicContact CG1-SD 4.28Å
153	Q	95.2	Very high	94.6	Very high	131 Å²	131	74.4 Å²	74.4	61%	0.612	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.6	125.8	172.2	-178.9	176.8	18.2	0	0	110.4	F118 L119 L120	F118-Q153 PolarHBondContact O-N 3.03Å; F118-Q153 VanDerWaalsContact O-N 3.14Å; L119-Q153 WeakPolarHBondContact CA-O 3.22Å; L119-Q153 HydrophobicContact CD2-CB 3.74Å; L119-Q153 HydrophobicContact CD2-CG 3.95Å; L120-Q153 PolarHBondContact N-O 3.31Å
154	M	94.4	Very high	94.5	Very high	83 Å²	83	76 Å²	76	41%	0.409	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	133.9	-178.4	-59	-57.7	-68.8	0	0	111.2	L120 K122 V129 V152	L120-M154 HydrophobicContact CB-SD 4.04Å; L120-M154 HydrophobicContact CD2-CE 4.14Å; L120-M154 HydrophobicContact CD2-SD 3.83Å; L120-M154 HydrophobicContact CG-CE 4.48Å; L120-M154 HydrophobicContact CG-SD 4.3Å; L120-M154 CarbonylContact O-C 3.56Å; L120-M154 WeakPolarHBondContact O-CA 3.3Å; K122-M154 HydrophobicContact CB-CE 4.01Å; K122-M154 HydrophobicContact CG-CE 4.15Å; V129-M154 HydrophobicContact CG1-SD 4.39Å; V129-M154 HydrophobicContact CG2-CE 4.41Å; V152-M154 HydrophobicContact CG1-SD 4.28Å
155	V	94.4	Very high	94.4	Very high	16 Å²	16	80.1 Å²	80.1	10%	0.097	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	133.6	173.6	-175.6	0	0	0	0	109.2	L119 L120 K122 S157 D160 V161	L119-V155 HydrophobicContact CB-CG2 3.85Å; L119-V155 HydrophobicContact CD1-CG2 4.11Å; L119-V155 HydrophobicContact CD2-CG2 4.14Å; L119-V155 HydrophobicContact CG-CG2 4.25Å; L120-V155 PolarHBondContact O-N 2.95Å; K122-V155 WeakPolarHBondContact CB-O 3.33Å; K122-V155 PolarHBondContact N-O 3.43Å; V155-S157 WeakPolarHBondContact CG1-O 3.41Å; V155-D160 HydrophobicContact CG1-CB 3.75Å; V155-V161 HydrophobicContact CB-CG2 4.43Å; V155-V161 HydrophobicContact CG1-CG2 3.81Å; V155-V161 HydrophobicContact CG2-CG2 4.17Å
156	I	92.6	Very high	94.1	Very high	138 Å²	138	70.1 Å²	70.1	71%	0.708	34%	0.342	S	S	*	.	S	Bend	trans	-74.7	-50.6	-176.6	-60.2	172.2	0	0	0	109.9
157	S	92	Very high	94.1	Very high	34 Å²	34	72.9 Å²	72.9	24%	0.238	35%	0.354	C	S	.	.			trans	-122.3	147.7	-175.5	97.4	0	0	0	0	111.2	V155 N159 D160	V155-S157 WeakPolarHBondContact CG1-O 3.41Å; S157-N159 PolarHBondContact O-N 2.98Å; S157-N159 WeakPolarHBondContact OG-CB 3.22Å; S157-N159 PolarHBondContact OG-N 3.48Å; S157-D160 PolarHBondContact N-OD2 3.44Å; S157-D160 PolarHBondContact O-N 2.95Å; S157-D160 PolarHBondContact OG-N 3.26Å; S157-D160 PolarHBondContact OG-OD1 3.05Å; S157-D160 PolarHBondContact OG-OD2 3.39Å
158	K	91.1	Very high	94	Very high	113 Å²	113	72.9 Å²	72.9	49%	0.491	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-59.6	-27.9	171.9	-178.1	171.3	-178.8	-179.2	0	111.6	D160 V161 I162	K158-D160 PolarHBondContact O-N 3.24Å; K158-V161 PolarHBondContact O-N 3.42Å; K158-I162 WeakPolarHBondContact O-CG1 3.21Å
159	N	92.2	Very high	93.8	Very high	109 Å²	109	76.7 Å²	76.7	58%	0.583	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-66.4	-27.8	-177.9	-59.3	-20.6	0	0	0	112.4	S157 V161 I162	S157-N159 PolarHBondContact O-N 2.98Å; S157-N159 WeakPolarHBondContact OG-CB 3.22Å; S157-N159 PolarHBondContact OG-N 3.48Å; N159-V161 PolarHBondContact O-N 3.31Å; N159-I162 HydrophobicContact CB-CD1 4.39Å; N159-I162 PolarHBondContact O-N 3.12Å
160	D	91.2	Very high	93.5	Very high	105 Å²	105	74.8 Å²	74.8	56%	0.561	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-67.2	-20.5	-178.8	-51.2	-19.6	0	0	0	112.2	V155 S157 K158	V155-D160 HydrophobicContact CG1-CB 3.75Å; S157-D160 PolarHBondContact N-OD2 3.44Å; S157-D160 PolarHBondContact O-N 2.95Å; S157-D160 PolarHBondContact OG-N 3.26Å; S157-D160 PolarHBondContact OG-OD1 3.05Å; S157-D160 PolarHBondContact OG-OD2 3.39Å; K158-D160 PolarHBondContact O-N 3.24Å
161	V	92.9	Very high	93.3	Very high	25 Å²	25	78.3 Å²	78.3	15%	0.152	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-94.4	-13.7	-179.8	-165.7	0	0	0	0	112.1	T48 Q102 L119 V155 K158 N159 F163	T48-V161 HydrophobicContact CG2-CG1 3.85Å; Q102-V161 HydrophobicContact CB-CG1 4.46Å; Q102-V161 HydrophobicContact CB-CG2 3.98Å; L119-V161 HydrophobicContact CD1-CG1 4.04Å; L119-V161 HydrophobicContact CD1-CG2 4.15Å; V155-V161 HydrophobicContact CB-CG2 4.43Å; V155-V161 HydrophobicContact CG1-CG2 3.81Å; V155-V161 HydrophobicContact CG2-CG2 4.17Å; K158-V161 PolarHBondContact O-N 3.42Å; N159-V161 PolarHBondContact O-N 3.31Å; V161-F163 PolarHBondContact O-N 3Å
162	I	94.6	Very high	93.1	Very high	35 Å²	35	79.1 Å²	79.1	18%	0.179	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	123.4	-174.7	-56.1	174.1	0	0	0	109	P46 K158 N159 Y165	P46-I162 HydrophobicContact CB-CB 4.43Å; P46-I162 HydrophobicContact CB-CD1 3.58Å; P46-I162 HydrophobicContact CB-CG1 3.84Å; P46-I162 HydrophobicContact CB-CG2 3.72Å; P46-I162 HydrophobicContact CG-CD1 4.36Å; K158-I162 WeakPolarHBondContact O-CG1 3.21Å; N159-I162 HydrophobicContact CB-CD1 4.39Å; N159-I162 PolarHBondContact O-N 3.12Å; I162-Y165 WeakPolarHBondContact CD1-OH 3.41Å; I162-Y165 HydrophobicContact CG2-CD2 4.3Å; I162-Y165 HydrophobicContact CG2-CE1 4.46Å; I162-Y165 HydrophobicContact CG2-CE2 3.83Å
163	F	93.7	Very high	92.9	Very high	108 Å²	108	82.3 Å²	82.3	47%	0.474	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-42.9	176.4	176.2	-106.7	0	0	0	112.1	L47 Y49 A52 V161	L47-F163 PolarHBondContact O-N 2.68Å; Y49-F163 HydrophobicContact CD2-CD1 4.35Å; Y49-F163 AromaticContact CD2-CD2 3.8Å; Y49-F163 HydrophobicContact CD2-CD2 3.8Å; Y49-F163 HydrophobicContact CD2-CE1 4.44Å; Y49-F163 AromaticContact CD2-CE2 3.9Å; Y49-F163 HydrophobicContact CD2-CE2 3.9Å; Y49-F163 HydrophobicContact CD2-CG 4.03Å; Y49-F163 HydrophobicContact CD2-CZ 4.23Å; Y49-F163 HydrophobicContact CE2-CE2 4.27Å; Y49-F163 HydrophobicContact CE2-CZ 4.38Å; A52-F163 HydrophobicContact CB-CD1 3.76Å; A52-F163 HydrophobicContact CB-CE1 4.32Å; V161-F163 PolarHBondContact O-N 3Å
164	R	93.2	Very high	92.8	Very high	129 Å²	129	78.5 Å²	78.5	49%	0.487	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	148.7	-175.9	176.2	175.2	174	167.1	7.8	111.3	L47 V166	L47-R164 WeakPolarHBondContact CB-O 3.32Å; L47-R164 PolarHBondContact N-O 3.17Å; L47-R164 PolarHBondContact O-N 3.03Å; R164-V166 HydrophobicContact CG-CG2 4.2Å
165	Y	93.8	Very high	92.6	Very high	110 Å²	110	78.2 Å²	78.2	43%	0.431	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	140.3	169.1	-68.3	-90.5	0	0	0	112.1	Q43 H45 P46 I162	Q43-Y165 WeakPolarHBondContact O-CB 3.41Å; H45-Y165 WeakPolarHBondContact O-CA 3.34Å; P46-Y165 HydrophobicContact CB-CD1 4.1Å; P46-Y165 HydrophobicContact CB-CE1 3.75Å; I162-Y165 WeakPolarHBondContact CD1-OH 3.41Å; I162-Y165 HydrophobicContact CG2-CD2 4.3Å; I162-Y165 HydrophobicContact CG2-CE1 4.46Å; I162-Y165 HydrophobicContact CG2-CE2 3.83Å
166	V	89.7	Confident	92.5	Very high	16 Å²	16	83.8 Å²	83.8	10%	0.097	40%	0.4	C	S	.	.			trans	-136.8	0	-171.5	169.6	0	0	0	0	113.1	R39 T40 H45 L47 R164	R39-V166 WeakPolarHBondContact CA-OXT 3.48Å; R39-V166 HydrophobicContact CB-CG1 4.1Å; R39-V166 HydrophobicContact CG-CG1 3.85Å; T40-V166 VanDerWaalsContact CB-O 3.25Å; T40-V166 WeakPolarHBondContact CB-O 3.32Å; T40-V166 PolarHBondContact N-OXT 3.23Å; T40-V166 PolarHBondContact OG1-O 3.2Å; H45-V166 WeakPolarHBondContact CB-O 3.42Å; H45-V166 PolarHBondContact N-O 3.17Å; H45-V166 PolarHBondContact O-N 2.85Å; L47-V166 HydrophobicContact CD1-CB 3.79Å; L47-V166 HydrophobicContact CD1-CG1 4.29Å; L47-V166 HydrophobicContact CD1-CG2 3.41Å; L47-V166 VanDerWaalsContact CD1-CG2 3.41Å; L47-V166 HydrophobicContact CG-CB 4.14Å; L47-V166 HydrophobicContact CG-CG2 4.06Å; R164-V166 HydrophobicContact CG-CG2 4.2Å

Retrieved 166 of 166 residues in 51.5 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).