A0A3B3TTX9_9TELE Loading...

Glyoxalase domain-containing protein 5

AlphaFold DB , UniProt , Accession A0A3B3TTX9, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 170 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	40.8	Very low	38.5	Very low	256 Å²	256	159 Å²	159	100%	1.261	87%	0.869	S	S	*	*				0	114.1	0	-117.3	172.1	167.2	0	0	107.5
2	A	39.4	Very low	38.3	Very low	91 Å²	91	164.7 Å²	164.7	75%	0.752	87%	0.871	S	S	*	*			trans	-104.5	137.1	-168.5	0	0	0	0	0	111.4
3	L	37.3	Very low	38.3	Very low	172 Å²	172	167.2 Å²	167.2	90%	0.901	87%	0.871	S	S	*	*			trans	-150.6	93.1	163.8	-75.4	172	0	0	0	106.7
4	R	37.9	Very low	38.5	Very low	242 Å²	242	167.8 Å²	167.8	91%	0.913	87%	0.867	S	S	*	*				51	113.8	87.2	-76.1	-167	176.9	-132	0.6	114.8
5	A	41	Very low	38.7	Very low	107 Å²	107	172.7 Å²	172.7	88%	0.884	87%	0.87	S	S	*	*			trans	-69.5	154.3	170.5	0	0	0	0	0	112.9
6	A	40.5	Very low	38.8	Very low	109 Å²	109	169.3 Å²	169.3	90%	0.901	86%	0.861	S	S	*	*			trans	-150.9	126.8	153.5	0	0	0	0	0	110.3
7	S	38	Very low	38.6	Very low	116 Å²	116	166.4 Å²	166.4	81%	0.811	86%	0.858	S	S	*	*			trans	-96	142.3	177.8	-175.9	0	0	0	0	109.4
8	N	38.1	Very low	38.4	Very low	158 Å²	158	167.1 Å²	167.1	85%	0.845	85%	0.854	S	S	*	*			trans	-145.1	98.8	166	-109.4	-6.5	0	0	0	105.8
9	R	43.9	Very low	38.2	Very low	216 Å²	216	168 Å²	168	82%	0.815	85%	0.851	S	S	*	*				66.5	137.1	72.8	-133.7	-172.2	-149.6	-114.7	3.2	113.4
10	L	34.6	Very low	38.3	Very low	133 Å²	133	166.4 Å²	166.4	70%	0.696	85%	0.85	S	S	*	*			trans	89.4	126.5	168.8	-80	92.7	0	0	0	116.1
11	L	32	Very low	38	Very low	149 Å²	149	164.9 Å²	164.9	78%	0.78	84%	0.843	S	S	*	*			cis	-153.1	138.3	14	-86.2	139.1	0	0	0	110.9
12	Y	36	Very low	38	Very low	227 Å²	227	157.2 Å²	157.2	89%	0.89	82%	0.821	S	S	*	*			trans	-99.7	120.5	165	-124.6	-98.3	0	0	0	107.6	Q14	Y12-Q14 PolarHBondContact O-N 2.91Å
13	F	39.1	Very low	37.9	Very low	198 Å²	198	160.7 Å²	160.7	87%	0.868	83%	0.826	S	S	*	*			trans	-87.5	99.5	176.1	-136.7	-94	0	0	0	108.3	R15	F13-R15 PolarHBondContact O-N 3.23Å
14	Q	39.9	Very low	38.2	Very low	175 Å²	175	160.3 Å²	160.3	82%	0.818	82%	0.819	S	S	*	*			trans	-77.5	115.2	170.8	-88.4	179.9	-34.3	0	0	109.5	Y12 T16	Y12-Q14 PolarHBondContact O-N 2.91Å; Q14-T16 PolarHBondContact O-N 3.47Å
15	R	42	Very low	38.4	Very low	241 Å²	241	152.5 Å²	152.5	91%	0.909	81%	0.807	S	S	*	*			trans	-70.2	109.9	164	-79.6	179.4	165	-174.5	-4.7	108.5	F13 C17	F13-R15 PolarHBondContact O-N 3.23Å; R15-C17 PolarHBondContact O-N 3.28Å
16	T	39.8	Very low	38.9	Very low	119 Å²	119	155.8 Å²	155.8	73%	0.73	80%	0.804	S	S	*	*			trans	-69.7	110.4	168.4	24	0	0	0	0	109.6	Q14 F18	Q14-T16 PolarHBondContact O-N 3.47Å; T16-F18 PolarHBondContact O-N 3.01Å
17	C	36.6	Very low	39.4	Very low	120 Å²	120	156.2 Å²	156.2	81%	0.811	79%	0.79	S	S	*	*			trans	-76.3	105.4	166.1	-174.7	0	0	0	0	107.9	R15 K19	R15-C17 PolarHBondContact O-N 3.28Å; C17-K19 PolarHBondContact O-N 3.13Å
18	F	34.2	Very low	40.3	Very low	179 Å²	179	153 Å²	153	79%	0.785	78%	0.776	S	S	*	*			trans	-73.2	106.1	170.6	-87.8	-90.4	0	0	0	108.7	T16 V20	T16-F18 PolarHBondContact O-N 3.01Å; F18-V20 PolarHBondContact O-N 3.15Å
19	K	34	Very low	41.6	Very low	184 Å²	184	152 Å²	152	80%	0.8	78%	0.775	S	S	*	*			trans	-69.9	110.2	162.4	-79.5	-174.2	174.8	-175.7	0	108	C17 N21	C17-K19 PolarHBondContact O-N 3.13Å; K19-N21 PolarHBondContact O-N 3.45Å
20	V	40.9	Very low	42.5	Very low	136 Å²	136	153 Å²	153	82%	0.824	78%	0.778	S	S	*	*			trans	-74.9	102.9	165.2	-174.9	0	0	0	0	106.2	F18 A22	F18-V20 PolarHBondContact O-N 3.15Å; V20-A22 PolarHBondContact O-N 2.91Å
21	N	33	Very low	43.9	Very low	134 Å²	134	151.8 Å²	151.8	72%	0.717	78%	0.782	S	S	*	*			trans	-71.1	114.1	168.9	-80	-19.1	0	0	0	107.6	K19 L23	K19-N21 PolarHBondContact O-N 3.45Å; N21-L23 PolarHBondContact O-N 3.15Å; N21-L23 VanDerWaalsContact O-N 3.08Å
22	A	39.8	Very low	45.7	Very low	95 Å²	95	153 Å²	153	79%	0.785	78%	0.781	S	S	*	*			trans	-64.2	106.3	165.3	0	0	0	0	0	107.8	V20 E24	V20-A22 PolarHBondContact O-N 2.91Å; A22-E24 PolarHBondContact O-N 3.32Å
23	L	38.4	Very low	47.3	Very low	164 Å²	164	147.4 Å²	147.4	86%	0.859	78%	0.781	S	S	*	*			trans	-73.7	98.7	167.3	-97.6	141.5	0	0	0	107.2	N21 A25	N21-L23 PolarHBondContact O-N 3.15Å; N21-L23 VanDerWaalsContact O-N 3.08Å; L23-A25 VanDerWaalsContact C-N 3.33Å; L23-A25 PolarHBondContact O-N 3.14Å
24	E	42.7	Very low	49.5	Very low	164 Å²	164	144.4 Å²	144.4	77%	0.766	78%	0.779	S	S	*	*			trans	-63.1	99.6	160	-79.1	-174.9	147.2	0	0	108	A22 H26	A22-E24 PolarHBondContact O-N 3.32Å; E24-H26 PolarHBondContact O-N 3.36Å
25	A	42.8	Very low	51.7	Low	78 Å²	78	139.4 Å²	139.4	65%	0.645	76%	0.763	S	S	*	*			trans	-69.5	97.7	167.6	0	0	0	0	0	107.7	L23 L27	L23-A25 VanDerWaalsContact C-N 3.33Å; L23-A25 PolarHBondContact O-N 3.14Å; A25-L27 HydrophobicContact CB-CG 4.5Å; A25-L27 PolarHBondContact O-N 2.92Å
26	H	50.7	Low	54	Low	177 Å²	177	134.4 Å²	134.4	82%	0.819	76%	0.761	S	S	*	*			trans	-61.1	91.2	163.5	-80.3	-64	0	0	0	108.8	E24 G28	E24-H26 PolarHBondContact O-N 3.36Å; H26-G28 PolarHBondContact O-N 3.48Å
27	L	50.3	Low	56.6	Low	117 Å²	117	133.8 Å²	133.8	61%	0.613	76%	0.757	S	S	*	*			trans	-75.8	66.2	173.2	-70.8	165.4	0	0	0	109.1	A25	A25-L27 HydrophobicContact CB-CG 4.5Å; A25-L27 PolarHBondContact O-N 2.92Å
28	G	57.5	Low	59.2	Low	50 Å²	50	136.6 Å²	136.6	52%	0.515	76%	0.758	S	S	.	*			trans	-91.6	137.7	163.8	0	0	0	0	0	109.7	H26 R30	H26-G28 PolarHBondContact O-N 3.48Å; G28-R30 PolarHBondContact O-N 3.49Å; G28-R30 VanDerWaalsContact O-N 3.11Å
29	V	65.4	Low	62	Low	137 Å²	137	133.9 Å²	133.9	83%	0.83	76%	0.756	S	S	*	*			trans	-62.8	113.6	172	-179.1	0	0	0	0	108.4
30	R	62.3	Low	64.9	Low	235 Å²	235	130.3 Å²	130.3	89%	0.887	75%	0.754	S	S	*	*			trans	-75.3	126	179.8	-68.9	-175.4	175.7	-150.7	-1.2	110.5	G28	G28-R30 PolarHBondContact O-N 3.49Å; G28-R30 VanDerWaalsContact O-N 3.11Å
31	S	64.7	Low	67.6	Low	109 Å²	109	129.4 Å²	129.4	76%	0.762	74%	0.741	S	S	*	*			trans	-68.6	136.2	169.4	60.1	0	0	0	0	110.3	A33	S31-A33 PolarHBondContact O-N 2.89Å
32	K	69.8	Low	70.7	Confident	175 Å²	175	128 Å²	128	76%	0.761	73%	0.733	S	S	*	*			trans	-80.8	108.7	172.2	-77.7	-173.7	178.4	179.1	0	108.5	T34 C35	K32-T34 PolarHBondContact O-N 3.11Å; K32-C35 PolarHBondContact O-N 3.38Å; K32-C35 VanDerWaalsContact O-N 3.15Å
33	A	68.6	Low	73.4	Confident	109 Å²	109	127.6 Å²	127.6	90%	0.901	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-8.9	-177.1	0	0	0	0	0	115.9	S31	S31-A33 PolarHBondContact O-N 2.89Å
34	T	85.7	Confident	76.3	Confident	134 Å²	134	123.6 Å²	123.6	82%	0.822	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	-10.1	-178.6	56.8	0	0	0	0	114.3	K32	K32-T34 PolarHBondContact O-N 3.11Å
35	C	87.1	Confident	79	Confident	71 Å²	71	117.5 Å²	117.5	48%	0.48	67%	0.667	S	S	.	*			trans	-92	125.5	176.7	-176.3	0	0	0	0	109.3	K32 V37	K32-C35 PolarHBondContact O-N 3.38Å; K32-C35 VanDerWaalsContact O-N 3.15Å; C35-V37 PolarHBondContact O-N 2.79Å; C35-V37 PolarHBondContact SG-N 3.15Å; C35-V37 VanDerWaalsContact SG-N 3.42Å; C35-V37 PolarHBondContact SG-O 3.27Å; C35-V37 VanDerWaalsContact SG-O 3.38Å
36	P	89.6	Confident	81.6	Confident	135 Å²	135	117 Å²	117	88%	0.877	66%	0.656	S	S	*	*	S	Bend	trans	-74.2	-9.7	176.1	32	-35.8	0	0	0	112.7
37	V	93.9	Very high	83.9	Confident	106 Å²	106	109 Å²	109	64%	0.642	62%	0.619	S	S	*	*			trans	-95.7	123.8	179.5	-176.8	0	0	0	0	109.7	C35	C35-V37 PolarHBondContact O-N 2.79Å; C35-V37 PolarHBondContact SG-N 3.15Å; C35-V37 VanDerWaalsContact SG-N 3.42Å; C35-V37 PolarHBondContact SG-O 3.27Å; C35-V37 VanDerWaalsContact SG-O 3.38Å
38	E	91.5	Very high	86.2	Confident	179 Å²	179	104 Å²	104	84%	0.836	59%	0.593	S	S	*	*			trans	-112.9	120	172.1	-174.1	176.3	-178.5	0	0	109.4
39	V	94.1	Very high	88.2	Confident	122 Å²	122	101.6 Å²	101.6	74%	0.739	57%	0.569	S	S	*	*			trans	-90.2	126.8	175	176.4	0	0	0	0	108.5
40	S	95.3	Very high	89.8	Confident	109 Å²	109	100.9 Å²	100.9	76%	0.762	55%	0.554	S	S	*	*			trans	-78.8	-58	-179.8	174.4	0	0	0	0	112.7
41	H	96	Very high	91.5	Very high	118 Å²	118	91.1 Å²	91.1	55%	0.546	52%	0.522	S	S	.	.			trans	-162.6	168.6	-176.2	59.6	-77.1	0	0	0	111.1
42	L	97.9	Very high	93.2	Very high	104 Å²	104	86.9 Å²	86.9	55%	0.545	49%	0.492	S	S	.	.			trans	-77.9	117.7	167.6	-175.2	72.9	0	0	0	109.3	H44 L45 Q82	L42-H44 WeakPolarHBondContact CD1-O 3.49Å; L42-L45 HydrophobicContact CD2-CD2 4.27Å; L42-Q82 WeakPolarHBondContact O-CG 3.19Å; L42-Q82 PolarHBondContact O-NE2 2.9Å
43	D	98.4	Very high	94.5	Very high	87 Å²	87	82 Å²	82	47%	0.465	48%	0.477	S	S	.	.			trans	-79.1	-51.2	175	177.1	84.4	0	0	0	111.3	Q82 K83	D43-Q82 VanDerWaalsContact O-CA 3.3Å; D43-Q82 WeakPolarHBondContact O-CA 3.41Å; D43-Q82 WeakPolarHBondContact O-CB 3.18Å; D43-K83 PolarHBondContact O-N 3.05Å
44	H	98.5	Very high	96	Very high	79 Å²	79	80.9 Å²	80.9	37%	0.366	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	166.1	176.6	66.5	-87.3	0	0	0	111.3	L42 K83 N85	L42-H44 WeakPolarHBondContact CD1-O 3.49Å; H44-K83 WeakPolarHBondContact CA-O 3.48Å; H44-K83 HydrophobicContact CB-CG 3.65Å; H44-K83 WeakPolarHBondContact CB-O 3.47Å; H44-N85 PolarHBondContact CD2-ND2 2.76Å; H44-N85 VanDerWaalsContact CD2-ND2 3.25Å; H44-N85 PolarHBondContact NE2-ND2 3.2Å
45	L	98.6	Very high	96.6	Very high	37 Å²	37	74.5 Å²	74.5	19%	0.194	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	169.6	164.7	61	76.6	0	0	0	110.1	L42 L47 K83 F84 N85 L107	L42-L45 HydrophobicContact CD2-CD2 4.27Å; L45-L47 HydrophobicContact CD1-CD2 3.63Å; L45-L47 HydrophobicContact CD1-CG 3.68Å; L45-K83 PolarHBondContact N-O 2.99Å; L45-F84 HydrophobicContact CD1-CB 4.38Å; L45-F84 HydrophobicContact CD1-CD1 3.49Å; L45-F84 VanDerWaalsContact CD1-CD1 3.49Å; L45-F84 HydrophobicContact CD1-CE1 4Å; L45-F84 HydrophobicContact CD1-CG 4.11Å; L45-F84 HydrophobicContact CD2-CD1 4.24Å; L45-F84 HydrophobicContact CD2-CE1 3.99Å; L45-F84 HydrophobicContact CG-CD1 3.66Å; L45-F84 HydrophobicContact CG-CE1 3.92Å; L45-N85 PolarHBondContact O-N 3.37Å; L45-L107 HydrophobicContact CD2-CD1 4.29Å; L45-L107 HydrophobicContact CD2-CD2 3.58Å
46	V	98.7	Very high	97.1	Very high	68 Å²	68	72.2 Å²	72.2	41%	0.412	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.7	175.1	179.2	0	0	0	0	108.7	N85 H87	V46-N85 CarbonylContact C-O 3.51Å; V46-N85 WeakPolarHBondContact CA-O 3Å; V46-N85 HydrophobicContact CG2-CB 4.09Å; V46-H87 HydrophobicContact CG1-CB 4.07Å
47	L	98.9	Very high	97.6	Very high	7 Å²	7	70.3 Å²	70.3	4%	0.037	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.6	167	-63.5	179.1	0	0	0	108.9	L45 V49 F84 N85 L86 H87 A105 L107	L45-L47 HydrophobicContact CD1-CD2 3.63Å; L45-L47 HydrophobicContact CD1-CG 3.68Å; L47-V49 HydrophobicContact CB-CG1 3.93Å; L47-F84 HydrophobicContact CD1-CB 4.17Å; L47-F84 HydrophobicContact CD1-CD2 3.91Å; L47-F84 HydrophobicContact CD1-CG 4.11Å; L47-F84 HydrophobicContact CG-CB 4.39Å; L47-N85 PolarHBondContact N-O 2.95Å; L47-L86 HydrophobicContact CB-CD2 4.05Å; L47-L86 HydrophobicContact CD1-CD2 4.44Å; L47-H87 PolarHBondContact O-N 2.78Å; L47-A105 HydrophobicContact CD2-CB 3.72Å; L47-L107 HydrophobicContact CD2-CD1 4.34Å
48	T	98.8	Very high	97.8	Very high	13 Å²	13	66.7 Å²	66.7	8%	0.08	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	120.5	166.2	-55.6	0	0	0	0	107.6	H87 L89 E92 P100 S102	T48-H87 CarbonylContact C-O 3.46Å; T48-H87 VanDerWaalsContact CA-O 3.29Å; T48-H87 WeakPolarHBondContact CA-O 3.48Å; T48-L89 HydrophobicContact CG2-CB 4.16Å; T48-L89 HydrophobicContact CG2-CD1 3.72Å; T48-E92 HydrophobicContact CG2-CG 4.19Å; T48-P100 HydrophobicContact CG2-CB 3.9Å; T48-P100 WeakPolarHBondContact OG1-CB 3.48Å; T48-S102 VanDerWaalsContact O-CA 3.23Å; T48-S102 WeakPolarHBondContact O-CA 3.26Å; T48-S102 WeakPolarHBondContact O-CB 3.43Å
49	V	98.9	Very high	98.2	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	148.4	-169.9	-63	0	0	0	0	111	L47 S51 V52 T55 L86 H87 Q88 L89 D152	L47-V49 HydrophobicContact CB-CG1 3.93Å; V49-S51 VanDerWaalsContact C-N 3.31Å; V49-S51 PolarHBondContact O-N 3.42Å; V49-V52 HydrophobicContact CG2-CG2 3.82Å; V49-T55 WeakPolarHBondContact CB-OG1 3.49Å; V49-T55 HydrophobicContact CG1-CG2 4.01Å; V49-T55 WeakPolarHBondContact CG1-OG1 3.46Å; V49-L86 HydrophobicContact CG1-CD2 4.5Å; V49-H87 PolarHBondContact N-O 2.9Å; V49-Q88 CarbonylContact O-C 3.57Å; V49-Q88 WeakPolarHBondContact O-CA 3.45Å; V49-L89 PolarHBondContact O-N 2.75Å; V49-D152 WeakPolarHBondContact CB-OD2 3.3Å
50	K	98.8	Very high	98.4	Very high	122 Å²	122	54.2 Å²	54.2	53%	0.53	30%	0.295	S	S	.	.	S	Bend	trans	-64.5	-38.4	178	-72.3	165.1	-172.9	168.6	0	111.3	S102 D152	K50-S102 WeakPolarHBondContact CE-OG 3.32Å; K50-D152 WeakPolarHBondContact CB-OD1 3.44Å; K50-D152 VanDerWaalsContact CG-OD1 3.28Å; K50-D152 WeakPolarHBondContact CG-OD1 3.23Å; K50-D152 PolarHBondContact N-OD1 2.91Å
51	S	98.8	Very high	98.6	Very high	29 Å²	29	52.5 Å²	52.5	20%	0.203	28%	0.283	C	S	.	.			trans	-143.5	108.7	-175.8	177.9	0	0	0	0	111.2	V49 D54 T55	V49-S51 VanDerWaalsContact C-N 3.31Å; V49-S51 PolarHBondContact O-N 3.42Å; S51-D54 WeakPolarHBondContact CB-OD2 3.46Å; S51-D54 PolarHBondContact O-N 3.21Å; S51-D54 PolarHBondContact OG-N 2.86Å; S51-D54 PolarHBondContact OG-OD2 2.84Å; S51-T55 PolarHBondContact O-N 3.44Å; S51-T55 PolarHBondContact O-OG1 3.31Å
52	V	98.7	Very high	98.7	Very high	21 Å²	21	47.4 Å²	47.4	13%	0.127	26%	0.26	C	S	.	.	H	α-helix	trans	-58	-42.9	177.2	167.7	0	0	0	0	112.4	V49 D54 I56 K75 L86 Q88	V49-V52 HydrophobicContact CG2-CG2 3.82Å; V52-D54 PolarHBondContact O-N 3.06Å; V52-I56 HydrophobicContact CG1-CD1 3.65Å; V52-I56 HydrophobicContact CG1-CG1 4.32Å; V52-I56 WeakPolarHBondContact O-CB 3.32Å; V52-I56 VanDerWaalsContact O-CG1 3.26Å; V52-I56 WeakPolarHBondContact O-CG1 3.31Å; V52-I56 PolarHBondContact O-N 3.06Å; V52-K75 HydrophobicContact CG1-CB 3.95Å; V52-K75 HydrophobicContact CG1-CG 3.95Å; V52-L86 HydrophobicContact CG1-CB 4.48Å; V52-L86 HydrophobicContact CG1-CD1 4.17Å; V52-L86 HydrophobicContact CG2-CB 4.1Å; V52-Q88 HydrophobicContact CG2-CB 3.84Å
53	P	98.6	Very high	98.7	Very high	71 Å²	71	44.7 Å²	44.7	46%	0.461	25%	0.245	S	C	.	.	H	α-helix	trans	-59.4	-43.1	175.6	-26	35.9	0	0	0	113.8	I56 N57	P53-I56 PolarHBondContact O-N 3.43Å; P53-N57 WeakPolarHBondContact O-CB 3.4Å; P53-N57 PolarHBondContact O-N 3.19Å; P53-N57 PolarHBondContact O-ND2 2.81Å
54	D	98.8	Very high	98.7	Very high	87 Å²	87	43.4 Å²	43.4	47%	0.465	25%	0.253	S	S	.	.	H	α-helix	trans	-69.8	-42.1	-178	-59.4	-33.4	0	0	0	111.2	S51 V52 I56 N57 F58	S51-D54 WeakPolarHBondContact CB-OD2 3.46Å; S51-D54 PolarHBondContact O-N 3.21Å; S51-D54 PolarHBondContact OG-N 2.86Å; S51-D54 PolarHBondContact OG-OD2 2.84Å; V52-D54 PolarHBondContact O-N 3.06Å; D54-I56 VanDerWaalsContact C-N 3.33Å; D54-I56 PolarHBondContact O-N 3.07Å; D54-N57 PolarHBondContact O-N 3.07Å; D54-F58 WeakPolarHBondContact O-CB 3.26Å; D54-F58 PolarHBondContact O-N 3.44Å
55	T	98.9	Very high	98.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58.4	-46.1	171.6	-52	0	0	0	0	110.7	V49 S51 N57 F58 Y59 L77 L86	V49-T55 WeakPolarHBondContact CB-OG1 3.49Å; V49-T55 HydrophobicContact CG1-CG2 4.01Å; V49-T55 WeakPolarHBondContact CG1-OG1 3.46Å; S51-T55 PolarHBondContact O-N 3.44Å; S51-T55 PolarHBondContact O-OG1 3.31Å; T55-N57 PolarHBondContact O-N 2.79Å; T55-F58 PolarHBondContact O-N 3.35Å; T55-Y59 HydrophobicContact CG2-CD2 3.59Å; T55-Y59 HydrophobicContact CG2-CE2 3.7Å; T55-Y59 VanDerWaalsContact O-CD2 3.3Å; T55-Y59 WeakPolarHBondContact O-CD2 3.39Å; T55-Y59 PolarHBondContact O-N 3.49Å; T55-L77 HydrophobicContact CG2-CD1 4.11Å; T55-L86 HydrophobicContact CG2-CD1 4.03Å; T55-L86 HydrophobicContact CG2-CD2 3.89Å
56	I	98.8	Very high	98.7	Very high	23 Å²	23	45.4 Å²	45.4	12%	0.118	26%	0.262	C	S	.	.	H	α-helix	trans	-59.1	-51.1	177.9	-77.4	169.8	0	0	0	110.9	V52 P53 D54 F58 Y59 T60 V67 K75 L77 L86	V52-I56 HydrophobicContact CG1-CD1 3.65Å; V52-I56 HydrophobicContact CG1-CG1 4.32Å; V52-I56 WeakPolarHBondContact O-CB 3.32Å; V52-I56 VanDerWaalsContact O-CG1 3.26Å; V52-I56 WeakPolarHBondContact O-CG1 3.31Å; V52-I56 PolarHBondContact O-N 3.06Å; P53-I56 PolarHBondContact O-N 3.43Å; D54-I56 VanDerWaalsContact C-N 3.33Å; D54-I56 PolarHBondContact O-N 3.07Å; I56-F58 VanDerWaalsContact C-N 3.28Å; I56-F58 PolarHBondContact O-N 3.26Å; I56-Y59 PolarHBondContact O-N 3.41Å; I56-T60 HydrophobicContact CG2-CG2 4.1Å; I56-T60 VanDerWaalsContact O-CB 3.31Å; I56-T60 WeakPolarHBondContact O-CB 3.2Å; I56-T60 WeakPolarHBondContact O-CG2 3.45Å; I56-T60 PolarHBondContact O-N 2.88Å; I56-T60 PolarHBondContact O-OG1 3.09Å; I56-V67 HydrophobicContact CD1-CG1 4.11Å; I56-V67 HydrophobicContact CG2-CG2 3.47Å; I56-V67 VanDerWaalsContact CG2-CG2 3.47Å; I56-K75 HydrophobicContact CD1-CB 4.03Å; I56-K75 HydrophobicContact CD1-CD 4.3Å; I56-K75 HydrophobicContact CD1-CG 4.04Å; I56-L77 HydrophobicContact CG1-CD2 4.4Å; I56-L86 HydrophobicContact CD1-CD1 4.37Å; I56-L86 HydrophobicContact CG1-CD1 3.76Å
57	N	98.8	Very high	98.7	Very high	94 Å²	94	45.3 Å²	45.3	50%	0.503	26%	0.261	S	S	.	.	H	α-helix	trans	-59.1	-41.8	-178.9	-70.3	-18.6	0	0	0	111.4	P53 D54 T55 T60 S61	P53-N57 WeakPolarHBondContact O-CB 3.4Å; P53-N57 PolarHBondContact O-N 3.19Å; P53-N57 PolarHBondContact O-ND2 2.81Å; D54-N57 PolarHBondContact O-N 3.07Å; T55-N57 PolarHBondContact O-N 2.79Å; N57-T60 PolarHBondContact O-OG1 2.92Å; N57-T60 VanDerWaalsContact O-OG1 3.13Å; N57-S61 VanDerWaalsContact O-CB 3.23Å; N57-S61 WeakPolarHBondContact O-CB 3.33Å; N57-S61 PolarHBondContact O-N 2.79Å; N57-S61 VanDerWaalsContact O-N 3.13Å; N57-S61 PolarHBondContact O-OG 2.93Å
58	F	98.9	Very high	98.7	Very high	30 Å²	30	47.6 Å²	47.6	13%	0.132	28%	0.275	C	S	.	.	H	α-helix	trans	-62.2	-60.3	176.8	-178.8	-90.3	0	0	0	111.8	D54 T55 I56 T60 S61 V62 V127 F148 R149 D150 P151	D54-F58 WeakPolarHBondContact O-CB 3.26Å; D54-F58 PolarHBondContact O-N 3.44Å; T55-F58 PolarHBondContact O-N 3.35Å; I56-F58 VanDerWaalsContact C-N 3.28Å; I56-F58 PolarHBondContact O-N 3.26Å; F58-T60 VanDerWaalsContact C-N 3.31Å; F58-T60 PolarHBondContact O-N 3.35Å; F58-S61 PolarHBondContact O-N 2.9Å; F58-V62 HydrophobicContact CD1-CB 4.44Å; F58-V62 HydrophobicContact CD1-CG2 4.41Å; F58-V62 HydrophobicContact CD2-CG2 3.82Å; F58-V62 HydrophobicContact CE1-CB 4.25Å; F58-V62 HydrophobicContact CE1-CG1 4.25Å; F58-V62 HydrophobicContact CE1-CG2 4.37Å; F58-V62 HydrophobicContact CE2-CB 4.49Å; F58-V62 HydrophobicContact CE2-CG2 3.79Å; F58-V62 HydrophobicContact CG-CG2 4.14Å; F58-V62 HydrophobicContact CZ-CB 4.26Å; F58-V62 HydrophobicContact CZ-CG1 4.02Å; F58-V62 HydrophobicContact CZ-CG2 4.06Å; F58-V62 WeakPolarHBondContact O-CB 3.45Å; F58-V62 VanDerWaalsContact O-CG2 3.25Å; F58-V62 WeakPolarHBondContact O-CG2 3.47Å; F58-V62 PolarHBondContact O-N 3.29Å; F58-V127 HydrophobicContact CE2-CG2 3.9Å; F58-V127 HydrophobicContact CZ-CG2 4.41Å; F58-F148 HydrophobicContact CE1-CE2 4.23Å; F58-F148 HydrophobicContact CZ-CD2 4.09Å; F58-F148 AromaticContact CZ-CE2 3.98Å; F58-F148 HydrophobicContact CZ-CE2 3.98Å; F58-R149 WeakPolarHBondContact CZ-O 3.14Å; F58-D150 HydrophobicContact CD1-CB 4.04Å; F58-D150 HydrophobicContact CE1-CB 3.7Å; F58-D150 HydrophobicContact CZ-CB 4.16Å; F58-P151 HydrophobicContact CB-CG 3.57Å; F58-P151 HydrophobicContact CD1-CG 4.49Å; F58-P151 HydrophobicContact CD2-CG 3.9Å; F58-P151 VanDerWaalsContact CG-CD 3.48Å; F58-P151 HydrophobicContact CG-CG 3.75Å
59	Y	98.9	Very high	98.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-69.2	-28.9	-172	-79.9	-87.7	0	0	0	113.4	T55 I56 L63 G64 M65 L77 F84 D150 I156	T55-Y59 HydrophobicContact CG2-CD2 3.59Å; T55-Y59 HydrophobicContact CG2-CE2 3.7Å; T55-Y59 VanDerWaalsContact O-CD2 3.3Å; T55-Y59 WeakPolarHBondContact O-CD2 3.39Å; T55-Y59 PolarHBondContact O-N 3.49Å; I56-Y59 PolarHBondContact O-N 3.41Å; Y59-L63 HydrophobicContact CD1-CD1 3.85Å; Y59-L63 HydrophobicContact CE1-CD1 4.02Å; Y59-L63 CarbonylContact O-C 3.58Å; Y59-L63 WeakPolarHBondContact O-CA 3.31Å; Y59-L63 PolarHBondContact O-N 2.67Å; Y59-L63 VanDerWaalsContact O-N 3.15Å; Y59-G64 PolarHBondContact O-N 2.99Å; Y59-M65 HydrophobicContact CD1-CE 3.83Å; Y59-M65 HydrophobicContact CD1-SD 3.6Å; Y59-M65 VanDerWaalsContact CD1-SD 3.6Å; Y59-M65 HydrophobicContact CE1-CE 4.35Å; Y59-M65 HydrophobicContact CG-SD 4.14Å; Y59-M65 PolarHBondContact O-N 2.98Å; Y59-L77 VanDerWaalsContact CB-CD1 3.44Å; Y59-L77 HydrophobicContact CD1-CD1 4.44Å; Y59-L77 HydrophobicContact CD2-CD1 3.69Å; Y59-L77 HydrophobicContact CG-CD1 3.61Å; Y59-F84 HydrophobicContact CD1-CE2 4.46Å; Y59-F84 HydrophobicContact CE1-CD2 4.39Å; Y59-F84 HydrophobicContact CE1-CE2 4.03Å; Y59-D150 HydrophobicContact CE2-CB 3.92Å; Y59-D150 WeakPolarHBondContact CE2-OD2 3.25Å; Y59-D150 WeakPolarHBondContact OH-CB 3.49Å; Y59-D150 PolarHBondContact OH-OD2 3.43Å; Y59-I156 HydrophobicContact CE1-CD1 4.44Å; Y59-I156 WeakPolarHBondContact OH-CD1 3.33Å
60	T	98.8	Very high	98.2	Very high	40 Å²	40	52.6 Å²	52.6	25%	0.245	30%	0.302	C	S	.	.	H	α-helix	trans	-69.9	-41.9	173	54.9	0	0	0	0	111.7	I56 N57 F58 G64 M65 V67 L77	I56-T60 HydrophobicContact CG2-CG2 4.1Å; I56-T60 VanDerWaalsContact O-CB 3.31Å; I56-T60 WeakPolarHBondContact O-CB 3.2Å; I56-T60 WeakPolarHBondContact O-CG2 3.45Å; I56-T60 PolarHBondContact O-N 2.88Å; I56-T60 PolarHBondContact O-OG1 3.09Å; N57-T60 PolarHBondContact O-OG1 2.92Å; N57-T60 VanDerWaalsContact O-OG1 3.13Å; F58-T60 VanDerWaalsContact C-N 3.31Å; F58-T60 PolarHBondContact O-N 3.35Å; T60-G64 VanDerWaalsContact O-CA 3.26Å; T60-G64 WeakPolarHBondContact O-CA 3.34Å; T60-G64 PolarHBondContact O-N 3.35Å; T60-M65 VanDerWaalsContact CG2-O 3.28Å; T60-M65 WeakPolarHBondContact CG2-O 3.19Å; T60-V67 HydrophobicContact CG2-CG2 3.43Å; T60-V67 VanDerWaalsContact CG2-CG2 3.43Å; T60-L77 HydrophobicContact CG2-CD2 4.11Å
61	S	98.6	Very high	97.8	Very high	73 Å²	73	55 Å²	55	51%	0.51	31%	0.313	S	S	.	.	H	α-helix	trans	-80.1	-41.8	-177.6	-53.2	0	0	0	0	112.8	N57 F58 H121	N57-S61 VanDerWaalsContact O-CB 3.23Å; N57-S61 WeakPolarHBondContact O-CB 3.33Å; N57-S61 PolarHBondContact O-N 2.79Å; N57-S61 VanDerWaalsContact O-N 3.13Å; N57-S61 PolarHBondContact O-OG 2.93Å; F58-S61 PolarHBondContact O-N 2.9Å; S61-H121 PolarHBondContact O-NE2 3.46Å
62	V	98.7	Very high	97.4	Very high	10 Å²	10	56.3 Å²	56.3	6%	0.061	33%	0.331	C	S	.	.	H	α-helix	trans	-84.4	-40	-172.4	179.3	0	0	0	0	111.4	F58 H121 L122 C125 V127 F148	F58-V62 HydrophobicContact CD1-CB 4.44Å; F58-V62 HydrophobicContact CD1-CG2 4.41Å; F58-V62 HydrophobicContact CD2-CG2 3.82Å; F58-V62 HydrophobicContact CE1-CB 4.25Å; F58-V62 HydrophobicContact CE1-CG1 4.25Å; F58-V62 HydrophobicContact CE1-CG2 4.37Å; F58-V62 HydrophobicContact CE2-CB 4.49Å; F58-V62 HydrophobicContact CE2-CG2 3.79Å; F58-V62 HydrophobicContact CG-CG2 4.14Å; F58-V62 HydrophobicContact CZ-CB 4.26Å; F58-V62 HydrophobicContact CZ-CG1 4.02Å; F58-V62 HydrophobicContact CZ-CG2 4.06Å; F58-V62 WeakPolarHBondContact O-CB 3.45Å; F58-V62 VanDerWaalsContact O-CG2 3.25Å; F58-V62 WeakPolarHBondContact O-CG2 3.47Å; F58-V62 PolarHBondContact O-N 3.29Å; V62-H121 PolarHBondContact O-CD2 2.89Å; V62-H121 VanDerWaalsContact O-CD2 3.31Å; V62-H121 PolarHBondContact O-NE2 3.42Å; V62-L122 HydrophobicContact CG1-CD2 3.4Å; V62-C125 HydrophobicContact CG2-CB 4.19Å; V62-V127 HydrophobicContact CG1-CG2 4.12Å; V62-V127 HydrophobicContact CG2-CG2 3.77Å; V62-F148 HydrophobicContact CG1-CE2 4.2Å
63	L	98.6	Very high	97.1	Very high	47 Å²	47	62.3 Å²	62.3	25%	0.246	36%	0.362	C	S	.	.	H	α-helix	trans	-119	5.1	-174	-65.4	-177.8	0	0	0	114.2	Y59 M65 L109 F148 I156 V158	Y59-L63 HydrophobicContact CD1-CD1 3.85Å; Y59-L63 HydrophobicContact CE1-CD1 4.02Å; Y59-L63 CarbonylContact O-C 3.58Å; Y59-L63 WeakPolarHBondContact O-CA 3.31Å; Y59-L63 PolarHBondContact O-N 2.67Å; Y59-L63 VanDerWaalsContact O-N 3.15Å; L63-M65 HydrophobicContact CB-CE 4.19Å; L63-M65 HydrophobicContact CB-CG 4.18Å; L63-M65 HydrophobicContact CD1-CE 3.93Å; L63-M65 PolarHBondContact O-N 3.32Å; L63-L109 HydrophobicContact CD1-CD1 4.08Å; L63-F148 HydrophobicContact CD1-CZ 4.34Å; L63-F148 HydrophobicContact CD2-CZ 4.06Å; L63-F148 HydrophobicContact CG-CZ 4.49Å; L63-I156 HydrophobicContact CD1-CG2 4.22Å; L63-V158 HydrophobicContact CD2-CG2 3.86Å
64	G	98.4	Very high	97	Very high	61 Å²	61	62.7 Å²	62.7	63%	0.629	35%	0.354	S	S	*	.			trans	63.4	21.9	176.3	0	0	0	0	0	114	Y59 T60	Y59-G64 PolarHBondContact O-N 2.99Å; T60-G64 VanDerWaalsContact O-CA 3.26Å; T60-G64 WeakPolarHBondContact O-CA 3.34Å; T60-G64 PolarHBondContact O-N 3.35Å
65	M	98.7	Very high	97	Very high	12 Å²	12	61.7 Å²	61.7	6%	0.059	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-70.3	151.4	179.5	-63.7	-171.9	178.3	0	0	111.3	Y59 T60 L63 L77 G78 F79 F84 L109	Y59-M65 HydrophobicContact CD1-CE 3.83Å; Y59-M65 HydrophobicContact CD1-SD 3.6Å; Y59-M65 VanDerWaalsContact CD1-SD 3.6Å; Y59-M65 HydrophobicContact CE1-CE 4.35Å; Y59-M65 HydrophobicContact CG-SD 4.14Å; Y59-M65 PolarHBondContact O-N 2.98Å; T60-M65 VanDerWaalsContact CG2-O 3.28Å; T60-M65 WeakPolarHBondContact CG2-O 3.19Å; L63-M65 HydrophobicContact CB-CE 4.19Å; L63-M65 HydrophobicContact CB-CG 4.18Å; L63-M65 HydrophobicContact CD1-CE 3.93Å; L63-M65 PolarHBondContact O-N 3.32Å; M65-L77 HydrophobicContact CB-CB 4.18Å; M65-L77 HydrophobicContact CB-CD2 4.16Å; M65-L77 HydrophobicContact SD-CB 3.91Å; M65-G78 WeakPolarHBondContact CA-O 3.44Å; M65-F79 HydrophobicContact CE-CD1 3.64Å; M65-F79 HydrophobicContact CE-CE1 4.03Å; M65-F79 HydrophobicContact CE-CG 4.12Å; M65-F79 HydrophobicContact CG-CB 4.26Å; M65-F79 HydrophobicContact CG-CD1 4.27Å; M65-F79 HydrophobicContact SD-CD1 3.69Å; M65-F79 HydrophobicContact SD-CE1 4.25Å; M65-F79 HydrophobicContact SD-CG 4.5Å; M65-F84 HydrophobicContact CE-CD2 4.37Å; M65-F84 HydrophobicContact CE-CE2 3.75Å; M65-F84 HydrophobicContact CE-CZ 4.42Å; M65-F84 HydrophobicContact SD-CD2 4.16Å; M65-F84 HydrophobicContact SD-CE2 4.13Å; M65-L109 HydrophobicContact CE-CD1 3.86Å
66	E	98.6	Very high	96.9	Very high	146 Å²	146	61.7 Å²	61.7	68%	0.682	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	135.1	-179.8	-67.1	-176.7	178.8	0	0	111.8	V68 L77 G78	E66-V68 PolarHBondContact O-N 3.13Å; E66-L77 CarbonylContact O-C 3.44Å; E66-L77 WeakPolarHBondContact O-CA 3.38Å; E66-G78 PolarHBondContact N-O 3.19Å; E66-G78 PolarHBondContact O-N 3.35Å
67	V	98.5	Very high	96.9	Very high	65 Å²	65	60.6 Å²	60.6	39%	0.394	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	121.7	175.8	-172.5	0	0	0	0	110.1	I56 T60 K75	I56-V67 HydrophobicContact CD1-CG1 4.11Å; I56-V67 HydrophobicContact CG2-CG2 3.47Å; I56-V67 VanDerWaalsContact CG2-CG2 3.47Å; T60-V67 HydrophobicContact CG2-CG2 3.43Å; T60-V67 VanDerWaalsContact CG2-CG2 3.43Å; V67-K75 HydrophobicContact CG1-CD 4.34Å
68	V	97.5	Very high	96.9	Very high	56 Å²	56	56.8 Å²	56.8	34%	0.339	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	131.2	174.6	-177.1	0	0	0	0	109.6	E66 F70 K75 A76	E66-V68 PolarHBondContact O-N 3.13Å; V68-F70 HydrophobicContact CG1-CD1 4.46Å; V68-K75 CarbonylContact O-C 3.25Å; V68-K75 WeakPolarHBondContact O-CA 3.1Å; V68-A76 HydrophobicContact CB-CB 4.35Å; V68-A76 PolarHBondContact N-O 3.18Å; V68-A76 PolarHBondContact O-N 3.13Å
69	T	96.4	Very high	96.9	Very high	72 Å²	72	57.8 Å²	57.8	44%	0.442	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128.5	171.3	-54.3	0	0	0	0	109.4	G72 R74 K75	T69-G72 VanDerWaalsContact CG2-O 3.26Å; T69-G72 WeakPolarHBondContact CG2-O 3.48Å; T69-R74 WeakPolarHBondContact CA-O 3.28Å; T69-K75 HydrophobicContact CG2-CD 4.48Å; T69-K75 PolarHBondContact OG1-NZ 2.86Å
70	F	92.4	Very high	96.8	Very high	46 Å²	46	62 Å²	62	20%	0.202	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	159.9	-175.4	68.4	-76.3	0	0	0	111.7	V68 G72 R74 A76 N85	V68-F70 HydrophobicContact CG1-CD1 4.46Å; F70-G72 VanDerWaalsContact C-N 3.3Å; F70-G72 CarbonylContact O-C 3.53Å; F70-G72 PolarHBondContact O-N 2.9Å; F70-R74 HydrophobicContact CD1-CB 4.17Å; F70-R74 HydrophobicContact CD2-CB 4.42Å; F70-R74 HydrophobicContact CE1-CB 3.84Å; F70-R74 HydrophobicContact CE2-CB 4.13Å; F70-R74 HydrophobicContact CG-CB 4.44Å; F70-R74 HydrophobicContact CZ-CB 3.83Å; F70-R74 PolarHBondContact N-O 3.05Å; F70-R74 VanDerWaalsContact O-CB 3.24Å; F70-R74 WeakPolarHBondContact O-CB 3.4Å; F70-R74 PolarHBondContact O-N 2.92Å; F70-R74 VanDerWaalsContact O-N 3.17Å; F70-A76 HydrophobicContact CD1-CB 4.38Å; F70-A76 HydrophobicContact CE1-CB 3.75Å; F70-N85 WeakPolarHBondContact CZ-OD1 3.42Å
71	K	89.9	Confident	96.8	Very high	173 Å²	173	69.8 Å²	69.8	75%	0.752	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	45	54.6	178.1	-69.1	-175.7	176.3	-173.6	0	112
72	G	90.8	Very high	96.8	Very high	56 Å²	56	70 Å²	70	58%	0.577	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	-123	-170.7	0	0	0	0	0	110.9	T69 F70	T69-G72 VanDerWaalsContact CG2-O 3.26Å; T69-G72 WeakPolarHBondContact CG2-O 3.48Å; F70-G72 VanDerWaalsContact C-N 3.3Å; F70-G72 CarbonylContact O-C 3.53Å; F70-G72 PolarHBondContact O-N 2.9Å
73	N	91.8	Very high	96.8	Very high	146 Å²	146	72 Å²	72	78%	0.781	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	16.5	-173.5	-70.6	-30.1	0	0	0	114.1
74	R	95.8	Very high	96.8	Very high	80 Å²	80	70 Å²	70	30%	0.302	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	138	177.2	-52.2	-170.2	-178.7	-161.3	-2.4	109.4	T69 F70 F93	T69-R74 WeakPolarHBondContact CA-O 3.28Å; F70-R74 HydrophobicContact CD1-CB 4.17Å; F70-R74 HydrophobicContact CD2-CB 4.42Å; F70-R74 HydrophobicContact CE1-CB 3.84Å; F70-R74 HydrophobicContact CE2-CB 4.13Å; F70-R74 HydrophobicContact CG-CB 4.44Å; F70-R74 HydrophobicContact CZ-CB 3.83Å; F70-R74 PolarHBondContact N-O 3.05Å; F70-R74 VanDerWaalsContact O-CB 3.24Å; F70-R74 WeakPolarHBondContact O-CB 3.4Å; F70-R74 PolarHBondContact O-N 2.92Å; F70-R74 VanDerWaalsContact O-N 3.17Å; R74-F93 HydrophobicContact CG-CD2 4.48Å; R74-F93 HydrophobicContact CG-CE1 4.38Å; R74-F93 HydrophobicContact CG-CE2 3.89Å; R74-F93 HydrophobicContact CG-CZ 3.83Å
75	K	98.3	Very high	96.8	Very high	66 Å²	66	67.9 Å²	67.9	29%	0.287	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	143.3	-178.5	-61	-64.3	-179	175.5	0	110.6	V52 I56 V67 V68 T69 L86	V52-K75 HydrophobicContact CG1-CB 3.95Å; V52-K75 HydrophobicContact CG1-CG 3.95Å; I56-K75 HydrophobicContact CD1-CB 4.03Å; I56-K75 HydrophobicContact CD1-CD 4.3Å; I56-K75 HydrophobicContact CD1-CG 4.04Å; V67-K75 HydrophobicContact CG1-CD 4.34Å; V68-K75 CarbonylContact O-C 3.25Å; V68-K75 WeakPolarHBondContact O-CA 3.1Å; T69-K75 HydrophobicContact CG2-CD 4.48Å; T69-K75 PolarHBondContact OG1-NZ 2.86Å; K75-L86 PolarHBondContact O-N 3.13Å
76	A	98.6	Very high	96.8	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	162.1	168.8	0	0	0	0	0	110.9	V68 F70 K83 F84 N85	V68-A76 HydrophobicContact CB-CB 4.35Å; V68-A76 PolarHBondContact N-O 3.18Å; V68-A76 PolarHBondContact O-N 3.13Å; F70-A76 HydrophobicContact CD1-CB 4.38Å; F70-A76 HydrophobicContact CE1-CB 3.75Å; A76-K83 HydrophobicContact CB-CB 4.44Å; A76-K83 HydrophobicContact CB-CD 3.92Å; A76-F84 CarbonylContact C-O 3.55Å; A76-F84 WeakPolarHBondContact CA-O 3.43Å; A76-F84 WeakPolarHBondContact CB-O 2.99Å; A76-N85 WeakPolarHBondContact CB-OD1 3.45Å
77	L	98.8	Very high	96.8	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	110.3	172.6	-69	162	0	0	0	108.5	T55 I56 Y59 T60 M65 E66 K83 F84 L86	T55-L77 HydrophobicContact CG2-CD1 4.11Å; I56-L77 HydrophobicContact CG1-CD2 4.4Å; Y59-L77 VanDerWaalsContact CB-CD1 3.44Å; Y59-L77 HydrophobicContact CD1-CD1 4.44Å; Y59-L77 HydrophobicContact CD2-CD1 3.69Å; Y59-L77 HydrophobicContact CG-CD1 3.61Å; T60-L77 HydrophobicContact CG2-CD2 4.11Å; M65-L77 HydrophobicContact CB-CB 4.18Å; M65-L77 HydrophobicContact CB-CD2 4.16Å; M65-L77 HydrophobicContact SD-CB 3.91Å; E66-L77 CarbonylContact O-C 3.44Å; E66-L77 WeakPolarHBondContact O-CA 3.38Å; L77-K83 CarbonylContact O-C 3.58Å; L77-K83 WeakPolarHBondContact O-CA 3.38Å; L77-K83 VanDerWaalsContact O-CB 3.3Å; L77-K83 WeakPolarHBondContact O-CB 3.48Å; L77-F84 HydrophobicContact CB-CB 4.4Å; L77-F84 PolarHBondContact N-O 2.87Å; L77-F84 PolarHBondContact O-N 3.18Å; L77-L86 HydrophobicContact CD1-CD1 3.99Å; L77-L86 HydrophobicContact CD1-CD2 4.18Å; L77-L86 HydrophobicContact CD1-CG 4.45Å; L77-L86 HydrophobicContact CG-CD1 4.16Å
78	G	98.7	Very high	96.8	Very high	13 Å²	13	60.9 Å²	60.9	13%	0.134	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	143.3	-179.8	0	0	0	0	0	112.4	M65 E66	M65-G78 WeakPolarHBondContact CA-O 3.44Å; E66-G78 PolarHBondContact N-O 3.19Å; E66-G78 PolarHBondContact O-N 3.35Å
79	F	98.5	Very high	96.9	Very high	51 Å²	51	62 Å²	62	22%	0.224	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	132.9	173	53.9	-86.8	0	0	0	109.8	M65 K81 Q82 F84 L109	M65-F79 HydrophobicContact CE-CD1 3.64Å; M65-F79 HydrophobicContact CE-CE1 4.03Å; M65-F79 HydrophobicContact CE-CG 4.12Å; M65-F79 HydrophobicContact CG-CB 4.26Å; M65-F79 HydrophobicContact CG-CD1 4.27Å; M65-F79 HydrophobicContact SD-CD1 3.69Å; M65-F79 HydrophobicContact SD-CE1 4.25Å; M65-F79 HydrophobicContact SD-CG 4.5Å; F79-K81 PolarHBondContact O-N 2.91Å; F79-Q82 HydrophobicContact CD2-CB 4.28Å; F79-Q82 HydrophobicContact CE2-CB 3.75Å; F79-Q82 HydrophobicContact CZ-CB 4.01Å; F79-Q82 PolarHBondContact N-O 3.22Å; F79-Q82 PolarHBondContact O-N 3.15Å; F79-Q82 VanDerWaalsContact O-O 3.05Å; F79-F84 AromaticContact CE1-CD1 3.71Å; F79-F84 HydrophobicContact CE1-CD1 3.71Å; F79-F84 HydrophobicContact CE1-CD2 4Å; F79-F84 AromaticContact CE1-CE1 3.53Å; F79-F84 HydrophobicContact CE1-CE1 3.53Å; F79-F84 AromaticContact CE1-CE2 3.83Å; F79-F84 HydrophobicContact CE1-CE2 3.83Å; F79-F84 AromaticContact CE1-CG 3.95Å; F79-F84 HydrophobicContact CE1-CG 3.95Å; F79-F84 AromaticContact CE1-CZ 3.58Å; F79-F84 HydrophobicContact CE1-CZ 3.58Å; F79-F84 AromaticContact CZ-CD1 3.96Å; F79-F84 HydrophobicContact CZ-CD1 3.96Å; F79-F84 AromaticContact CZ-CE1 3.4Å; F79-F84 HydrophobicContact CZ-CE1 3.4Å; F79-F84 VanDerWaalsContact CZ-CE1 3.4Å; F79-F84 HydrophobicContact CZ-CE2 4.31Å; F79-F84 AromaticContact CZ-CZ 3.6Å; F79-F84 HydrophobicContact CZ-CZ 3.6Å; F79-L109 HydrophobicContact CE2-CD2 4.44Å; F79-L109 HydrophobicContact CZ-CD2 4.48Å
80	G	97.3	Very high	96.9	Very high	90 Å²	90	61.7 Å²	61.7	93%	0.928	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	-113.6	-174.7	0	0	0	0	0	111.9
81	K	97.9	Very high	97.1	Very high	202 Å²	202	66.3 Å²	66.3	88%	0.878	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	19	175.8	-62.8	-175	179.3	-179	0	112.8	F79	F79-K81 PolarHBondContact O-N 2.91Å
82	Q	98.7	Very high	97.5	Very high	78 Å²	78	59.9 Å²	59.9	36%	0.364	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	170.9	-173.7	-67.2	165.5	-43.1	0	0	110	L42 D43 F79	L42-Q82 WeakPolarHBondContact O-CG 3.19Å; L42-Q82 PolarHBondContact O-NE2 2.9Å; D43-Q82 VanDerWaalsContact O-CA 3.3Å; D43-Q82 WeakPolarHBondContact O-CA 3.41Å; D43-Q82 WeakPolarHBondContact O-CB 3.18Å; F79-Q82 HydrophobicContact CD2-CB 4.28Å; F79-Q82 HydrophobicContact CE2-CB 3.75Å; F79-Q82 HydrophobicContact CZ-CB 4.01Å; F79-Q82 PolarHBondContact N-O 3.22Å; F79-Q82 PolarHBondContact O-N 3.15Å; F79-Q82 VanDerWaalsContact O-O 3.05Å
83	K	98.6	Very high	97.7	Very high	51 Å²	51	60.7 Å²	60.7	22%	0.222	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	161.6	174.8	63.9	-179.8	-179.5	167.6	0	114	D43 H44 L45 A76 L77 N85	D43-K83 PolarHBondContact O-N 3.05Å; H44-K83 WeakPolarHBondContact CA-O 3.48Å; H44-K83 HydrophobicContact CB-CG 3.65Å; H44-K83 WeakPolarHBondContact CB-O 3.47Å; L45-K83 PolarHBondContact N-O 2.99Å; A76-K83 HydrophobicContact CB-CB 4.44Å; A76-K83 HydrophobicContact CB-CD 3.92Å; L77-K83 CarbonylContact O-C 3.58Å; L77-K83 WeakPolarHBondContact O-CA 3.38Å; L77-K83 VanDerWaalsContact O-CB 3.3Å; L77-K83 WeakPolarHBondContact O-CB 3.48Å; K83-N85 WeakPolarHBondContact CE-OD1 3.46Å; K83-N85 PolarHBondContact NZ-OD1 3.08Å
84	F	98.8	Very high	97.9	Very high	5 Å²	5	59.9 Å²	59.9	2%	0.022	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	116.5	161.7	-55	-30.8	0	0	0	109.5	L45 L47 Y59 M65 A76 L77 F79 L107 L109	L45-F84 HydrophobicContact CD1-CB 4.38Å; L45-F84 HydrophobicContact CD1-CD1 3.49Å; L45-F84 VanDerWaalsContact CD1-CD1 3.49Å; L45-F84 HydrophobicContact CD1-CE1 4Å; L45-F84 HydrophobicContact CD1-CG 4.11Å; L45-F84 HydrophobicContact CD2-CD1 4.24Å; L45-F84 HydrophobicContact CD2-CE1 3.99Å; L45-F84 HydrophobicContact CG-CD1 3.66Å; L45-F84 HydrophobicContact CG-CE1 3.92Å; L47-F84 HydrophobicContact CD1-CB 4.17Å; L47-F84 HydrophobicContact CD1-CD2 3.91Å; L47-F84 HydrophobicContact CD1-CG 4.11Å; L47-F84 HydrophobicContact CG-CB 4.39Å; Y59-F84 HydrophobicContact CD1-CE2 4.46Å; Y59-F84 HydrophobicContact CE1-CD2 4.39Å; Y59-F84 HydrophobicContact CE1-CE2 4.03Å; M65-F84 HydrophobicContact CE-CD2 4.37Å; M65-F84 HydrophobicContact CE-CE2 3.75Å; M65-F84 HydrophobicContact CE-CZ 4.42Å; M65-F84 HydrophobicContact SD-CD2 4.16Å; M65-F84 HydrophobicContact SD-CE2 4.13Å; A76-F84 CarbonylContact C-O 3.55Å; A76-F84 WeakPolarHBondContact CA-O 3.43Å; A76-F84 WeakPolarHBondContact CB-O 2.99Å; L77-F84 HydrophobicContact CB-CB 4.4Å; L77-F84 PolarHBondContact N-O 2.87Å; L77-F84 PolarHBondContact O-N 3.18Å; F79-F84 AromaticContact CE1-CD1 3.71Å; F79-F84 HydrophobicContact CE1-CD1 3.71Å; F79-F84 HydrophobicContact CE1-CD2 4Å; F79-F84 AromaticContact CE1-CE1 3.53Å; F79-F84 HydrophobicContact CE1-CE1 3.53Å; F79-F84 AromaticContact CE1-CE2 3.83Å; F79-F84 HydrophobicContact CE1-CE2 3.83Å; F79-F84 AromaticContact CE1-CG 3.95Å; F79-F84 HydrophobicContact CE1-CG 3.95Å; F79-F84 AromaticContact CE1-CZ 3.58Å; F79-F84 HydrophobicContact CE1-CZ 3.58Å; F79-F84 AromaticContact CZ-CD1 3.96Å; F79-F84 HydrophobicContact CZ-CD1 3.96Å; F79-F84 AromaticContact CZ-CE1 3.4Å; F79-F84 HydrophobicContact CZ-CE1 3.4Å; F79-F84 VanDerWaalsContact CZ-CE1 3.4Å; F79-F84 HydrophobicContact CZ-CE2 4.31Å; F79-F84 AromaticContact CZ-CZ 3.6Å; F79-F84 HydrophobicContact CZ-CZ 3.6Å; F84-L107 HydrophobicContact CE1-CD1 4.12Å; F84-L107 HydrophobicContact CE2-CD1 4.19Å; F84-L107 HydrophobicContact CZ-CD1 3.73Å; F84-L109 HydrophobicContact CE2-CD1 4.43Å; F84-L109 HydrophobicContact CZ-CD1 4.22Å; F84-L109 HydrophobicContact CZ-CD2 3.94Å
85	N	98.8	Very high	98	Very high	17 Å²	17	62.1 Å²	62.1	9%	0.091	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	137.9	166.4	-71.3	-21.2	0	0	0	108.9	H44 L45 V46 L47 F70 A76 K83	H44-N85 PolarHBondContact CD2-ND2 2.76Å; H44-N85 VanDerWaalsContact CD2-ND2 3.25Å; H44-N85 PolarHBondContact NE2-ND2 3.2Å; L45-N85 PolarHBondContact O-N 3.37Å; V46-N85 CarbonylContact C-O 3.51Å; V46-N85 WeakPolarHBondContact CA-O 3Å; V46-N85 HydrophobicContact CG2-CB 4.09Å; L47-N85 PolarHBondContact N-O 2.95Å; F70-N85 WeakPolarHBondContact CZ-OD1 3.42Å; A76-N85 WeakPolarHBondContact CB-OD1 3.45Å; K83-N85 WeakPolarHBondContact CE-OD1 3.46Å; K83-N85 PolarHBondContact NZ-OD1 3.08Å
86	L	98.8	Very high	98	Very high	5 Å²	5	62.5 Å²	62.5	3%	0.026	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	123.6	-177.6	-57.8	-177.6	0	0	0	110.9	L47 V49 V52 T55 I56 K75 L77	L47-L86 HydrophobicContact CB-CD2 4.05Å; L47-L86 HydrophobicContact CD1-CD2 4.44Å; V49-L86 HydrophobicContact CG1-CD2 4.5Å; V52-L86 HydrophobicContact CG1-CB 4.48Å; V52-L86 HydrophobicContact CG1-CD1 4.17Å; V52-L86 HydrophobicContact CG2-CB 4.1Å; T55-L86 HydrophobicContact CG2-CD1 4.03Å; T55-L86 HydrophobicContact CG2-CD2 3.89Å; I56-L86 HydrophobicContact CD1-CD1 4.37Å; I56-L86 HydrophobicContact CG1-CD1 3.76Å; K75-L86 PolarHBondContact O-N 3.13Å; L77-L86 HydrophobicContact CD1-CD1 3.99Å; L77-L86 HydrophobicContact CD1-CD2 4.18Å; L77-L86 HydrophobicContact CD1-CG 4.45Å; L77-L86 HydrophobicContact CG-CD1 4.16Å
87	H	98.5	Very high	97.9	Very high	15 Å²	15	65.7 Å²	65.7	7%	0.069	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.7	169	-74.2	-163.7	0	0	0	108.1	V46 L47 T48 V49 E92 F93	V46-H87 HydrophobicContact CG1-CB 4.07Å; L47-H87 PolarHBondContact O-N 2.78Å; T48-H87 CarbonylContact C-O 3.46Å; T48-H87 VanDerWaalsContact CA-O 3.29Å; T48-H87 WeakPolarHBondContact CA-O 3.48Å; V49-H87 PolarHBondContact N-O 2.9Å; H87-E92 HydrophobicContact CB-CB 4.1Å; H87-E92 HydrophobicContact CB-CG 4.11Å; H87-F93 AromaticContact CD2-CD2 3.69Å; H87-F93 PolarHBondContact CE1-O 3.1Å; H87-F93 PolarHBondContact ND1-N 2.96Å; H87-F93 AromaticContact NE2-CD2 3.57Å
88	Q	98.6	Very high	97.9	Very high	57 Å²	57	74.6 Å²	74.6	27%	0.266	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	134.5	171.8	-173.8	166.4	-42.7	0	0	109.4	V49 V52 G90 K91 E92	V49-Q88 CarbonylContact O-C 3.57Å; V49-Q88 WeakPolarHBondContact O-CA 3.45Å; V52-Q88 HydrophobicContact CG2-CB 3.84Å; Q88-G90 PolarHBondContact O-N 3.46Å; Q88-K91 HydrophobicContact CB-CB 4.25Å; Q88-K91 CarbonylContact O-C 3.6Å; Q88-K91 VanDerWaalsContact O-C 3.25Å; Q88-K91 WeakPolarHBondContact O-CA 3.49Å; Q88-K91 PolarHBondContact O-N 3.49Å; Q88-E92 PolarHBondContact O-N 2.65Å
89	L	98.1	Very high	97.9	Very high	80 Å²	80	80.5 Å²	80.5	42%	0.419	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	130.1	176.3	-172.8	67.7	0	0	0	110.3	T48 V49 K91	T48-L89 HydrophobicContact CG2-CB 4.16Å; T48-L89 HydrophobicContact CG2-CD1 3.72Å; V49-L89 PolarHBondContact O-N 2.75Å; L89-K91 PolarHBondContact O-N 3.01Å
90	G	97.4	Very high	97.9	Very high	65 Å²	65	79.5 Å²	79.5	67%	0.67	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	-0.4	-173.9	0	0	0	0	0	114.9	Q88 E92	Q88-G90 PolarHBondContact O-N 3.46Å; G90-E92 PolarHBondContact N-OE1 3.25Å
91	K	97.5	Very high	97.9	Very high	142 Å²	142	78.5 Å²	78.5	62%	0.617	41%	0.406	S	S	*	.	S	Bend	trans	-135.6	32.7	177.2	-57	-180	-178.3	172.2	0	111.3	Q88 L89	Q88-K91 HydrophobicContact CB-CB 4.25Å; Q88-K91 CarbonylContact O-C 3.6Å; Q88-K91 VanDerWaalsContact O-C 3.25Å; Q88-K91 WeakPolarHBondContact O-CA 3.49Å; Q88-K91 PolarHBondContact O-N 3.49Å; L89-K91 PolarHBondContact O-N 3.01Å
92	E	97.5	Very high	98	Very high	38 Å²	38	70 Å²	70	18%	0.178	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-72	151.9	-178	-45.7	84	-175.3	0	0	111.3	T48 H87 Q88 G90 K96 P100	T48-E92 HydrophobicContact CG2-CG 4.19Å; H87-E92 HydrophobicContact CB-CB 4.1Å; H87-E92 HydrophobicContact CB-CG 4.11Å; Q88-E92 PolarHBondContact O-N 2.65Å; G90-E92 PolarHBondContact N-OE1 3.25Å; E92-K96 HydrophobicContact CB-CD 3.33Å; E92-K96 HydrophobicContact CG-CD 3.91Å; E92-K96 IonicContact OE2-NZ 2.89Å; E92-K96 PolarHBondContact OE2-NZ 3.04Å; E92-P100 HydrophobicContact CG-CB 4.23Å; E92-P100 HydrophobicContact CG-CG 4.49Å
93	F	95.3	Very high	98	Very high	74 Å²	74	67.6 Å²	67.6	33%	0.325	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-88	145.2	171.8	-56.2	-78	0	0	0	110.9	R74 H87 P95	R74-F93 HydrophobicContact CG-CD2 4.48Å; R74-F93 HydrophobicContact CG-CE1 4.38Å; R74-F93 HydrophobicContact CG-CE2 3.89Å; R74-F93 HydrophobicContact CG-CZ 3.83Å; H87-F93 AromaticContact CD2-CD2 3.69Å; H87-F93 PolarHBondContact CE1-O 3.1Å; H87-F93 PolarHBondContact ND1-N 2.96Å; H87-F93 AromaticContact NE2-CD2 3.57Å; F93-P95 CarbonylContact O-C 3.58Å
94	E	96.1	Very high	98	Very high	129 Å²	129	69.2 Å²	69.2	60%	0.603	39%	0.385	S	S	*	.	S	Bend	trans	-88.3	149.6	171.9	-63.9	-57.1	151.3	0	0	112.3	K96	E94-K96 WeakPolarHBondContact OE1-CD 3.38Å; E94-K96 WeakPolarHBondContact OE1-CE 3.38Å; E94-K96 IonicContact OE1-NZ 2.86Å; E94-K96 PolarHBondContact OE1-NZ 3.2Å; E94-K96 PolarHBondContact OE2-N 2.92Å
95	P	97	Very high	98	Very high	126 Å²	126	69.9 Å²	69.9	82%	0.818	39%	0.391	S	S	*	.	S	Bend	cis	-72.5	155.2	-12	32.3	-35.3	0	0	0	111.8	F93	F93-P95 CarbonylContact O-C 3.58Å
96	K	97.8	Very high	98	Very high	74 Å²	74	74.2 Å²	74.2	32%	0.322	42%	0.415	S	S	.	.			trans	-137.3	175.1	177.8	64.2	-165.4	-177.7	-152.5	0	112.7	E92 E94 P100	E92-K96 HydrophobicContact CB-CD 3.33Å; E92-K96 HydrophobicContact CG-CD 3.91Å; E92-K96 IonicContact OE2-NZ 2.89Å; E92-K96 PolarHBondContact OE2-NZ 3.04Å; E94-K96 WeakPolarHBondContact OE1-CD 3.38Å; E94-K96 WeakPolarHBondContact OE1-CE 3.38Å; E94-K96 IonicContact OE1-NZ 2.86Å; E94-K96 PolarHBondContact OE1-NZ 3.2Å; E94-K96 PolarHBondContact OE2-N 2.92Å; K96-P100 HydrophobicContact CD-CG 3.72Å; K96-P100 HydrophobicContact CG-CG 3.9Å
97	A	98.1	Very high	98	Very high	67 Å²	67	75.1 Å²	75.1	55%	0.554	42%	0.42	S	S	*	.			trans	-53.6	145.5	170.4	0	0	0	0	0	110.4	H99 P100	A97-H99 PolarHBondContact O-N 3.11Å; A97-P100 WeakPolarHBondContact O-CD 3.46Å; A97-P100 VanDerWaalsContact O-CG 3.3Å; A97-P100 WeakPolarHBondContact O-CG 3.33Å
98	K	98.3	Very high	98	Very high	188 Å²	188	77.3 Å²	77.3	82%	0.817	44%	0.436	S	S	*	.	S	Bend	trans	-58.4	-34.5	-179.9	-172.5	179.1	178.5	-178.7	0	112.9
99	H	98.3	Very high	98	Very high	136 Å²	136	76 Å²	76	63%	0.63	43%	0.43	S	S	*	.	S	Bend	trans	-128	77.6	177.4	-59.6	-66.8	0	0	0	109.7	A97 T101	A97-H99 PolarHBondContact O-N 3.11Å; H99-T101 PolarHBondContact O-N 2.97Å; H99-T101 VanDerWaalsContact O-N 3.08Å; H99-T101 PolarHBondContact O-OG1 2.9Å
100	P	98.4	Very high	98	Very high	30 Å²	30	76.4 Å²	76.4	20%	0.195	43%	0.432	C	S	.	.			trans	-61.1	114.2	177	-15.2	29.5	0	0	0	109.1	T48 E92 K96 A97	T48-P100 HydrophobicContact CG2-CB 3.9Å; T48-P100 WeakPolarHBondContact OG1-CB 3.48Å; E92-P100 HydrophobicContact CG-CB 4.23Å; E92-P100 HydrophobicContact CG-CG 4.49Å; K96-P100 HydrophobicContact CD-CG 3.72Å; K96-P100 HydrophobicContact CG-CG 3.9Å; A97-P100 WeakPolarHBondContact O-CD 3.46Å; A97-P100 VanDerWaalsContact O-CG 3.3Å; A97-P100 WeakPolarHBondContact O-CG 3.33Å
101	T	98.6	Very high	98.1	Very high	70 Å²	70	75.1 Å²	75.1	43%	0.429	41%	0.411	S	S	.	.			trans	-128.9	123.4	-171.1	-53.1	0	0	0	0	108.7	H99 S104	H99-T101 PolarHBondContact O-N 2.97Å; H99-T101 VanDerWaalsContact O-N 3.08Å; H99-T101 PolarHBondContact O-OG1 2.9Å; T101-S104 PolarHBondContact O-OG 3.33Å
102	S	98.6	Very high	98.1	Very high	24 Å²	24	78.4 Å²	78.4	17%	0.168	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	139	171.7	144.7	0	0	0	0	109.4	T48 K50 S104 D152	T48-S102 VanDerWaalsContact O-CA 3.23Å; T48-S102 WeakPolarHBondContact O-CA 3.26Å; T48-S102 WeakPolarHBondContact O-CB 3.43Å; K50-S102 WeakPolarHBondContact CE-OG 3.32Å; S102-S104 VanDerWaalsContact C-N 3.31Å; S102-S104 PolarHBondContact O-N 2.97Å; S102-D152 WeakPolarHBondContact CB-OD1 3.46Å; S102-D152 WeakPolarHBondContact OG-CB 3.41Å; S102-D152 PolarHBondContact OG-OD1 2.86Å
103	G	98.5	Very high	98.1	Very high	27 Å²	27	79.4 Å²	79.4	28%	0.278	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	7	-177.7	0	0	0	0	0	115	D152 N154	G103-D152 WeakPolarHBondContact CA-O 3.5Å; G103-N154 WeakPolarHBondContact CA-OD1 3.37Å; G103-N154 PolarHBondContact N-OD1 3.03Å
104	S	98.7	Very high	98.2	Very high	84 Å²	84	78.5 Å²	78.5	59%	0.587	44%	0.436	S	S	*	.			trans	-90.1	-2.7	-177	74	0	0	0	0	114.5	T101 S102 N154	T101-S104 PolarHBondContact O-OG 3.33Å; S102-S104 VanDerWaalsContact C-N 3.31Å; S102-S104 PolarHBondContact O-N 2.97Å; S104-N154 PolarHBondContact N-OD1 3.33Å
105	A	98.8	Very high	98.3	Very high	19 Å²	19	73.1 Å²	73.1	16%	0.157	41%	0.411	C	S	.	.			trans	-88.1	143.5	-179	0	0	0	0	0	111.3	L47 L107 N154 L155	L47-A105 HydrophobicContact CD2-CB 3.72Å; A105-L107 HydrophobicContact CB-CD1 4.36Å; A105-L107 HydrophobicContact CB-CD2 4.49Å; A105-L107 HydrophobicContact CB-CG 4.14Å; A105-N154 HydrophobicContact CB-CB 4.09Å; A105-N154 WeakPolarHBondContact CB-OD1 3.29Å; A105-N154 PolarHBondContact N-OD1 2.85Å; A105-N154 CarbonylContact O-C 3.47Å; A105-N154 WeakPolarHBondContact O-CA 3.42Å; A105-N154 WeakPolarHBondContact O-CB 3.23Å; A105-L155 PolarHBondContact O-N 2.9Å
106	D	98.8	Very high	98.3	Very high	108 Å²	108	72.4 Å²	72.4	58%	0.578	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132	110.5	170.6	-173.8	-11.3	0	0	0	106.5	L155	D106-L155 WeakPolarHBondContact CA-O 3.45Å; D106-L155 HydrophobicContact CB-CB 4.36Å
107	L	98.8	Very high	98.4	Very high	25 Å²	25	74.4 Å²	74.4	13%	0.131	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	126.1	-165.6	-59.2	178.9	0	0	0	111.2	L45 L47 F84 A105 L155 I156 E157	L45-L107 HydrophobicContact CD2-CD1 4.29Å; L45-L107 HydrophobicContact CD2-CD2 3.58Å; L47-L107 HydrophobicContact CD2-CD1 4.34Å; F84-L107 HydrophobicContact CE1-CD1 4.12Å; F84-L107 HydrophobicContact CE2-CD1 4.19Å; F84-L107 HydrophobicContact CZ-CD1 3.73Å; A105-L107 HydrophobicContact CB-CD1 4.36Å; A105-L107 HydrophobicContact CB-CD2 4.49Å; A105-L107 HydrophobicContact CB-CG 4.14Å; L107-L155 PolarHBondContact N-O 2.9Å; L107-I156 HydrophobicContact CB-CD1 4.4Å; L107-I156 HydrophobicContact CD1-CD1 4.38Å; L107-E157 PolarHBondContact O-N 3.24Å
108	C	98.8	Very high	98.4	Very high	60 Å²	60	71.9 Å²	71.9	41%	0.405	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	122.2	168.7	178.3	0	0	0	0	110.9	E157	C108-E157 CarbonylContact C-O 3.56Å; C108-E157 WeakPolarHBondContact CA-O 3.34Å; C108-E157 HydrophobicContact CB-CB 4.15Å; C108-E157 HydrophobicContact CB-CG 4.32Å
109	L	98.8	Very high	98.4	Very high	30 Å²	30	64.2 Å²	64.2	16%	0.157	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.2	-177.2	-56.3	178.3	0	0	0	110.3	L63 M65 F79 F84 I156 E157 V158 S159	L63-L109 HydrophobicContact CD1-CD1 4.08Å; M65-L109 HydrophobicContact CE-CD1 3.86Å; F79-L109 HydrophobicContact CE2-CD2 4.44Å; F79-L109 HydrophobicContact CZ-CD2 4.48Å; F84-L109 HydrophobicContact CE2-CD1 4.43Å; F84-L109 HydrophobicContact CZ-CD1 4.22Å; F84-L109 HydrophobicContact CZ-CD2 3.94Å; L109-I156 HydrophobicContact CD1-CG2 4.36Å; L109-E157 PolarHBondContact N-O 3.48Å; L109-V158 WeakPolarHBondContact O-CA 3.48Å; L109-S159 PolarHBondContact O-N 2.84Å
110	I	98.6	Very high	98.5	Very high	88 Å²	88	60.4 Å²	60.4	45%	0.451	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	125.1	178.2	-53.2	-57.5	0	0	0	109.3	I143 S159 Y161	I110-I143 HydrophobicContact CD1-CG2 4.32Å; I110-S159 WeakPolarHBondContact CA-O 3.38Å; I110-Y161 HydrophobicContact CD1-CD2 4.22Å; I110-Y161 HydrophobicContact CD1-CE2 3.77Å; I110-Y161 HydrophobicContact CG1-CD2 4.39Å; I110-Y161 HydrophobicContact CG1-CE2 3.84Å; I110-Y161 HydrophobicContact CG2-CD2 3.96Å; I110-Y161 HydrophobicContact CG2-CE2 4.23Å
111	T	98.5	Very high	98.5	Very high	39 Å²	39	62.8 Å²	62.8	24%	0.239	37%	0.365	C	S	.	.			trans	-110.5	156.6	171.8	-176.2	0	0	0	0	110.8	T113 V118 V158 S159 N160	T111-T113 WeakPolarHBondContact CG2-O 3.3Å; T111-T113 WeakPolarHBondContact OG1-CB 3.25Å; T111-T113 PolarHBondContact OG1-N 2.93Å; T111-T113 VanDerWaalsContact OG1-N 3.09Å; T111-T113 PolarHBondContact OG1-OG1 2.91Å; T111-V118 HydrophobicContact CG2-CG2 4.09Å; T111-V158 HydrophobicContact CG2-CG1 3.41Å; T111-V158 VanDerWaalsContact CG2-CG1 3.41Å; T111-S159 PolarHBondContact N-O 3.08Å; T111-N160 WeakPolarHBondContact CG2-ND2 3.15Å; T111-N160 PolarHBondContact O-ND2 3.42Å
112	K	97.1	Very high	98.5	Very high	210 Å²	210	59.5 Å²	59.5	91%	0.913	35%	0.345	S	S	*	.	S	Bend	trans	-90.5	-17.1	168.2	-65.2	-178.4	-179.2	179.5	0	112
113	T	98.1	Very high	98.5	Very high	60 Å²	60	66.7 Å²	66.7	37%	0.368	37%	0.373	S	S	.	.	S	Bend	trans	-67.8	131.2	176.7	-53.8	0	0	0	0	109.2	T111 L115 E117 V118 N160	T111-T113 WeakPolarHBondContact CG2-O 3.3Å; T111-T113 WeakPolarHBondContact OG1-CB 3.25Å; T111-T113 PolarHBondContact OG1-N 2.93Å; T111-T113 VanDerWaalsContact OG1-N 3.09Å; T111-T113 PolarHBondContact OG1-OG1 2.91Å; T113-L115 PolarHBondContact O-N 2.71Å; T113-E117 HydrophobicContact CG2-CB 3.86Å; T113-V118 HydrophobicContact CG2-CG2 3.83Å; T113-N160 PolarHBondContact O-ND2 2.71Å; T113-N160 PolarHBondContact O-OD1 3.33Å
114	P	98.1	Very high	98.5	Very high	55 Å²	55	71.3 Å²	71.3	36%	0.357	40%	0.396	S	S	.	.			trans	-55.9	135.7	175.7	-26.4	35.7	0	0	0	111.9	T116 E117 V118 N160	P114-T116 PolarHBondContact O-N 2.52Å; P114-E117 HydrophobicContact CB-CG 4.46Å; P114-E117 WeakPolarHBondContact O-CB 3.33Å; P114-E117 PolarHBondContact O-N 3.22Å; P114-V118 PolarHBondContact O-N 2.95Å; P114-N160 WeakPolarHBondContact CA-OD1 3.17Å
115	L	98.1	Very high	98.4	Very high	15 Å²	15	69.7 Å²	69.7	8%	0.079	38%	0.384	C	S	.	.	H	α-helix	trans	-58.9	-24.4	-178.5	-69.5	-179.1	0	0	0	114.3	T113 E117 V118 A119 T144 L146 V158 N160	T113-L115 PolarHBondContact O-N 2.71Å; L115-E117 VanDerWaalsContact C-N 3.34Å; L115-V118 HydrophobicContact CD2-CG2 4.48Å; L115-V118 PolarHBondContact O-N 3.27Å; L115-A119 VanDerWaalsContact O-CB 3.31Å; L115-A119 WeakPolarHBondContact O-CB 3.43Å; L115-A119 PolarHBondContact O-N 2.81Å; L115-T144 VanDerWaalsContact CD1-C 3.42Å; L115-T144 HydrophobicContact CD1-CG2 3.66Å; L115-T144 WeakPolarHBondContact CD1-O 3.03Å; L115-L146 HydrophobicContact CB-CD1 4.26Å; L115-L146 HydrophobicContact CB-CG 4.49Å; L115-L146 HydrophobicContact CD1-CG 4.49Å; L115-L146 HydrophobicContact CD2-CD1 4.17Å; L115-L146 HydrophobicContact CD2-CG 4.23Å; L115-V158 HydrophobicContact CD2-CG1 4.34Å; L115-V158 WeakPolarHBondContact CD2-O 3.21Å; L115-N160 WeakPolarHBondContact CG-OD1 3.34Å; L115-N160 PolarHBondContact N-OD1 2.81Å
116	T	97.8	Very high	98.4	Very high	112 Å²	112	72 Å²	72	69%	0.687	41%	0.41	S	S	*	.	H	α-helix	trans	-63.8	-40.6	172.9	47.3	0	0	0	0	111.9	P114 A120	P114-T116 PolarHBondContact O-N 2.52Å; T116-A120 PolarHBondContact O-N 2.74Å; T116-A120 VanDerWaalsContact O-N 3.14Å
117	E	98.6	Very high	98.4	Very high	116 Å²	116	67.8 Å²	67.8	54%	0.542	39%	0.388	S	S	.	.	H	α-helix	trans	-72.4	-39.7	175.2	-66.9	174.5	-146.8	0	0	111.1	T113 P114 L115 A120 H121	T113-E117 HydrophobicContact CG2-CB 3.86Å; P114-E117 HydrophobicContact CB-CG 4.46Å; P114-E117 WeakPolarHBondContact O-CB 3.33Å; P114-E117 PolarHBondContact O-N 3.22Å; L115-E117 VanDerWaalsContact C-N 3.34Å; E117-A120 PolarHBondContact O-N 2.83Å; E117-H121 WeakPolarHBondContact O-CB 3.42Å; E117-H121 PolarHBondContact O-N 2.79Å
118	V	98.6	Very high	98.4	Very high	14 Å²	14	74.2 Å²	74.2	9%	0.085	42%	0.417	C	S	.	.	H	α-helix	trans	-58.7	-49.8	173.6	179.4	0	0	0	0	110.3	T111 T113 P114 L115 A120 H121 L122 L146 V158	T111-V118 HydrophobicContact CG2-CG2 4.09Å; T113-V118 HydrophobicContact CG2-CG2 3.83Å; P114-V118 PolarHBondContact O-N 2.95Å; L115-V118 HydrophobicContact CD2-CG2 4.48Å; L115-V118 PolarHBondContact O-N 3.27Å; V118-A120 VanDerWaalsContact C-N 3.31Å; V118-A120 PolarHBondContact O-N 2.81Å; V118-H121 PolarHBondContact O-N 2.94Å; V118-H121 VanDerWaalsContact O-N 3.15Å; V118-L122 HydrophobicContact CG1-CD1 4.15Å; V118-L122 HydrophobicContact CG1-CG 4.22Å; V118-L122 VanDerWaalsContact O-CG 3.32Å; V118-L122 WeakPolarHBondContact O-CG 3.45Å; V118-L122 PolarHBondContact O-N 2.78Å; V118-L146 HydrophobicContact CB-CD1 4.2Å; V118-L146 HydrophobicContact CG1-CD1 4.03Å; V118-V158 HydrophobicContact CG1-CG1 4.15Å
119	A	98.7	Very high	98.4	Very high	26 Å²	26	74 Å²	74	22%	0.215	41%	0.412	C	S	.	.	H	α-helix	trans	-59.8	-41.2	179.1	0	0	0	0	0	112.4	L115 K123 I129 L146	L115-A119 VanDerWaalsContact O-CB 3.31Å; L115-A119 WeakPolarHBondContact O-CB 3.43Å; L115-A119 PolarHBondContact O-N 2.81Å; A119-K123 PolarHBondContact O-N 2.98Å; A119-K123 VanDerWaalsContact O-N 3.15Å; A119-I129 HydrophobicContact CB-CD1 3.83Å; A119-L146 HydrophobicContact CB-CD1 3.85Å
120	A	98.7	Very high	98.4	Very high	57 Å²	57	77.2 Å²	77.2	47%	0.471	43%	0.426	S	S	.	.	H	α-helix	trans	-63.2	-43.3	175.4	0	0	0	0	0	111.8	T116 E117 V118 K123 V124	T116-A120 PolarHBondContact O-N 2.74Å; T116-A120 VanDerWaalsContact O-N 3.14Å; E117-A120 PolarHBondContact O-N 2.83Å; V118-A120 VanDerWaalsContact C-N 3.31Å; V118-A120 PolarHBondContact O-N 2.81Å; A120-K123 PolarHBondContact O-N 2.84Å; A120-V124 WeakPolarHBondContact O-CG2 3.48Å; A120-V124 PolarHBondContact O-N 3.03Å; A120-V124 VanDerWaalsContact O-N 3.13Å
121	H	98.8	Very high	98.4	Very high	79 Å²	79	77.1 Å²	77.1	37%	0.366	42%	0.424	S	S	.	.	H	α-helix	trans	-64.2	-46.4	177	-177.5	63	0	0	0	112.4	S61 V62 E117 V118 K123 V124 C125	S61-H121 PolarHBondContact O-NE2 3.46Å; V62-H121 PolarHBondContact O-CD2 2.89Å; V62-H121 VanDerWaalsContact O-CD2 3.31Å; V62-H121 PolarHBondContact O-NE2 3.42Å; E117-H121 WeakPolarHBondContact O-CB 3.42Å; E117-H121 PolarHBondContact O-N 2.79Å; V118-H121 PolarHBondContact O-N 2.94Å; V118-H121 VanDerWaalsContact O-N 3.15Å; H121-K123 PolarHBondContact O-N 3.28Å; H121-V124 WeakPolarHBondContact O-CB 3.32Å; H121-V124 PolarHBondContact O-N 2.93Å; H121-C125 PolarHBondContact CE1-SG 2.85Å; H121-C125 PolarHBondContact NE2-SG 2.9Å; H121-C125 VanDerWaalsContact NE2-SG 3.42Å; H121-C125 PolarHBondContact O-N 2.79Å
122	L	98.7	Very high	98.3	Very high	1 Å²	1	76.8 Å²	76.8	1%	0.005	43%	0.427	C	S	.	.	H	α-helix	trans	-54.2	-43.8	175.8	-69.5	-179.6	0	0	0	111.2	V62 V118 V124 C125 G126 V127 I129 L146 F148	V62-L122 HydrophobicContact CG1-CD2 3.4Å; V118-L122 HydrophobicContact CG1-CD1 4.15Å; V118-L122 HydrophobicContact CG1-CG 4.22Å; V118-L122 VanDerWaalsContact O-CG 3.32Å; V118-L122 WeakPolarHBondContact O-CG 3.45Å; V118-L122 PolarHBondContact O-N 2.78Å; L122-V124 PolarHBondContact O-N 3.47Å; L122-C125 CarbonylContact O-C 3.59Å; L122-C125 PolarHBondContact O-N 2.57Å; L122-G126 PolarHBondContact O-N 3.2Å; L122-G126 VanDerWaalsContact O-N 3.11Å; L122-V127 HydrophobicContact CB-CB 4.26Å; L122-V127 HydrophobicContact CD2-CB 4.14Å; L122-V127 HydrophobicContact CD2-CG1 4.14Å; L122-V127 PolarHBondContact O-N 3.33Å; L122-I129 HydrophobicContact CB-CD1 4.47Å; L122-I129 HydrophobicContact CB-CG1 4.38Å; L122-I129 HydrophobicContact CD1-CD1 4.14Å; L122-I129 HydrophobicContact CD1-CG1 3.84Å; L122-L146 HydrophobicContact CD1-CD1 4.44Å; L122-F148 HydrophobicContact CD1-CD1 3.65Å; L122-F148 HydrophobicContact CD1-CE1 3.86Å; L122-F148 HydrophobicContact CD1-CG 4.33Å; L122-F148 HydrophobicContact CD2-CD1 4.38Å; L122-F148 HydrophobicContact CD2-CE1 4.19Å; L122-F148 HydrophobicContact CD2-CE2 4.44Å; L122-F148 HydrophobicContact CD2-CZ 4.24Å
123	K	98.3	Very high	98.3	Very high	175 Å²	175	71.3 Å²	71.3	76%	0.761	41%	0.413	S	S	*	.	H	α-helix	trans	-62	-41.4	176	-174.4	178.5	-179.5	178.9	0	112.6	A119 A120 H121 C125 G126	A119-K123 PolarHBondContact O-N 2.98Å; A119-K123 VanDerWaalsContact O-N 3.15Å; A120-K123 PolarHBondContact O-N 2.84Å; H121-K123 PolarHBondContact O-N 3.28Å; K123-C125 VanDerWaalsContact C-N 3.33Å; K123-G126 PolarHBondContact O-N 3.43Å; K123-G126 VanDerWaalsContact O-N 3.15Å
124	V	98.5	Very high	98.3	Very high	124 Å²	124	70.2 Å²	70.2	75%	0.752	41%	0.406	S	S	*	.	H	α-helix	trans	-64.9	-38.8	175.9	171	0	0	0	0	111.3	A120 H121 L122 G126	A120-V124 WeakPolarHBondContact O-CG2 3.48Å; A120-V124 PolarHBondContact O-N 3.03Å; A120-V124 VanDerWaalsContact O-N 3.13Å; H121-V124 WeakPolarHBondContact O-CB 3.32Å; H121-V124 PolarHBondContact O-N 2.93Å; L122-V124 PolarHBondContact O-N 3.47Å; V124-G126 PolarHBondContact O-N 2.76Å
125	C	98.4	Very high	98.3	Very high	50 Å²	50	73.1 Å²	73.1	34%	0.338	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-5.2	174.7	-68.9	0	0	0	0	113.9	V62 H121 L122 K123 V127	V62-C125 HydrophobicContact CG2-CB 4.19Å; H121-C125 PolarHBondContact CE1-SG 2.85Å; H121-C125 PolarHBondContact NE2-SG 2.9Å; H121-C125 VanDerWaalsContact NE2-SG 3.42Å; H121-C125 PolarHBondContact O-N 2.79Å; L122-C125 CarbonylContact O-C 3.59Å; L122-C125 PolarHBondContact O-N 2.57Å; K123-C125 VanDerWaalsContact C-N 3.33Å; C125-V127 VanDerWaalsContact C-N 3.29Å; C125-V127 HydrophobicContact CB-CG2 4.07Å; C125-V127 PolarHBondContact O-N 2.78Å
126	G	98.3	Very high	98.3	Very high	69 Å²	69	76.2 Å²	76.2	71%	0.711	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	23.3	-176.4	0	0	0	0	0	113.8	L122 K123 V124	L122-G126 PolarHBondContact O-N 3.2Å; L122-G126 VanDerWaalsContact O-N 3.11Å; K123-G126 PolarHBondContact O-N 3.43Å; K123-G126 VanDerWaalsContact O-N 3.15Å; V124-G126 PolarHBondContact O-N 2.76Å
127	V	98.6	Very high	98.2	Very high	19 Å²	19	76.1 Å²	76.1	12%	0.115	43%	0.43	C	S	.	.			trans	-88.6	124.6	175.9	179.7	0	0	0	0	109.2	F58 V62 L122 C125 F148	F58-V127 HydrophobicContact CE2-CG2 3.9Å; F58-V127 HydrophobicContact CZ-CG2 4.41Å; V62-V127 HydrophobicContact CG1-CG2 4.12Å; V62-V127 HydrophobicContact CG2-CG2 3.77Å; L122-V127 HydrophobicContact CB-CB 4.26Å; L122-V127 HydrophobicContact CD2-CB 4.14Å; L122-V127 HydrophobicContact CD2-CG1 4.14Å; L122-V127 PolarHBondContact O-N 3.33Å; C125-V127 VanDerWaalsContact C-N 3.29Å; C125-V127 HydrophobicContact CB-CG2 4.07Å; C125-V127 PolarHBondContact O-N 2.78Å; V127-F148 HydrophobicContact CG1-CB 3.75Å; V127-F148 HydrophobicContact CG1-CD2 3.74Å; V127-F148 HydrophobicContact CG1-CG 3.89Å
128	E	98.4	Very high	98.1	Very high	159 Å²	159	71.4 Å²	71.4	74%	0.743	41%	0.412	S	S	*	.			trans	-74.5	130.6	174.3	-174.3	177.1	-179.2	0	0	110.6	F148	E128-F148 WeakPolarHBondContact O-CB 3.43Å
129	I	98.8	Very high	98	Very high	57 Å²	57	74 Å²	74	29%	0.292	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	113.5	171.1	-61.3	171.8	0	0	0	107.1	A119 L122 E131 L146 Y147	A119-I129 HydrophobicContact CB-CD1 3.83Å; L122-I129 HydrophobicContact CB-CD1 4.47Å; L122-I129 HydrophobicContact CB-CG1 4.38Å; L122-I129 HydrophobicContact CD1-CD1 4.14Å; L122-I129 HydrophobicContact CD1-CG1 3.84Å; I129-E131 WeakPolarHBondContact CG2-O 3.26Å; I129-L146 HydrophobicContact CG2-CD2 4.19Å; I129-Y147 CarbonylContact C-O 3.43Å; I129-Y147 WeakPolarHBondContact CA-O 3.34Å
130	E	98.6	Very high	97.8	Very high	97 Å²	97	78.1 Å²	78.1	45%	0.453	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	-38.9	178.1	-66.8	-166.5	162.6	0	0	111.5	Y147 R149	E130-Y147 PolarHBondContact N-O 2.82Å; E130-R149 VanDerWaalsContact CD-NE 3.31Å; E130-R149 WeakPolarHBondContact OE1-CD 3.13Å; E130-R149 WeakPolarHBondContact OE1-CG 3.05Å; E130-R149 IonicContact OE1-CZ 2.93Å; E130-R149 IonicContact OE1-NE 2.78Å; E130-R149 PolarHBondContact OE1-NE 3.27Å; E130-R149 IonicContact OE1-NH2 2.71Å; E130-R149 IonicContact OE2-CZ 3.69Å; E130-R149 IonicContact OE2-NE 3.13Å; E130-R149 PolarHBondContact OE2-NE 3.23Å; E130-R149 VanDerWaalsContact OE2-NE 3.13Å; E130-R149 IonicContact OE2-NH2 3.72Å; E130-R149 PolarHBondContact OE2-NH2 3.5Å
131	E	98.6	Very high	97.6	Very high	86 Å²	86	76.1 Å²	76.1	40%	0.402	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	145.9	178.5	-168.3	-176.2	170.7	0	0	110.9	I129 V134 R136 L146 Y147	I129-E131 WeakPolarHBondContact CG2-O 3.26Å; E131-V134 HydrophobicContact CG-CG1 4.13Å; E131-V134 HydrophobicContact CG-CG2 4.15Å; E131-R136 IonicContact OE1-CZ 3.42Å; E131-R136 IonicContact OE1-NH1 3.87Å; E131-R136 IonicContact OE1-NH2 3.7Å; E131-R136 PolarHBondContact OE1-NH2 2.96Å; E131-R136 IonicContact OE2-NH2 2.9Å; E131-R136 PolarHBondContact OE2-NH2 2.95Å; E131-L146 CarbonylContact O-C 3.55Å; E131-L146 WeakPolarHBondContact O-CA 3.34Å; E131-Y147 HydrophobicContact CB-CD2 3.99Å; E131-Y147 HydrophobicContact CB-CG 4.47Å; E131-Y147 PolarHBondContact O-N 3.28Å
132	G	96.9	Very high	97.5	Very high	31 Å²	31	76.5 Å²	76.5	32%	0.32	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	124.6	168.3	169.5	0	0	0	0	0	114.6
133	P	97.4	Very high	97.4	Very high	95 Å²	95	76.6 Å²	76.6	62%	0.617	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	cis	-71.9	132.5	1.6	28.9	-34.4	0	0	0	112.8	T144 S145 L146	P133-T144 HydrophobicContact CB-CG2 3.85Å; P133-S145 WeakPolarHBondContact CA-O 3.45Å; P133-L146 HydrophobicContact CB-CD2 4.2Å
134	V	98.1	Very high	97.5	Very high	37 Å²	37	69.6 Å²	69.6	22%	0.224	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	150.5	-179.2	-73.4	0	0	0	0	111.7	E131 T144 S145 Y147	E131-V134 HydrophobicContact CG-CG1 4.13Å; E131-V134 HydrophobicContact CG-CG2 4.15Å; V134-T144 CarbonylContact O-C 3.57Å; V134-T144 WeakPolarHBondContact O-CA 3.4Å; V134-S145 PolarHBondContact N-O 3.38Å; V134-S145 PolarHBondContact O-N 3.17Å; V134-Y147 HydrophobicContact CG2-CD2 4.36Å; V134-Y147 HydrophobicContact CG2-CE2 3.95Å
135	Q	97.7	Very high	97.5	Very high	116 Å²	116	63.7 Å²	63.7	54%	0.542	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	139.5	175.8	-67.1	-61.7	-41.3	0	0	111.3	I143 T144	Q135-I143 PolarHBondContact OE1-O 3.01Å; Q135-T144 PolarHBondContact NE2-OG1 3Å
136	R	97.6	Very high	97.5	Very high	80 Å²	80	61.4 Å²	61.4	30%	0.302	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	166	178	-66.2	-66.3	-175.8	-95	4.5	111	E131 P142 I143 Y147	E131-R136 IonicContact OE1-CZ 3.42Å; E131-R136 IonicContact OE1-NH1 3.87Å; E131-R136 IonicContact OE1-NH2 3.7Å; E131-R136 PolarHBondContact OE1-NH2 2.96Å; E131-R136 IonicContact OE2-NH2 2.9Å; E131-R136 PolarHBondContact OE2-NH2 2.95Å; R136-P142 WeakPolarHBondContact O-CA 3.3Å; R136-I143 HydrophobicContact CB-CD1 4.32Å; R136-I143 HydrophobicContact CB-CG1 3.82Å; R136-I143 PolarHBondContact N-O 2.95Å; R136-I143 PolarHBondContact O-N 2.84Å; R136-Y147 WeakPolarHBondContact CD-OH 3.4Å; R136-Y147 HydrophobicContact CG-CE2 4.39Å; R136-Y147 WeakPolarHBondContact CG-OH 3.33Å; R136-Y147 PolarHBondContact NE-OH 2.98Å
137	S	96.4	Very high	97.5	Very high	111 Å²	111	59.2 Å²	59.2	78%	0.776	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	105.2	175.7	-60.7	0	0	0	0	109.6
138	G	96.5	Very high	97.5	Very high	16 Å²	16	58.3 Å²	58.3	17%	0.165	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	172.5	171.5	0	0	0	0	0	112.3	V140 G141	G138-V140 VanDerWaalsContact C-N 3.27Å; G138-V140 PolarHBondContact O-N 2.83Å; G138-G141 CarbonylContact C-O 3.59Å; G138-G141 WeakPolarHBondContact CA-O 3.12Å; G138-G141 PolarHBondContact N-O 2.89Å
139	A	95	Very high	97.6	Very high	69 Å²	69	54.9 Å²	54.9	57%	0.57	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-29.1	-176.1	0	0	0	0	0	114.1	Y161	A139-Y161 PolarHBondContact N-OH 3.21Å
140	V	94.9	Very high	97.6	Very high	113 Å²	113	52.4 Å²	52.4	69%	0.685	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.1	12.3	-179.7	-58.7	0	0	0	0	113.7	G138 Y161	G138-V140 VanDerWaalsContact C-N 3.27Å; G138-V140 PolarHBondContact O-N 2.83Å; V140-Y161 HydrophobicContact CG2-CD1 4.36Å; V140-Y161 HydrophobicContact CG2-CE1 3.54Å; V140-Y161 HydrophobicContact CG2-CE2 4.17Å; V140-Y161 VanDerWaalsContact CG2-CZ 3.44Å; V140-Y161 WeakPolarHBondContact CG2-OH 2.95Å; V140-Y161 PolarHBondContact N-OH 3.45Å
141	G	94.8	Very high	97.6	Very high	14 Å²	14	50.3 Å²	50.3	14%	0.144	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.2	-179.8	-179.7	0	0	0	0	0	113.5	G138	G138-G141 CarbonylContact C-O 3.59Å; G138-G141 WeakPolarHBondContact CA-O 3.12Å; G138-G141 PolarHBondContact N-O 2.89Å
142	P	96.2	Very high	97.6	Very high	87 Å²	87	46.5 Å²	46.5	57%	0.565	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.9	139.7	177.9	-21.5	33.4	0	0	0	112.4	R136	R136-P142 WeakPolarHBondContact O-CA 3.3Å
143	I	98.2	Very high	97.7	Very high	3 Å²	3	50.6 Å²	50.6	2%	0.015	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	153.7	174.2	61.7	-177	0	0	0	109.5	I110 Q135 R136 N160 Y161	I110-I143 HydrophobicContact CD1-CG2 4.32Å; Q135-I143 PolarHBondContact OE1-O 3.01Å; R136-I143 HydrophobicContact CB-CD1 4.32Å; R136-I143 HydrophobicContact CB-CG1 3.82Å; R136-I143 PolarHBondContact N-O 2.95Å; R136-I143 PolarHBondContact O-N 2.84Å; I143-N160 WeakPolarHBondContact CA-O 3.28Å; I143-N160 WeakPolarHBondContact CB-O 3.47Å; I143-Y161 HydrophobicContact CG2-CD1 3.39Å; I143-Y161 HydrophobicContact CG2-CD2 4.18Å; I143-Y161 HydrophobicContact CG2-CE1 3.35Å; I143-Y161 HydrophobicContact CG2-CE2 4.16Å; I143-Y161 HydrophobicContact CG2-CG 3.81Å
144	T	98.5	Very high	97.7	Very high	29 Å²	29	46.1 Å²	46.1	18%	0.178	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	140.3	165.9	-49	0	0	0	0	108	L115 P133 V134 Q135 S159 N160	L115-T144 VanDerWaalsContact CD1-C 3.42Å; L115-T144 HydrophobicContact CD1-CG2 3.66Å; L115-T144 WeakPolarHBondContact CD1-O 3.03Å; P133-T144 HydrophobicContact CB-CG2 3.85Å; V134-T144 CarbonylContact O-C 3.57Å; V134-T144 WeakPolarHBondContact O-CA 3.4Å; Q135-T144 PolarHBondContact NE2-OG1 3Å; T144-S159 CarbonylContact O-C 3.56Å; T144-S159 WeakPolarHBondContact O-CA 3.3Å; T144-S159 WeakPolarHBondContact O-CB 3.4Å; T144-N160 PolarHBondContact N-O 3.25Å; T144-N160 PolarHBondContact O-N 2.89Å
145	S	98.8	Very high	97.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	149.3	-167.6	-56.7	0	0	0	0	113.8	P133 V134 E157 V158 S159	P133-S145 WeakPolarHBondContact CA-O 3.45Å; V134-S145 PolarHBondContact N-O 3.38Å; V134-S145 PolarHBondContact O-N 3.17Å; S145-E157 WeakPolarHBondContact CB-OE1 3.17Å; S145-E157 PolarHBondContact OG-OE1 3.25Å; S145-V158 WeakPolarHBondContact CA-O 3.33Å; S145-S159 WeakPolarHBondContact CB-OG 3.35Å; S145-S159 PolarHBondContact OG-OG 3.41Å
146	L	98.9	Very high	97.8	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	141.3	164.7	-62.5	173.5	0	0	0	109.2	L115 V118 A119 L122 I129 E131 P133 E157 V158	L115-L146 HydrophobicContact CB-CD1 4.26Å; L115-L146 HydrophobicContact CB-CG 4.49Å; L115-L146 HydrophobicContact CD1-CG 4.49Å; L115-L146 HydrophobicContact CD2-CD1 4.17Å; L115-L146 HydrophobicContact CD2-CG 4.23Å; V118-L146 HydrophobicContact CB-CD1 4.2Å; V118-L146 HydrophobicContact CG1-CD1 4.03Å; A119-L146 HydrophobicContact CB-CD1 3.85Å; L122-L146 HydrophobicContact CD1-CD1 4.44Å; I129-L146 HydrophobicContact CG2-CD2 4.19Å; E131-L146 CarbonylContact O-C 3.55Å; E131-L146 WeakPolarHBondContact O-CA 3.34Å; P133-L146 HydrophobicContact CB-CD2 4.2Å; L146-E157 CarbonylContact O-C 3.51Å; L146-E157 WeakPolarHBondContact O-CA 3.5Å; L146-V158 PolarHBondContact N-O 3.41Å; L146-V158 PolarHBondContact O-N 3.38Å
147	Y	98.9	Very high	97.9	Very high	22 Å²	22	37.4 Å²	37.4	9%	0.086	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	137.6	-179.9	-67.3	-90	0	0	0	111.1	I129 E130 E131 V134 R136 L155 I156 E157	I129-Y147 CarbonylContact C-O 3.43Å; I129-Y147 WeakPolarHBondContact CA-O 3.34Å; E130-Y147 PolarHBondContact N-O 2.82Å; E131-Y147 HydrophobicContact CB-CD2 3.99Å; E131-Y147 HydrophobicContact CB-CG 4.47Å; E131-Y147 PolarHBondContact O-N 3.28Å; V134-Y147 HydrophobicContact CG2-CD2 4.36Å; V134-Y147 HydrophobicContact CG2-CE2 3.95Å; R136-Y147 WeakPolarHBondContact CD-OH 3.4Å; R136-Y147 HydrophobicContact CG-CE2 4.39Å; R136-Y147 WeakPolarHBondContact CG-OH 3.33Å; R136-Y147 PolarHBondContact NE-OH 2.98Å; Y147-L155 HydrophobicContact CD1-CD1 3.94Å; Y147-L155 HydrophobicContact CD1-CD2 4.16Å; Y147-L155 HydrophobicContact CD1-CG 4.09Å; Y147-L155 HydrophobicContact CE1-CD2 4.47Å; Y147-I156 WeakPolarHBondContact CA-O 3.08Å; Y147-E157 HydrophobicContact CD1-CB 3.76Å; Y147-E157 HydrophobicContact CD1-CG 4.01Å; Y147-E157 HydrophobicContact CE1-CB 3.5Å; Y147-E157 VanDerWaalsContact CE1-CB 3.5Å; Y147-E157 HydrophobicContact CE1-CG 3.48Å; Y147-E157 VanDerWaalsContact CE1-CG 3.48Å; Y147-E157 VanDerWaalsContact CE1-OE2 3.25Å; Y147-E157 WeakPolarHBondContact CE1-OE2 3.42Å; Y147-E157 HydrophobicContact CE2-CG 4.23Å; Y147-E157 VanDerWaalsContact CZ-OE2 3.32Å; Y147-E157 PolarHBondContact OH-OE1 3.11Å; Y147-E157 PolarHBondContact OH-OE2 3.08Å
148	F	98.9	Very high	98	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	174.6	175	56.4	-86.9	0	0	0	110.7	F58 V62 L63 L122 V127 E128 I156 V158	F58-F148 HydrophobicContact CE1-CE2 4.23Å; F58-F148 HydrophobicContact CZ-CD2 4.09Å; F58-F148 AromaticContact CZ-CE2 3.98Å; F58-F148 HydrophobicContact CZ-CE2 3.98Å; V62-F148 HydrophobicContact CG1-CE2 4.2Å; L63-F148 HydrophobicContact CD1-CZ 4.34Å; L63-F148 HydrophobicContact CD2-CZ 4.06Å; L63-F148 HydrophobicContact CG-CZ 4.49Å; L122-F148 HydrophobicContact CD1-CD1 3.65Å; L122-F148 HydrophobicContact CD1-CE1 3.86Å; L122-F148 HydrophobicContact CD1-CG 4.33Å; L122-F148 HydrophobicContact CD2-CD1 4.38Å; L122-F148 HydrophobicContact CD2-CE1 4.19Å; L122-F148 HydrophobicContact CD2-CE2 4.44Å; L122-F148 HydrophobicContact CD2-CZ 4.24Å; V127-F148 HydrophobicContact CG1-CB 3.75Å; V127-F148 HydrophobicContact CG1-CD2 3.74Å; V127-F148 HydrophobicContact CG1-CG 3.89Å; E128-F148 WeakPolarHBondContact O-CB 3.43Å; F148-I156 HydrophobicContact CD2-CB 4.13Å; F148-I156 HydrophobicContact CE1-CB 4.48Å; F148-I156 HydrophobicContact CE1-CG2 4.21Å; F148-I156 HydrophobicContact CE2-CB 3.73Å; F148-I156 HydrophobicContact CE2-CG1 4.32Å; F148-I156 HydrophobicContact CE2-CG2 3.75Å; F148-I156 HydrophobicContact CZ-CB 3.91Å; F148-I156 HydrophobicContact CZ-CG2 3.51Å; F148-I156 PolarHBondContact N-O 3.28Å; F148-I156 PolarHBondContact O-N 3.23Å; F148-V158 HydrophobicContact CE1-CB 4.24Å; F148-V158 HydrophobicContact CE1-CG2 3.65Å; F148-V158 HydrophobicContact CZ-CG2 3.75Å
149	R	98.9	Very high	98.1	Very high	87 Å²	87	31.6 Å²	31.6	33%	0.328	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	143.5	179.4	-62.8	-69.5	173	-174.2	-15.6	112	F58 E130 H153 N154	F58-R149 WeakPolarHBondContact CZ-O 3.14Å; E130-R149 VanDerWaalsContact CD-NE 3.31Å; E130-R149 WeakPolarHBondContact OE1-CD 3.13Å; E130-R149 WeakPolarHBondContact OE1-CG 3.05Å; E130-R149 IonicContact OE1-CZ 2.93Å; E130-R149 IonicContact OE1-NE 2.78Å; E130-R149 PolarHBondContact OE1-NE 3.27Å; E130-R149 IonicContact OE1-NH2 2.71Å; E130-R149 IonicContact OE2-CZ 3.69Å; E130-R149 IonicContact OE2-NE 3.13Å; E130-R149 PolarHBondContact OE2-NE 3.23Å; E130-R149 VanDerWaalsContact OE2-NE 3.13Å; E130-R149 IonicContact OE2-NH2 3.72Å; E130-R149 PolarHBondContact OE2-NH2 3.5Å; R149-H153 WeakPolarHBondContact CD-O 3.24Å; R149-H153 PolarHBondContact NH1-O 3.36Å; R149-N154 WeakPolarHBondContact CA-O 3.21Å
150	D	98.9	Very high	98.3	Very high	5 Å²	5	29.8 Å²	29.8	3%	0.027	16%	0.163	C	C	.	.			trans	-84.5	177.8	162.2	86.6	-8.6	0	0	0	111.3	F58 Y59 D152 H153 N154 I156	F58-D150 HydrophobicContact CD1-CB 4.04Å; F58-D150 HydrophobicContact CE1-CB 3.7Å; F58-D150 HydrophobicContact CZ-CB 4.16Å; Y59-D150 HydrophobicContact CE2-CB 3.92Å; Y59-D150 WeakPolarHBondContact CE2-OD2 3.25Å; Y59-D150 WeakPolarHBondContact OH-CB 3.49Å; Y59-D150 PolarHBondContact OH-OD2 3.43Å; D150-D152 PolarHBondContact O-N 3.19Å; D150-D152 VanDerWaalsContact O-N 3.1Å; D150-D152 WeakPolarHBondContact OD1-CA 3.14Å; D150-D152 PolarHBondContact OD1-N 3.41Å; D150-H153 PolarHBondContact O-N 3.31Å; D150-H153 PolarHBondContact OD1-N 3.44Å; D150-H153 VanDerWaalsContact OD1-N 3.11Å; D150-N154 PolarHBondContact N-O 3.35Å; D150-N154 WeakPolarHBondContact OD1-CB 3.22Å; D150-N154 PolarHBondContact OD1-N 2.85Å; D150-N154 PolarHBondContact OD1-ND2 3.02Å; D150-N154 PolarHBondContact OD2-ND2 3.48Å; D150-I156 HydrophobicContact CB-CG1 4.11Å
151	P	98.8	Very high	98.4	Very high	53 Å²	53	28.2 Å²	28.2	34%	0.344	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-20.8	-177.4	-25.7	36	0	0	0	115	F58	F58-P151 HydrophobicContact CB-CG 3.57Å; F58-P151 HydrophobicContact CD1-CG 4.49Å; F58-P151 HydrophobicContact CD2-CG 3.9Å; F58-P151 VanDerWaalsContact CG-CD 3.48Å; F58-P151 HydrophobicContact CG-CG 3.75Å
152	D	98.8	Very high	97.8	Very high	6 Å²	6	30.8 Å²	30.8	3%	0.032	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	0.9	179.3	-75.5	-87.8	0	0	0	112.2	V49 K50 S102 G103 D150 N154	V49-D152 WeakPolarHBondContact CB-OD2 3.3Å; K50-D152 WeakPolarHBondContact CB-OD1 3.44Å; K50-D152 VanDerWaalsContact CG-OD1 3.28Å; K50-D152 WeakPolarHBondContact CG-OD1 3.23Å; K50-D152 PolarHBondContact N-OD1 2.91Å; S102-D152 WeakPolarHBondContact CB-OD1 3.46Å; S102-D152 WeakPolarHBondContact OG-CB 3.41Å; S102-D152 PolarHBondContact OG-OD1 2.86Å; G103-D152 WeakPolarHBondContact CA-O 3.5Å; D150-D152 PolarHBondContact O-N 3.19Å; D150-D152 VanDerWaalsContact O-N 3.1Å; D150-D152 WeakPolarHBondContact OD1-CA 3.14Å; D150-D152 PolarHBondContact OD1-N 3.41Å; D152-N154 VanDerWaalsContact C-N 3.31Å
153	H	98.7	Very high	96.3	Very high	117 Å²	117	35.5 Å²	35.5	54%	0.542	18%	0.175	S	C	.	.			trans	67.3	22.8	-173.6	-54.7	-78.5	0	0	0	115.2	R149 D150	R149-H153 WeakPolarHBondContact CD-O 3.24Å; R149-H153 PolarHBondContact NH1-O 3.36Å; D150-H153 PolarHBondContact O-N 3.31Å; D150-H153 PolarHBondContact OD1-N 3.44Å; D150-H153 VanDerWaalsContact OD1-N 3.11Å
154	N	98.9	Very high	94.2	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.011	21%	0.211	C	C	.	.			trans	-59	142.1	163.3	-59.9	-59.1	0	0	0	108.8	G103 S104 A105 R149 D150 D152 I156	G103-N154 WeakPolarHBondContact CA-OD1 3.37Å; G103-N154 PolarHBondContact N-OD1 3.03Å; S104-N154 PolarHBondContact N-OD1 3.33Å; A105-N154 HydrophobicContact CB-CB 4.09Å; A105-N154 WeakPolarHBondContact CB-OD1 3.29Å; A105-N154 PolarHBondContact N-OD1 2.85Å; A105-N154 CarbonylContact O-C 3.47Å; A105-N154 WeakPolarHBondContact O-CA 3.42Å; A105-N154 WeakPolarHBondContact O-CB 3.23Å; R149-N154 WeakPolarHBondContact CA-O 3.21Å; D150-N154 PolarHBondContact N-O 3.35Å; D150-N154 WeakPolarHBondContact OD1-CB 3.22Å; D150-N154 PolarHBondContact OD1-N 2.85Å; D150-N154 PolarHBondContact OD1-ND2 3.02Å; D150-N154 PolarHBondContact OD2-ND2 3.48Å; D152-N154 VanDerWaalsContact C-N 3.31Å; N154-I156 HydrophobicContact CB-CD1 4.13Å; N154-I156 PolarHBondContact O-N 2.8Å
155	L	98.9	Very high	91.6	Very high	31 Å²	31	43 Å²	43	16%	0.162	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	119.3	174.4	-175.9	57.2	0	0	0	108.7	A105 D106 L107 Y147	A105-L155 PolarHBondContact O-N 2.9Å; D106-L155 WeakPolarHBondContact CA-O 3.45Å; D106-L155 HydrophobicContact CB-CB 4.36Å; L107-L155 PolarHBondContact N-O 2.9Å; Y147-L155 HydrophobicContact CD1-CD1 3.94Å; Y147-L155 HydrophobicContact CD1-CD2 4.16Å; Y147-L155 HydrophobicContact CD1-CG 4.09Å; Y147-L155 HydrophobicContact CE1-CD2 4.47Å
156	I	98.9	Very high	89	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	118.2	178.7	-49.9	-57.6	0	0	0	108.5	Y59 L63 L107 L109 Y147 F148 D150 N154 V158	Y59-I156 HydrophobicContact CE1-CD1 4.44Å; Y59-I156 WeakPolarHBondContact OH-CD1 3.33Å; L63-I156 HydrophobicContact CD1-CG2 4.22Å; L107-I156 HydrophobicContact CB-CD1 4.4Å; L107-I156 HydrophobicContact CD1-CD1 4.38Å; L109-I156 HydrophobicContact CD1-CG2 4.36Å; Y147-I156 WeakPolarHBondContact CA-O 3.08Å; F148-I156 HydrophobicContact CD2-CB 4.13Å; F148-I156 HydrophobicContact CE1-CB 4.48Å; F148-I156 HydrophobicContact CE1-CG2 4.21Å; F148-I156 HydrophobicContact CE2-CB 3.73Å; F148-I156 HydrophobicContact CE2-CG1 4.32Å; F148-I156 HydrophobicContact CE2-CG2 3.75Å; F148-I156 HydrophobicContact CZ-CB 3.91Å; F148-I156 HydrophobicContact CZ-CG2 3.51Å; F148-I156 PolarHBondContact N-O 3.28Å; F148-I156 PolarHBondContact O-N 3.23Å; D150-I156 HydrophobicContact CB-CG1 4.11Å; N154-I156 HydrophobicContact CB-CD1 4.13Å; N154-I156 PolarHBondContact O-N 2.8Å; I156-V158 HydrophobicContact CG2-CG2 4.31Å
157	E	98.9	Very high	86.7	Confident	19 Å²	19	56.1 Å²	56.1	9%	0.089	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	123.7	172.3	-177.3	-175.2	163.8	0	0	108.7	L107 C108 L109 S145 L146 Y147 S159	L107-E157 PolarHBondContact O-N 3.24Å; C108-E157 CarbonylContact C-O 3.56Å; C108-E157 WeakPolarHBondContact CA-O 3.34Å; C108-E157 HydrophobicContact CB-CB 4.15Å; C108-E157 HydrophobicContact CB-CG 4.32Å; L109-E157 PolarHBondContact N-O 3.48Å; S145-E157 WeakPolarHBondContact CB-OE1 3.17Å; S145-E157 PolarHBondContact OG-OE1 3.25Å; L146-E157 CarbonylContact O-C 3.51Å; L146-E157 WeakPolarHBondContact O-CA 3.5Å; Y147-E157 HydrophobicContact CD1-CB 3.76Å; Y147-E157 HydrophobicContact CD1-CG 4.01Å; Y147-E157 HydrophobicContact CE1-CB 3.5Å; Y147-E157 VanDerWaalsContact CE1-CB 3.5Å; Y147-E157 HydrophobicContact CE1-CG 3.48Å; Y147-E157 VanDerWaalsContact CE1-CG 3.48Å; Y147-E157 VanDerWaalsContact CE1-OE2 3.25Å; Y147-E157 WeakPolarHBondContact CE1-OE2 3.42Å; Y147-E157 HydrophobicContact CE2-CG 4.23Å; Y147-E157 VanDerWaalsContact CZ-OE2 3.32Å; Y147-E157 PolarHBondContact OH-OE1 3.11Å; Y147-E157 PolarHBondContact OH-OE2 3.08Å; E157-S159 PolarHBondContact OE1-OG 2.91Å
158	V	98.8	Very high	84.4	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.024	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	130.3	172	175.3	0	0	0	0	109.4	L63 L109 T111 L115 V118 S145 L146 F148 I156	L63-V158 HydrophobicContact CD2-CG2 3.86Å; L109-V158 WeakPolarHBondContact O-CA 3.48Å; T111-V158 HydrophobicContact CG2-CG1 3.41Å; T111-V158 VanDerWaalsContact CG2-CG1 3.41Å; L115-V158 HydrophobicContact CD2-CG1 4.34Å; L115-V158 WeakPolarHBondContact CD2-O 3.21Å; V118-V158 HydrophobicContact CG1-CG1 4.15Å; S145-V158 WeakPolarHBondContact CA-O 3.33Å; L146-V158 PolarHBondContact N-O 3.41Å; L146-V158 PolarHBondContact O-N 3.38Å; F148-V158 HydrophobicContact CE1-CB 4.24Å; F148-V158 HydrophobicContact CE1-CG2 3.65Å; F148-V158 HydrophobicContact CZ-CG2 3.75Å; I156-V158 HydrophobicContact CG2-CG2 4.31Å
159	S	98.8	Very high	81.7	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	154.1	-167.6	-46.6	0	0	0	0	114.1	L109 I110 T111 T144 S145 E157	L109-S159 PolarHBondContact O-N 2.84Å; I110-S159 WeakPolarHBondContact CA-O 3.38Å; T111-S159 PolarHBondContact N-O 3.08Å; T144-S159 CarbonylContact O-C 3.56Å; T144-S159 WeakPolarHBondContact O-CA 3.3Å; T144-S159 WeakPolarHBondContact O-CB 3.4Å; S145-S159 WeakPolarHBondContact CB-OG 3.35Å; S145-S159 PolarHBondContact OG-OG 3.41Å; E157-S159 PolarHBondContact OE1-OG 2.91Å
160	N	98.4	Very high	78.9	Confident	32 Å²	32	69.2 Å²	69.2	17%	0.171	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	141.9	162.4	-62.1	144.4	0	0	0	109.4	T111 T113 P114 L115 I143 T144	T111-N160 WeakPolarHBondContact CG2-ND2 3.15Å; T111-N160 PolarHBondContact O-ND2 3.42Å; T113-N160 PolarHBondContact O-ND2 2.71Å; T113-N160 PolarHBondContact O-OD1 3.33Å; P114-N160 WeakPolarHBondContact CA-OD1 3.17Å; L115-N160 WeakPolarHBondContact CG-OD1 3.34Å; L115-N160 PolarHBondContact N-OD1 2.81Å; I143-N160 WeakPolarHBondContact CA-O 3.28Å; I143-N160 WeakPolarHBondContact CB-O 3.47Å; T144-N160 PolarHBondContact N-O 3.25Å; T144-N160 PolarHBondContact O-N 2.89Å
161	Y	97.3	Very high	77.9	Confident	79 Å²	79	72.5 Å²	72.5	31%	0.31	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	135.4	158.4	-79.1	-78.9	0	0	0	109	I110 A139 V140 I143 Q163	I110-Y161 HydrophobicContact CD1-CD2 4.22Å; I110-Y161 HydrophobicContact CD1-CE2 3.77Å; I110-Y161 HydrophobicContact CG1-CD2 4.39Å; I110-Y161 HydrophobicContact CG1-CE2 3.84Å; I110-Y161 HydrophobicContact CG2-CD2 3.96Å; I110-Y161 HydrophobicContact CG2-CE2 4.23Å; A139-Y161 PolarHBondContact N-OH 3.21Å; V140-Y161 HydrophobicContact CG2-CD1 4.36Å; V140-Y161 HydrophobicContact CG2-CE1 3.54Å; V140-Y161 HydrophobicContact CG2-CE2 4.17Å; V140-Y161 VanDerWaalsContact CG2-CZ 3.44Å; V140-Y161 WeakPolarHBondContact CG2-OH 2.95Å; V140-Y161 PolarHBondContact N-OH 3.45Å; I143-Y161 HydrophobicContact CG2-CD1 3.39Å; I143-Y161 HydrophobicContact CG2-CD2 4.18Å; I143-Y161 HydrophobicContact CG2-CE1 3.35Å; I143-Y161 HydrophobicContact CG2-CE2 4.16Å; I143-Y161 HydrophobicContact CG2-CG 3.81Å; Y161-Q163 PolarHBondContact O-N 2.86Å
162	S	82.1	Confident	76.8	Confident	69 Å²	69	73.5 Å²	73.5	48%	0.483	46%	0.458	S	S	.	.			trans	-62.4	119.7	169.7	-60	0	0	0	0	108.1	S164	S162-S164 PolarHBondContact O-N 3.36Å; S162-S164 VanDerWaalsContact O-N 3.08Å
163	Q	65.8	Low	75.6	Confident	185 Å²	185	77.2 Å²	77.2	86%	0.864	48%	0.481	S	S	*	.			trans	-63.9	113.7	166	-71.6	-177.4	9.9	0	0	106.4	Y161 A165	Y161-Q163 PolarHBondContact O-N 2.86Å; Q163-A165 PolarHBondContact O-N 3.42Å
164	S	53.4	Low	74.2	Confident	110 Å²	110	74.9 Å²	74.9	77%	0.769	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-57	123	159.1	47.9	0	0	0	0	105.9	S162	S162-S164 PolarHBondContact O-N 3.36Å; S162-S164 VanDerWaalsContact O-N 3.08Å
165	A	43.2	Very low	72.7	Confident	80 Å²	80	79.4 Å²	79.4	66%	0.661	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-48.3	136.7	174.2	0	0	0	0	0	108.1	Q163 D167	Q163-A165 PolarHBondContact O-N 3.42Å; A165-D167 PolarHBondContact O-N 3.38Å; A165-D167 VanDerWaalsContact O-N 3.07Å
166	P	44.9	Very low	70.9	Confident	119 Å²	119	82.7 Å²	82.7	77%	0.773	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-56.2	123.9	173.3	23.2	-30.4	0	0	0	107	G168	P166-G168 PolarHBondContact O-N 3.31Å
167	D	51.3	Low	68.9	Low	158 Å²	158	88.6 Å²	88.6	85%	0.845	57%	0.568	S	S	*	*			trans	-50.9	113.4	172	-83.1	-31.2	0	0	0	107	A165 S169	A165-D167 PolarHBondContact O-N 3.38Å; A165-D167 VanDerWaalsContact O-N 3.07Å; D167-S169 PolarHBondContact O-N 3.15Å
168	G	48.9	Very low	66.6	Low	80 Å²	80	93.9 Å²	93.9	83%	0.825	60%	0.604	S	S	*	*			trans	-66.5	86.2	178.3	0	0	0	0	0	109.2	P166 S170	P166-G168 PolarHBondContact O-N 3.31Å; G168-S170 PolarHBondContact O-N 2.89Å
169	S	42.5	Very low	63.9	Low	116 Å²	116	101.4 Å²	101.4	81%	0.811	65%	0.653	S	S	*	*			trans	-92.2	83.8	160.7	64	0	0	0	0	108.1	D167	D167-S169 PolarHBondContact O-N 3.15Å
170	S	40.5	Very low	60.8	Low	189 Å²	189	110.6 Å²	110.6	100%	1.322	71%	0.712	S	S	*	*			trans	-72.4	0	150.7	49.8	0	0	0	0	110.4	G168	G168-S170 PolarHBondContact O-N 2.89Å

Retrieved 170 of 170 residues in 43.4 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).