A0A087X410_POEFO Loading...

U6 snRNA-associated Sm-like protein LSm4

Binds specifically to the 3'-terminal U-tract of U6 snRNA. Plays a role in pre-mRNA splicing as component of the U4/U6-U5 tri-snRNP complex that is involved in spliceosome assembly, and as component of the precatalytic spliceosome (spliceosome B complex). The heptameric LSM2-8 complex binds specifically to the 3'-terminal U-tract of U6 snRNA.

AlphaFold DB , UniProt , Accession A0A087X410, Species POEFO (Poecilia formosa, Amazon molly), Gene LSM4, Length 188 aa.

Structure Viewer

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(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	45.3	Very low	49.7	Very low	135 Å²	135	87.5 Å²	87.5	67%	0.665	44%	0.439	S	S	*	.				0	95.3	0	-80.7	-167	-179.7	0	0	111.2	D118	M1-D118 PolarHBondContact N-OD1 3.28Å
2	H	56	Low	48.9	Very low	55 Å²	55	93.2 Å²	93.2	26%	0.255	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	136.7	176.1	-67.2	-99.6	0	0	0	109.9	I13 I116 D118 I121	H2-I13 HydrophobicContact CB-CG2 4.41Å; H2-I116 PolarHBondContact O-N 2.9Å; H2-D118 IonicContact CD2-OD1 3.58Å; H2-I121 HydrophobicContact CB-CD1 3.85Å; H2-I121 WeakPolarHBondContact CD2-CD1 3.22Å; H2-I121 VanDerWaalsContact CG-CD1 3.42Å
3	V	54.2	Low	48.6	Very low	36 Å²	36	89.7 Å²	89.7	22%	0.218	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122	-174.8	178.3	0	0	0	0	109.5	Y113 L114	V3-Y113 HydrophobicContact CG1-CD1 4.12Å; V3-Y113 HydrophobicContact CG1-CD2 3.47Å; V3-Y113 VanDerWaalsContact CG1-CD2 3.47Å; V3-Y113 HydrophobicContact CG1-CE2 4.24Å; V3-Y113 HydrophobicContact CG1-CG 3.39Å; V3-Y113 HydrophobicContact CG2-CD2 4.45Å; V3-L114 WeakPolarHBondContact CA-O 3.23Å
4	F	64.6	Low	48	Very low	17 Å²	17	97.3 Å²	97.3	8%	0.075	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	121.6	179.5	-165.7	-86.6	0	0	0	111.2	Y11 P48 M81 Y113 L114 I116	F4-Y11 HydrophobicContact CE2-CG 4.44Å; F4-P48 HydrophobicContact CD2-CB 4.4Å; F4-P48 HydrophobicContact CE1-CB 3.71Å; F4-P48 HydrophobicContact CE1-CG 4.17Å; F4-P48 HydrophobicContact CE2-CB 3.45Å; F4-P48 VanDerWaalsContact CE2-CB 3.45Å; F4-P48 HydrophobicContact CE2-CG 3.44Å; F4-P48 VanDerWaalsContact CE2-CG 3.44Å; F4-P48 HydrophobicContact CZ-CB 3.1Å; F4-P48 HydrophobicContact CZ-CG 3.15Å; F4-M81 HydrophobicContact CD1-SD 4.38Å; F4-M81 HydrophobicContact CE1-SD 3.92Å; F4-Y113 CarbonylContact O-C 3.54Å; F4-Y113 WeakPolarHBondContact O-CA 3.29Å; F4-Y113 VanDerWaalsContact O-CB 3.25Å; F4-Y113 WeakPolarHBondContact O-CB 3.32Å; F4-L114 PolarHBondContact N-O 3.42Å; F4-L114 VanDerWaalsContact N-O 3.08Å; F4-L114 PolarHBondContact O-N 2.98Å; F4-I116 HydrophobicContact CB-CD1 4.38Å
5	S	59.2	Low	47.2	Very low	45 Å²	45	95 Å²	95	32%	0.315	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	140.1	-177.2	-168.9	0	0	0	0	113.9	K112	S5-K112 VanDerWaalsContact CA-O 3.3Å; S5-K112 WeakPolarHBondContact CA-O 3.25Å; S5-K112 WeakPolarHBondContact CB-O 3.23Å; S5-K112 PolarHBondContact OG-O 3.27Å
6	S	54	Low	46.6	Very low	23 Å²	23	92.5 Å²	92.5	16%	0.161	46%	0.462	C	S	.	.			trans	-81.9	-8.8	-175.1	73	0	0	0	0	115.5	G8 I111	S6-G8 PolarHBondContact O-N 2.95Å; S6-I111 PolarHBondContact OG-O 3.26Å
7	R	46.1	Very low	45.9	Very low	181 Å²	181	95.6 Å²	95.6	68%	0.683	48%	0.48	S	S	*	.	S	Bend	trans	-77.5	94	-174.8	-67	-166.9	-165.3	-166.7	3.2	111.2
8	G	42.5	Very low	45.4	Very low	57 Å²	57	98.2 Å²	98.2	59%	0.588	49%	0.494	S	S	*	.	S	Bend	trans	70	83.7	156.7	0	0	0	0	0	115.8	S6 H10	S6-G8 PolarHBondContact O-N 2.95Å; G8-H10 WeakPolarHBondContact O-CB 3.13Å; G8-H10 PolarHBondContact O-N 3.06Å
9	Q	40.4	Very low	45	Very low	191 Å²	191	105.4 Å²	105.4	89%	0.893	52%	0.515	S	S	*	.	S	Bend	trans	43.7	-0.5	162.1	-63.5	-76.4	21.2	0	0	119
10	H	36	Very low	44.7	Very low	150 Å²	150	111.9 Å²	111.9	69%	0.694	53%	0.533	S	S	*	.			trans	-119.2	87	-175.4	-123.8	-108.9	0	0	0	106.1	G8 K12	G8-H10 WeakPolarHBondContact O-CB 3.13Å; G8-H10 PolarHBondContact O-N 3.06Å; H10-K12 PolarHBondContact O-N 2.86Å
11	Y	48.5	Very low	44.3	Very low	73 Å²	73	117.4 Å²	117.4	29%	0.286	55%	0.549	S	S	.	.			trans	-64.4	104.5	175.8	42	-90.4	0	0	0	109.1	F4 I44 I45 P48	F4-Y11 HydrophobicContact CE2-CG 4.44Å; Y11-I44 HydrophobicContact CD2-CG2 3.7Å; Y11-I44 WeakPolarHBondContact CD2-O 3.46Å; Y11-I44 HydrophobicContact CE2-CG2 3.92Å; Y11-I44 WeakPolarHBondContact CE2-O 3.33Å; Y11-I45 WeakPolarHBondContact OH-CA 3.38Å; Y11-P48 HydrophobicContact CD1-CG 3.69Å; Y11-P48 HydrophobicContact CG-CG 4.06Å
12	K	40.6	Very low	44	Very low	155 Å²	155	122.4 Å²	122.4	67%	0.674	56%	0.561	S	S	*	*			trans	-96.4	96.7	167.2	-70	-175.6	-179.5	179.3	0	107.4	H10 W14	H10-K12 PolarHBondContact O-N 2.86Å; K12-W14 PolarHBondContact O-N 2.71Å; K12-W14 VanDerWaalsContact O-N 3.07Å
13	I	44.2	Very low	43.1	Very low	48 Å²	48	130.6 Å²	130.6	25%	0.246	59%	0.589	C	S	.	*			trans	-67.9	106.5	167.8	-63.2	-175.3	0	0	0	106.8	H2 S15 I44	H2-I13 HydrophobicContact CB-CG2 4.41Å; I13-S15 PolarHBondContact O-N 2.83Å; I13-I44 HydrophobicContact CB-CD1 4.3Å; I13-I44 HydrophobicContact CB-CG2 4.36Å; I13-I44 HydrophobicContact CD1-CB 3.99Å; I13-I44 HydrophobicContact CD1-CD1 4.05Å; I13-I44 HydrophobicContact CD1-CG1 3.71Å; I13-I44 HydrophobicContact CD1-CG2 3.59Å; I13-I44 HydrophobicContact CG1-CG2 3.87Å
14	W	39.9	Very low	42.2	Very low	196 Å²	196	134.3 Å²	134.3	74%	0.742	62%	0.616	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.4	100.8	164.8	-116.9	65.7	0	0	0	106.8	K12 A16	K12-W14 PolarHBondContact O-N 2.71Å; K12-W14 VanDerWaalsContact O-N 3.07Å; W14-A16 VanDerWaalsContact C-N 3.33Å; W14-A16 PolarHBondContact O-N 2.8Å
15	S	36.7	Very low	41.2	Very low	63 Å²	63	140 Å²	140	44%	0.441	65%	0.652	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-63.3	105.9	154.1	-82	0	0	0	0	105.7	I13 N17	I13-S15 PolarHBondContact O-N 2.83Å; S15-N17 PolarHBondContact O-N 2.99Å
16	A	37.7	Very low	40.4	Very low	55 Å²	55	141 Å²	141	46%	0.455	67%	0.67	S	S	.	*			trans	-63.1	85.6	166	0	0	0	0	0	106.8	W14 I18	W14-A16 VanDerWaalsContact C-N 3.33Å; W14-A16 PolarHBondContact O-N 2.8Å; A16-I18 PolarHBondContact O-N 3.16Å
17	N	33.9	Very low	40.1	Very low	145 Å²	145	143.6 Å²	143.6	78%	0.775	70%	0.7	S	S	*	*			trans	-69.2	90.1	172	-158.6	6.5	0	0	0	104.6	S15 R19	S15-N17 PolarHBondContact O-N 2.99Å; N17-R19 VanDerWaalsContact C-N 3.29Å; N17-R19 PolarHBondContact O-N 3.43Å
18	I	37.3	Very low	39.7	Very low	142 Å²	142	144.9 Å²	144.9	73%	0.728	71%	0.711	S	S	*	*			trans	-49.9	106.2	166	-73.3	171.9	0	0	0	104.5	A16 R20	A16-I18 PolarHBondContact O-N 3.16Å; I18-R20 PolarHBondContact O-N 3.24Å
19	R	37.8	Very low	39.6	Very low	235 Å²	235	148.2 Å²	148.2	89%	0.887	73%	0.725	S	S	*	*			trans	-62.8	85.8	-179	-174.2	-176.4	-76.7	178.2	-4.8	106.5	N17 R21	N17-R19 VanDerWaalsContact C-N 3.29Å; N17-R19 PolarHBondContact O-N 3.43Å; R19-R21 VanDerWaalsContact C-N 3.3Å; R19-R21 PolarHBondContact O-N 2.82Å
20	R	39.8	Very low	39.5	Very low	235 Å²	235	149.7 Å²	149.7	89%	0.887	72%	0.722	S	S	*	*			trans	-60.8	102.6	165.6	-92.9	-170.7	-171.1	147.5	3.6	105.8	I18 R22	I18-R20 PolarHBondContact O-N 3.24Å; R20-R22 PolarHBondContact O-N 3.27Å
21	R	36.4	Very low	39.8	Very low	228 Å²	228	148.4 Å²	148.4	86%	0.86	73%	0.725	S	S	*	*			trans	-46.7	106.6	173.4	-159.6	173.3	-177.8	170.3	0.1	107.6	R19 R23	R19-R21 VanDerWaalsContact C-N 3.3Å; R19-R21 PolarHBondContact O-N 2.82Å; R21-R23 PolarHBondContact O-N 2.72Å
22	R	38	Very low	39.5	Very low	241 Å²	241	151.4 Å²	151.4	91%	0.909	74%	0.744	S	S	*	*			trans	-71.3	92.7	178.2	-147.6	-178.5	-174.5	-171.7	0.6	106.6	R20 S24	R20-R22 PolarHBondContact O-N 3.27Å; R22-S24 PolarHBondContact O-N 3Å
23	R	36.4	Very low	39.4	Very low	227 Å²	227	152.2 Å²	152.2	86%	0.857	75%	0.75	S	S	*	*			trans	-74.6	105.8	157.8	-90	-172.7	178.5	175.4	0.1	106.1	R21 V25	R21-R23 PolarHBondContact O-N 2.72Å; R23-V25 PolarHBondContact O-N 2.72Å
24	S	36.8	Very low	39.2	Very low	113 Å²	113	159.1 Å²	159.1	79%	0.79	77%	0.773	S	S	*	*			trans	-68.7	117.5	165.6	-174.8	0	0	0	0	107.5	R22	R22-S24 PolarHBondContact O-N 3Å
25	V	42.8	Very low	39.4	Very low	137 Å²	137	161.2 Å²	161.2	83%	0.83	78%	0.781	S	S	*	*			trans	-125	109.7	157.8	-171.9	0	0	0	0	106	R23	R23-V25 PolarHBondContact O-N 2.72Å
26	G	42.9	Very low	39.6	Very low	67 Å²	67	167.5 Å²	167.5	69%	0.691	80%	0.795	S	S	*	*			trans	48.5	109.6	150.9	0	0	0	0	0	119.6
27	G	48	Very low	39.6	Very low	76 Å²	76	171.7 Å²	171.7	78%	0.784	81%	0.805	S	S	*	*				94	131.7	126.3	0	0	0	0	0	118.3
28	K	36.9	Very low	40	Very low	208 Å²	208	172.8 Å²	172.8	90%	0.904	81%	0.805	S	S	*	*			trans	83.3	89.6	165.9	-57.8	-177.2	179.5	179.2	0	116	R30	K28-R30 PolarHBondContact O-N 3.03Å
29	S	40.6	Very low	40.3	Very low	127 Å²	127	170.2 Å²	170.2	89%	0.888	79%	0.792	S	S	*	*			trans	-58.8	100.3	160.5	-60.4	0	0	0	0	110.5
30	R	38.1	Very low	40.9	Very low	223 Å²	223	165.7 Å²	165.7	84%	0.842	78%	0.781	S	S	*	*			trans	-106.2	109.2	158.7	-129	176.2	170.7	-171.5	-3.6	106.1	K28 I32	K28-R30 PolarHBondContact O-N 3.03Å; R30-I32 PolarHBondContact O-N 2.72Å
31	V	43.3	Very low	41.2	Very low	122 Å²	122	158.3 Å²	158.3	74%	0.739	76%	0.763	S	S	*	*			trans	-71.7	82.2	175.9	-177.9	0	0	0	0	107.7	H33	V31-H33 PolarHBondContact O-N 3.05Å
32	I	42.3	Very low	41.7	Very low	137 Å²	137	152.2 Å²	152.2	70%	0.703	75%	0.747	S	S	*	*			trans	-73	111.1	164.2	-56.2	173.8	0	0	0	104.6	R30 R34	R30-I32 PolarHBondContact O-N 2.72Å; I32-R34 PolarHBondContact O-N 2.52Å
33	H	37	Very low	42.4	Very low	171 Å²	171	142.1 Å²	142.1	79%	0.792	71%	0.711	S	S	*	*			trans	-61.2	83	167	-84.4	72.4	0	0	0	108	V31 R35	V31-H33 PolarHBondContact O-N 3.05Å; H33-R35 VanDerWaalsContact C-N 3.28Å; H33-R35 PolarHBondContact O-N 3.37Å
34	R	40.3	Very low	42.9	Very low	193 Å²	193	133.7 Å²	133.7	73%	0.728	68%	0.682	S	S	*	*			trans	-71.8	92.4	171.2	-170.1	-177.6	-95	-139.1	-2.8	105	I32 R36	I32-R34 PolarHBondContact O-N 2.52Å; R34-R36 HydrophobicContact CG-CB 4.28Å; R34-R36 PolarHBondContact O-N 3.05Å
35	R	44.1	Very low	43.4	Very low	241 Å²	241	133.2 Å²	133.2	91%	0.909	67%	0.67	S	S	*	*			trans	-56.6	81.3	153.3	-95.7	-175.5	178.7	173.3	0.2	106.2	H33 Q37	H33-R35 VanDerWaalsContact C-N 3.28Å; H33-R35 PolarHBondContact O-N 3.37Å; R35-Q37 VanDerWaalsContact C-N 3.26Å; R35-Q37 PolarHBondContact O-N 2.93Å
36	R	40.7	Very low	43.8	Very low	194 Å²	194	129.9 Å²	129.9	73%	0.732	65%	0.646	S	S	*	*			trans	-76.7	94.4	169.5	-158.2	176	-173.3	169.7	-1.6	103.4	R34 E38	R34-R36 HydrophobicContact CG-CB 4.28Å; R34-R36 PolarHBondContact O-N 3.05Å; R36-E38 PolarHBondContact O-N 2.71Å
37	Q	37.6	Very low	44.8	Very low	144 Å²	144	132.6 Å²	132.6	67%	0.673	64%	0.644	S	S	*	*			trans	-45.8	113.7	178.4	-86.7	179	-8.8	0	0	109.8	R35 I39	R35-Q37 VanDerWaalsContact C-N 3.26Å; R35-Q37 PolarHBondContact O-N 2.93Å; Q37-I39 HydrophobicContact CB-CB 4.26Å; Q37-I39 HydrophobicContact CB-CD1 3.88Å; Q37-I39 HydrophobicContact CB-CG1 3.84Å; Q37-I39 HydrophobicContact CG-CD1 3.81Å; Q37-I39 HydrophobicContact CG-CG1 4.25Å; Q37-I39 PolarHBondContact O-N 2.81Å; Q37-I39 VanDerWaalsContact OE1-CD1 3.27Å
38	E	42.4	Very low	45.9	Very low	167 Å²	167	130 Å²	130	78%	0.78	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	48.2	162.8	-117.3	167.4	-175	0	0	110.2	R36	R36-E38 PolarHBondContact O-N 2.71Å
39	I	44.4	Very low	47.8	Very low	89 Å²	89	122.3 Å²	122.3	46%	0.456	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.5	-18	176.4	-64.7	179.3	0	0	0	110.3	Q37 T41	Q37-I39 HydrophobicContact CB-CB 4.26Å; Q37-I39 HydrophobicContact CB-CD1 3.88Å; Q37-I39 HydrophobicContact CB-CG1 3.84Å; Q37-I39 HydrophobicContact CG-CD1 3.81Å; Q37-I39 HydrophobicContact CG-CG1 4.25Å; Q37-I39 PolarHBondContact O-N 2.81Å; Q37-I39 VanDerWaalsContact OE1-CD1 3.27Å; I39-T41 PolarHBondContact O-N 2.88Å
40	E	49.8	Very low	49.7	Very low	140 Å²	140	118.6 Å²	118.6	65%	0.654	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-18.8	-179.5	-72.7	-175.1	173.7	0	0	113.6	I44	E40-I44 WeakPolarHBondContact O-CD1 3.48Å; E40-I44 WeakPolarHBondContact O-CG1 3.49Å
41	T	47.3	Very low	51.8	Low	80 Å²	80	109.2 Å²	109.2	49%	0.491	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-23.1	-174.6	51.6	0	0	0	0	114.6	I39 I44	I39-T41 PolarHBondContact O-N 2.88Å; T41-I44 WeakPolarHBondContact O-CB 3.44Å; T41-I44 PolarHBondContact O-N 2.94Å
42	N	46.6	Very low	53.8	Low	100 Å²	100	103.5 Å²	103.5	54%	0.535	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-17.7	-177.4	-80	-37.4	0	0	0	114	I44 I45	N42-I44 VanDerWaalsContact C-N 3.35Å; N42-I45 WeakPolarHBondContact O-CG1 3.28Å; N42-I45 WeakPolarHBondContact OD1-CD1 3.39Å
43	I	51.5	Low	55.8	Low	29 Å²	29	102 Å²	102	15%	0.149	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-25.1	169.2	-51.8	134.1	0	0	0	110	I45 M46 V124 K125	I43-I45 VanDerWaalsContact C-N 3.32Å; I43-I45 PolarHBondContact O-N 2.95Å; I43-M46 WeakPolarHBondContact O-CB 3.09Å; I43-M46 PolarHBondContact O-N 3.45Å; I43-V124 HydrophobicContact CG2-CG1 4.05Å; I43-K125 HydrophobicContact CD1-CD 3.71Å; I43-K125 HydrophobicContact CD1-CG 3.24Å; I43-K125 HydrophobicContact CG1-CG 3.58Å
44	I	48.3	Very low	58.1	Low	49 Å²	49	95.5 Å²	95.5	25%	0.251	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-32.2	-175.4	-50.5	-169.6	0	0	0	110.6	Y11 I13 E40 T41 N42 M46	Y11-I44 HydrophobicContact CD2-CG2 3.7Å; Y11-I44 WeakPolarHBondContact CD2-O 3.46Å; Y11-I44 HydrophobicContact CE2-CG2 3.92Å; Y11-I44 WeakPolarHBondContact CE2-O 3.33Å; I13-I44 HydrophobicContact CB-CD1 4.3Å; I13-I44 HydrophobicContact CB-CG2 4.36Å; I13-I44 HydrophobicContact CD1-CB 3.99Å; I13-I44 HydrophobicContact CD1-CD1 4.05Å; I13-I44 HydrophobicContact CD1-CG1 3.71Å; I13-I44 HydrophobicContact CD1-CG2 3.59Å; I13-I44 HydrophobicContact CG1-CG2 3.87Å; E40-I44 WeakPolarHBondContact O-CD1 3.48Å; E40-I44 WeakPolarHBondContact O-CG1 3.49Å; T41-I44 WeakPolarHBondContact O-CB 3.44Å; T41-I44 PolarHBondContact O-N 2.94Å; N42-I44 VanDerWaalsContact C-N 3.35Å; I44-M46 PolarHBondContact O-N 3.07Å
45	I	45.6	Very low	60.3	Low	103 Å²	103	86.3 Å²	86.3	53%	0.528	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-2.1	170.6	48.8	177.7	0	0	0	113.8	Y11 N42 I43	Y11-I45 WeakPolarHBondContact OH-CA 3.38Å; N42-I45 WeakPolarHBondContact O-CG1 3.28Å; N42-I45 WeakPolarHBondContact OD1-CD1 3.39Å; I43-I45 VanDerWaalsContact C-N 3.32Å; I43-I45 PolarHBondContact O-N 2.95Å
46	M	51.2	Low	62.5	Low	67 Å²	67	78.9 Å²	78.9	33%	0.33	39%	0.389	S	S	.	.	S	Bend	trans	-68.7	132.5	165.7	-72.4	-83	123.5	0	0	109.3	I43 I44 P48 V128	I43-M46 WeakPolarHBondContact O-CB 3.09Å; I43-M46 PolarHBondContact O-N 3.45Å; I44-M46 PolarHBondContact O-N 3.07Å; M46-P48 WeakPolarHBondContact O-CD 3.5Å; M46-P48 VanDerWaalsContact O-N 3.13Å; M46-V128 HydrophobicContact CE-CG1 3.92Å; M46-V128 HydrophobicContact CE-CG2 3.81Å; M46-V128 HydrophobicContact CG-CG2 3.72Å; M46-V128 HydrophobicContact SD-CG2 3.31Å; M46-V128 WeakPolarHBondContact SD-CG2 3.4Å
47	L	64.7	Low	65	Low	124 Å²	124	73.7 Å²	73.7	65%	0.649	38%	0.376	S	S	*	.			trans	-47.4	121.9	176.4	-64.4	169.3	0	0	0	109.1	L49 S50	L47-L49 PolarHBondContact O-N 2.82Å; L47-S50 WeakPolarHBondContact O-CA 3.27Å; L47-S50 VanDerWaalsContact O-CB 3.27Å; L47-S50 WeakPolarHBondContact O-CB 3.34Å; L47-S50 PolarHBondContact O-N 2.82Å; L47-S50 PolarHBondContact O-OG 3.32Å
48	P	71.1	Confident	67.6	Low	23 Å²	23	68.8 Å²	68.8	15%	0.149	35%	0.353	C	S	.	.	H	α-helix	trans	-48.2	-31.7	-179.6	-35.1	38.1	0	0	0	115.4	F4 Y11 M46 S50 L51 L52	F4-P48 HydrophobicContact CD2-CB 4.4Å; F4-P48 HydrophobicContact CE1-CB 3.71Å; F4-P48 HydrophobicContact CE1-CG 4.17Å; F4-P48 HydrophobicContact CE2-CB 3.45Å; F4-P48 VanDerWaalsContact CE2-CB 3.45Å; F4-P48 HydrophobicContact CE2-CG 3.44Å; F4-P48 VanDerWaalsContact CE2-CG 3.44Å; F4-P48 HydrophobicContact CZ-CB 3.1Å; F4-P48 HydrophobicContact CZ-CG 3.15Å; Y11-P48 HydrophobicContact CD1-CG 3.69Å; Y11-P48 HydrophobicContact CG-CG 4.06Å; M46-P48 WeakPolarHBondContact O-CD 3.5Å; M46-P48 VanDerWaalsContact O-N 3.13Å; P48-S50 VanDerWaalsContact C-N 3.32Å; P48-L51 PolarHBondContact O-N 2.76Å; P48-L52 PolarHBondContact O-N 2.91Å
49	L	77.9	Confident	70	Confident	46 Å²	46	63.8 Å²	63.8	24%	0.241	34%	0.335	C	S	.	.	H	α-helix	trans	-67.2	-31.8	177.6	-62.1	175.8	0	0	0	112.2	L47 L52 K53 N79 M81	L47-L49 PolarHBondContact O-N 2.82Å; L49-L52 PolarHBondContact O-N 2.84Å; L49-K53 WeakPolarHBondContact O-CB 3.3Å; L49-K53 WeakPolarHBondContact O-CG 3.46Å; L49-K53 PolarHBondContact O-N 3.05Å; L49-N79 HydrophobicContact CD1-CB 4.46Å; L49-M81 HydrophobicContact CD2-CG 3.71Å
50	S	79.1	Confident	72.3	Confident	48 Å²	48	59.8 Å²	59.8	34%	0.336	31%	0.314	S	S	.	.	H	α-helix	trans	-64.3	-43.4	175.2	-58.9	0	0	0	0	111	L47 P48 L52 K53 T54	L47-S50 WeakPolarHBondContact O-CA 3.27Å; L47-S50 VanDerWaalsContact O-CB 3.27Å; L47-S50 WeakPolarHBondContact O-CB 3.34Å; L47-S50 PolarHBondContact O-N 2.82Å; L47-S50 PolarHBondContact O-OG 3.32Å; P48-S50 VanDerWaalsContact C-N 3.32Å; S50-L52 PolarHBondContact O-N 2.83Å; S50-K53 PolarHBondContact O-N 3.39Å; S50-T54 PolarHBondContact O-N 3.32Å; S50-T54 VanDerWaalsContact O-N 3.07Å; S50-T54 PolarHBondContact O-OG1 2.93Å
51	L	83.1	Confident	74.4	Confident	27 Å²	27	55.1 Å²	55.1	14%	0.141	29%	0.293	C	S	.	.	H	α-helix	trans	-63.3	-41.9	176.9	-179	66.3	0	0	0	111.8	P48 K53 T54 A55 I116 I120 V124	P48-L51 PolarHBondContact O-N 2.76Å; L51-K53 VanDerWaalsContact C-N 3.34Å; L51-T54 WeakPolarHBondContact CA-OG1 3.45Å; L51-T54 PolarHBondContact O-N 3.19Å; L51-T54 PolarHBondContact O-OG1 2.8Å; L51-A55 VanDerWaalsContact O-CB 3.31Å; L51-A55 WeakPolarHBondContact O-CB 3.5Å; L51-A55 PolarHBondContact O-N 2.92Å; L51-I116 HydrophobicContact CD2-CD1 3.42Å; L51-I116 VanDerWaalsContact CD2-CD1 3.42Å; L51-I116 HydrophobicContact CG-CD1 3.98Å; L51-I120 HydrophobicContact CD1-CG2 3.88Å; L51-V124 HydrophobicContact CD1-CB 4.26Å; L51-V124 HydrophobicContact CD1-CG2 3.59Å
52	L	84.3	Confident	76.7	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-69.6	-31.9	177.2	-72	171.2	0	0	0	112.8	P48 L49 S50 A55 M60 L74 C77 M81 L114	P48-L52 PolarHBondContact O-N 2.91Å; L49-L52 PolarHBondContact O-N 2.84Å; S50-L52 PolarHBondContact O-N 2.83Å; L52-A55 WeakPolarHBondContact O-CB 3.08Å; L52-A55 PolarHBondContact O-N 2.83Å; L52-M60 HydrophobicContact CD2-CE 4.16Å; L52-L74 WeakPolarHBondContact O-CD2 3.31Å; L52-C77 HydrophobicContact CB-CB 4.34Å; L52-M81 HydrophobicContact CD1-CG 4.12Å; L52-M81 HydrophobicContact CD1-SD 4.11Å; L52-L114 HydrophobicContact CD1-CD1 4.08Å; L52-L114 HydrophobicContact CD2-CD1 3.52Å; L52-L114 HydrophobicContact CG-CD1 4.43Å
53	K	84.4	Confident	78.9	Confident	106 Å²	106	48 Å²	48	46%	0.461	25%	0.252	S	S	.	.	H	α-helix	trans	-66.9	-41.3	174.4	-76.9	170.7	-176	-176	0	111.9	L49 S50 L51 A55 Q56	L49-K53 WeakPolarHBondContact O-CB 3.3Å; L49-K53 WeakPolarHBondContact O-CG 3.46Å; L49-K53 PolarHBondContact O-N 3.05Å; S50-K53 PolarHBondContact O-N 3.39Å; L51-K53 VanDerWaalsContact C-N 3.34Å; K53-A55 PolarHBondContact O-N 3.07Å; K53-Q56 VanDerWaalsContact O-CG 3.28Å; K53-Q56 WeakPolarHBondContact O-CG 3.33Å
54	T	85	Confident	81	Confident	34 Å²	34	47.1 Å²	47.1	21%	0.209	25%	0.247	C	C	.	.	H	α-helix	trans	-71.3	-22.1	173.6	50.2	0	0	0	0	112.7	S50 L51 Q56 V124	S50-T54 PolarHBondContact O-N 3.32Å; S50-T54 VanDerWaalsContact O-N 3.07Å; S50-T54 PolarHBondContact O-OG1 2.93Å; L51-T54 WeakPolarHBondContact CA-OG1 3.45Å; L51-T54 PolarHBondContact O-N 3.19Å; L51-T54 PolarHBondContact O-OG1 2.8Å; T54-Q56 PolarHBondContact O-N 2.8Å; T54-V124 HydrophobicContact CG2-CG2 3.98Å; T54-V124 WeakPolarHBondContact OG1-CG2 3.31Å
55	A	87.4	Confident	83.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	4.3	178.5	0	0	0	0	0	114.5	L51 L52 K53 N57 H58 M60 L74 I120	L51-A55 VanDerWaalsContact O-CB 3.31Å; L51-A55 WeakPolarHBondContact O-CB 3.5Å; L51-A55 PolarHBondContact O-N 2.92Å; L52-A55 WeakPolarHBondContact O-CB 3.08Å; L52-A55 PolarHBondContact O-N 2.83Å; K53-A55 PolarHBondContact O-N 3.07Å; A55-N57 PolarHBondContact O-N 3.18Å; A55-H58 WeakPolarHBondContact O-CB 3.43Å; A55-H58 PolarHBondContact O-N 2.8Å; A55-H58 VanDerWaalsContact O-N 3.16Å; A55-M60 HydrophobicContact CB-CE 4.14Å; A55-L74 HydrophobicContact CB-CD2 4.06Å; A55-I120 HydrophobicContact CB-CD1 3.65Å; A55-I120 HydrophobicContact CB-CG2 3.89Å
56	Q	90.9	Very high	85.3	Confident	85 Å²	85	48.5 Å²	48.5	40%	0.397	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	139.9	179.1	-75.5	177	7.4	0	0	111.3	K53 T54 H58	K53-Q56 VanDerWaalsContact O-CG 3.28Å; K53-Q56 WeakPolarHBondContact O-CG 3.33Å; T54-Q56 PolarHBondContact O-N 2.8Å; Q56-H58 PolarHBondContact O-CD2 3.06Å; Q56-H58 VanDerWaalsContact O-CD2 3.3Å; Q56-H58 PolarHBondContact O-N 2.88Å
57	N	92.7	Very high	87.3	Confident	85 Å²	85	46.3 Å²	46.3	46%	0.455	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	5.1	-173.7	-60.9	-66.5	0	0	0	116.3	A55 L74 R86	A55-N57 PolarHBondContact O-N 3.18Å; N57-L74 VanDerWaalsContact CA-O 3.25Å; N57-L74 WeakPolarHBondContact CA-O 3.06Å; N57-L74 PolarHBondContact N-O 3.01Å; N57-R86 PolarHBondContact OD1-NH1 3.43Å; N57-R86 PolarHBondContact OD1-NH2 3.21Å
58	H	91.7	Very high	88.7	Confident	42 Å²	42	43.3 Å²	43.3	19%	0.194	23%	0.228	C	C	.	.			trans	-90	148.8	175.2	-71.1	-87.8	0	0	0	112.6	A55 Q56 H73 L74 I120 M123	A55-H58 WeakPolarHBondContact O-CB 3.43Å; A55-H58 PolarHBondContact O-N 2.8Å; A55-H58 VanDerWaalsContact O-N 3.16Å; Q56-H58 PolarHBondContact O-CD2 3.06Å; Q56-H58 VanDerWaalsContact O-CD2 3.3Å; Q56-H58 PolarHBondContact O-N 2.88Å; H58-H73 WeakPolarHBondContact O-CA 3.44Å; H58-L74 PolarHBondContact O-N 2.73Å; H58-I120 HydrophobicContact CB-CD1 3.39Å; H58-I120 HydrophobicContact CB-CG1 4.17Å; H58-M123 VanDerWaalsContact NE2-CE 3.32Å; H58-M123 WeakPolarHBondContact NE2-CE 3.39Å
59	P	93.1	Very high	89.9	Confident	62 Å²	62	43.7 Å²	43.7	40%	0.403	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	136.1	173.9	29.1	-34.5	0	0	0	110.4	P117	P59-P117 HydrophobicContact CG-CG 4.46Å; P59-P117 VanDerWaalsContact O-CD 3.3Å; P59-P117 WeakPolarHBondContact O-CD 3.5Å; P59-P117 WeakPolarHBondContact O-CG 3.27Å
60	M	92.6	Very high	90.7	Very high	5 Å²	5	43.1 Å²	43.1	3%	0.025	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	150.7	176.6	58.5	170.1	49.4	0	0	112.6	L52 A55 V62 G72 L74 L85 L114	L52-M60 HydrophobicContact CD2-CE 4.16Å; A55-M60 HydrophobicContact CB-CE 4.14Å; M60-V62 HydrophobicContact CG-CG2 4.42Å; M60-V62 HydrophobicContact SD-CG2 4.37Å; M60-G72 PolarHBondContact N-O 2.55Å; M60-G72 PolarHBondContact O-N 3.38Å; M60-L74 HydrophobicContact CE-CB 3.86Å; M60-L74 HydrophobicContact CE-CD1 4.49Å; M60-L74 HydrophobicContact CE-CD2 3.72Å; M60-L74 HydrophobicContact CE-CG 4.23Å; M60-L74 HydrophobicContact CG-CB 4.32Å; M60-L74 HydrophobicContact SD-CB 3.88Å; M60-L74 HydrophobicContact SD-CD1 4.02Å; M60-L74 HydrophobicContact SD-CD2 4.32Å; M60-L74 HydrophobicContact SD-CG 4.29Å; M60-L85 HydrophobicContact CG-CD2 3.94Å; M60-L85 HydrophobicContact SD-CD2 4.18Å; M60-L114 HydrophobicContact SD-CD2 4.34Å
61	L	94	Very high	91.5	Very high	41 Å²	41	44.6 Å²	44.6	22%	0.215	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.2	172.9	-175.1	157	0	0	0	109.3	Y70 R115	L61-Y70 WeakPolarHBondContact CA-O 3.39Å; L61-R115 HydrophobicContact CB-CB 4.16Å; L61-R115 HydrophobicContact CB-CG 4.36Å; L61-R115 HydrophobicContact CD2-CG 4.17Å; L61-R115 PolarHBondContact O-N 2.7Å
62	V	94.8	Very high	92.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	121.8	-179.7	-174.5	0	0	0	0	108.7	M60 L64 T69 Y70 I83 L85 I106 I111 L114	M60-V62 HydrophobicContact CG-CG2 4.42Å; M60-V62 HydrophobicContact SD-CG2 4.37Å; V62-L64 HydrophobicContact CG1-CD2 3.97Å; V62-T69 CarbonylContact O-C 3.56Å; V62-T69 VanDerWaalsContact O-CA 3.26Å; V62-T69 WeakPolarHBondContact O-CA 3.25Å; V62-Y70 PolarHBondContact N-O 2.74Å; V62-Y70 PolarHBondContact O-N 2.8Å; V62-I83 HydrophobicContact CG1-CD1 4.17Å; V62-I83 HydrophobicContact CG2-CD1 3.81Å; V62-L85 HydrophobicContact CG2-CD1 3.94Å; V62-I106 HydrophobicContact CG1-CD1 4.23Å; V62-I111 HydrophobicContact CG1-CD1 4.45Å; V62-I111 HydrophobicContact CG1-CG1 4.2Å; V62-I111 HydrophobicContact CG1-CG2 4.16Å; V62-L114 HydrophobicContact CB-CD2 3.78Å; V62-L114 HydrophobicContact CG1-CD2 3.56Å; V62-L114 HydrophobicContact CG2-CD2 3.36Å
63	E	94.1	Very high	92.6	Very high	31 Å²	31	45.8 Å²	45.8	15%	0.145	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124.8	169.9	-173.2	177.2	122.8	0	0	109	T69 K112 Y113	E63-T69 HydrophobicContact CB-CG2 4.34Å; E63-T69 HydrophobicContact CG-CG2 4.19Å; E63-K112 HydrophobicContact CG-CD 4.5Å; E63-K112 WeakPolarHBondContact O-CA 3.34Å; E63-K112 WeakPolarHBondContact O-CB 3.42Å; E63-K112 PolarHBondContact O-N 2.79Å; E63-K112 WeakPolarHBondContact OE1-CD 3Å; E63-K112 WeakPolarHBondContact OE1-CE 3.32Å; E63-K112 IonicContact OE1-NZ 2.72Å; E63-K112 PolarHBondContact OE1-NZ 3.45Å; E63-Y113 HydrophobicContact CB-CD1 4.05Å; E63-Y113 HydrophobicContact CB-CD2 4.36Å; E63-Y113 HydrophobicContact CB-CE1 3.67Å; E63-Y113 HydrophobicContact CB-CE2 4.03Å; E63-Y113 HydrophobicContact CB-CG 4.38Å; E63-Y113 HydrophobicContact CG-CE1 3.97Å; E63-Y113 PolarHBondContact N-O 3.5Å; E63-Y113 PolarHBondContact O-N 3.16Å; E63-Y113 WeakPolarHBondContact OE1-CE1 3.26Å; E63-Y113 WeakPolarHBondContact OE2-CE1 3.31Å; E63-Y113 PolarHBondContact OE2-OH 2.79Å
64	L	94.4	Very high	93.1	Very high	11 Å²	11	40.8 Å²	40.8	6%	0.058	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	162.6	176.3	-62.7	-163.4	0	0	0	111.6	V62 N66 G67 E68 Y70 I106 T110 I111	V62-L64 HydrophobicContact CG1-CD2 3.97Å; L64-N66 WeakPolarHBondContact CB-OD1 3.37Å; L64-N66 PolarHBondContact O-N 3.31Å; L64-G67 PolarHBondContact O-N 3.08Å; L64-E68 PolarHBondContact N-O 3.32Å; L64-Y70 HydrophobicContact CD1-CD2 4Å; L64-Y70 HydrophobicContact CD1-CE2 3.34Å; L64-Y70 HydrophobicContact CG-CD2 3.93Å; L64-Y70 HydrophobicContact CG-CE2 3.77Å; L64-I106 HydrophobicContact CD2-CG2 3.59Å; L64-T110 WeakPolarHBondContact CA-O 3.01Å; L64-I111 HydrophobicContact CD2-CG1 4.16Å
65	K	93.3	Very high	93.6	Very high	100 Å²	100	41.9 Å²	41.9	44%	0.435	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-25.7	177.8	-73.6	173.9	-177.7	174	0	113.4	G67 S109 T110 K112	K65-G67 PolarHBondContact O-N 2.85Å; K65-S109 VanDerWaalsContact CE-O 3.3Å; K65-S109 WeakPolarHBondContact CE-O 3.41Å; K65-S109 PolarHBondContact NZ-O 3.06Å; K65-T110 WeakPolarHBondContact CB-O 3.47Å; K65-T110 WeakPolarHBondContact CG-O 3.46Å; K65-T110 PolarHBondContact N-O 2.95Å; K65-K112 HydrophobicContact CG-CB 4.15Å
66	N	91.6	Very high	93.9	Very high	80 Å²	80	44 Å²	44	43%	0.428	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-10	174.1	65	-2.1	0	0	0	112.5	L64 E68	L64-N66 WeakPolarHBondContact CB-OD1 3.37Å; L64-N66 PolarHBondContact O-N 3.31Å; N66-E68 PolarHBondContact ND2-OE2 2.96Å; N66-E68 WeakPolarHBondContact OD1-CB 3.32Å; N66-E68 PolarHBondContact OD1-N 3.21Å
67	G	92.4	Very high	93.9	Very high	21 Å²	21	40.9 Å²	40.9	22%	0.216	22%	0.222	C	C	.	.	S	Bend	trans	93.8	-3.2	-179.4	0	0	0	0	0	114.6	L64 K65 R93	L64-G67 PolarHBondContact O-N 3.08Å; K65-G67 PolarHBondContact O-N 2.85Å; G67-R93 WeakPolarHBondContact O-CA 3.19Å
68	E	94.4	Very high	93.8	Very high	61 Å²	61	39.1 Å²	39.1	29%	0.285	21%	0.212	S	C	.	.			trans	-72.7	148.3	173.1	-64.4	173.1	164.3	0	0	110.8	L64 N66 Y70 T91	L64-E68 PolarHBondContact N-O 3.32Å; N66-E68 PolarHBondContact ND2-OE2 2.96Å; N66-E68 WeakPolarHBondContact OD1-CB 3.32Å; N66-E68 PolarHBondContact OD1-N 3.21Å; E68-Y70 HydrophobicContact CB-CE2 4.06Å; E68-T91 WeakPolarHBondContact CA-O 3.32Å
69	T	95.8	Very high	93.5	Very high	32 Å²	32	42.3 Å²	42.3	20%	0.196	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	135.4	178.1	64.8	0	0	0	0	111.6	V62 E63 C90 T91	V62-T69 CarbonylContact O-C 3.56Å; V62-T69 VanDerWaalsContact O-CA 3.26Å; V62-T69 WeakPolarHBondContact O-CA 3.25Å; E63-T69 HydrophobicContact CB-CG2 4.34Å; E63-T69 HydrophobicContact CG-CG2 4.19Å; T69-C90 CarbonylContact O-C 3.56Å; T69-C90 WeakPolarHBondContact O-CA 3.09Å; T69-T91 PolarHBondContact N-O 3.45Å; T69-T91 PolarHBondContact O-N 3.5Å; T69-T91 WeakPolarHBondContact OG1-CB 3.39Å
70	Y	96.7	Very high	93.2	Very high	33 Å²	33	48.7 Å²	48.7	13%	0.129	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	122.3	177.6	-66.1	-103.5	0	0	0	108.7	L61 V62 L64 E68 V88 C90 C104 I106	L61-Y70 WeakPolarHBondContact CA-O 3.39Å; V62-Y70 PolarHBondContact N-O 2.74Å; V62-Y70 PolarHBondContact O-N 2.8Å; L64-Y70 HydrophobicContact CD1-CD2 4Å; L64-Y70 HydrophobicContact CD1-CE2 3.34Å; L64-Y70 HydrophobicContact CG-CD2 3.93Å; L64-Y70 HydrophobicContact CG-CE2 3.77Å; E68-Y70 HydrophobicContact CB-CE2 4.06Å; Y70-V88 HydrophobicContact CD1-CG1 3.82Å; Y70-V88 HydrophobicContact CG-CG1 4.45Å; Y70-C90 HydrophobicContact CD1-CB 3.96Å; Y70-C90 HydrophobicContact CE1-CB 3.77Å; Y70-C104 VanDerWaalsContact CE1-SG 3.59Å; Y70-I106 HydrophobicContact CD1-CD1 4.05Å; Y70-I106 HydrophobicContact CD2-CD1 3.98Å; Y70-I106 HydrophobicContact CG-CD1 3.7Å
71	N	95.3	Very high	93	Very high	79 Å²	79	50 Å²	50	42%	0.422	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.8	174.2	-173.5	-10.7	0	0	0	108.5	V88 I89	N71-V88 CarbonylContact O-C 3.59Å; N71-V88 VanDerWaalsContact O-CA 3.32Å; N71-V88 WeakPolarHBondContact O-CA 3.3Å; N71-I89 PolarHBondContact N-O 2.9Å; N71-I89 PolarHBondContact O-N 2.92Å
72	G	95.6	Very high	92.9	Very high	2 Å²	2	48.7 Å²	48.7	2%	0.021	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.5	-177	-179.8	0	0	0	0	0	111.9	M60	M60-G72 PolarHBondContact N-O 2.55Å; M60-G72 PolarHBondContact O-N 3.38Å
73	H	95.6	Very high	92.9	Very high	52 Å²	52	48.7 Å²	48.7	24%	0.241	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	131.7	178.6	-58.7	87.3	0	0	0	110.9	H58 V75 L85 R86 E87	H58-H73 WeakPolarHBondContact O-CA 3.44Å; H73-V75 PolarHBondContact O-N 2.98Å; H73-L85 CarbonylContact O-C 3.46Å; H73-L85 VanDerWaalsContact O-CA 3.23Å; H73-L85 WeakPolarHBondContact O-CA 3.12Å; H73-R86 HydrophobicContact CB-CG 3.68Å; H73-R86 PolarHBondContact N-O 3.08Å; H73-R86 PolarHBondContact O-N 3.29Å; H73-E87 IonicContact CE1-OE2 3.47Å; H73-E87 PolarHBondContact CE1-OE2 2.84Å; H73-E87 IonicContact ND1-OE2 3.41Å; H73-E87 PolarHBondContact ND1-OE2 3.3Å
74	L	94.9	Very high	93	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	122.5	176.4	-174.9	67.2	0	0	0	110.7	L52 A55 N57 H58 M60 S76 I83 L85	L52-L74 WeakPolarHBondContact O-CD2 3.31Å; A55-L74 HydrophobicContact CB-CD2 4.06Å; N57-L74 VanDerWaalsContact CA-O 3.25Å; N57-L74 WeakPolarHBondContact CA-O 3.06Å; N57-L74 PolarHBondContact N-O 3.01Å; H58-L74 PolarHBondContact O-N 2.73Å; M60-L74 HydrophobicContact CE-CB 3.86Å; M60-L74 HydrophobicContact CE-CD1 4.49Å; M60-L74 HydrophobicContact CE-CD2 3.72Å; M60-L74 HydrophobicContact CE-CG 4.23Å; M60-L74 HydrophobicContact CG-CB 4.32Å; M60-L74 HydrophobicContact SD-CB 3.88Å; M60-L74 HydrophobicContact SD-CD1 4.02Å; M60-L74 HydrophobicContact SD-CD2 4.32Å; M60-L74 HydrophobicContact SD-CG 4.29Å; L74-S76 WeakPolarHBondContact CD1-O 3.43Å; L74-I83 HydrophobicContact CD1-CB 3.82Å; L74-I83 HydrophobicContact CD1-CG2 3.89Å; L74-L85 HydrophobicContact CD1-CD2 4.4Å
75	V	95.3	Very high	93.1	Very high	57 Å²	57	49.7 Å²	49.7	35%	0.345	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-50.8	175.2	179.6	0	0	0	0	110	H73 N84 R86	H73-V75 PolarHBondContact O-N 2.98Å; V75-N84 HydrophobicContact CB-CB 4.14Å; V75-N84 PolarHBondContact N-O 2.77Å; V75-R86 HydrophobicContact CG2-CB 3.69Å; V75-R86 HydrophobicContact CG2-CG 3.75Å
76	S	92.8	Very high	93.3	Very high	44 Å²	44	49.3 Å²	49.3	31%	0.308	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	155.6	-178.2	65.9	0	0	0	0	111.4	L74 I83 N84	L74-S76 WeakPolarHBondContact CD1-O 3.43Å; S76-I83 WeakPolarHBondContact O-CA 3.28Å; S76-N84 PolarHBondContact O-N 3.06Å; S76-N84 WeakPolarHBondContact OG-CB 3.3Å; S76-N84 PolarHBondContact OG-ND2 2.83Å
77	C	90.5	Very high	93.5	Very high	20 Å²	20	51.8 Å²	51.8	14%	0.135	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	135.1	176	178.7	0	0	0	0	108.9	L52 N82 I83	L52-C77 HydrophobicContact CB-CB 4.34Å; C77-N82 WeakPolarHBondContact CA-O 3.47Å; C77-I83 HydrophobicContact CB-CG2 4.1Å
78	D	90.2	Very high	93.7	Very high	48 Å²	48	50.9 Å²	50.9	26%	0.257	25%	0.248	S	C	.	.			trans	-98.4	-178.3	174.8	76.4	9.2	0	0	0	112.9	W80 M81 N82	D78-W80 PolarHBondContact O-N 2.82Å; D78-W80 VanDerWaalsContact OD1-C 3.25Å; D78-W80 VanDerWaalsContact OD1-CA 3.31Å; D78-W80 WeakPolarHBondContact OD1-CA 3.02Å; D78-W80 PolarHBondContact OD1-N 3.24Å; D78-M81 PolarHBondContact O-N 3.07Å; D78-M81 PolarHBondContact OD1-N 3.27Å; D78-N82 PolarHBondContact N-O 3.41Å; D78-N82 PolarHBondContact OD1-N 3.47Å; D78-N82 VanDerWaalsContact OD2-CB 3.27Å; D78-N82 WeakPolarHBondContact OD2-CB 3.44Å; D78-N82 VanDerWaalsContact OD2-CG 3.32Å; D78-N82 PolarHBondContact OD2-ND2 2.59Å
79	N	85.9	Confident	93.8	Very high	110 Å²	110	50.9 Å²	50.9	59%	0.588	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-17.9	179.9	-65.7	-28.3	0	0	0	113.6	L49 M81	L49-N79 HydrophobicContact CD1-CB 4.46Å; N79-M81 VanDerWaalsContact C-N 3.33Å
80	W	86.3	Confident	93.7	Very high	196 Å²	196	49.8 Å²	49.8	74%	0.742	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.6	7	175.1	-65	-79.3	0	0	0	112.5	D78 N82	D78-W80 PolarHBondContact O-N 2.82Å; D78-W80 VanDerWaalsContact OD1-C 3.25Å; D78-W80 VanDerWaalsContact OD1-CA 3.31Å; D78-W80 WeakPolarHBondContact OD1-CA 3.02Å; D78-W80 PolarHBondContact OD1-N 3.24Å; W80-N82 PolarHBondContact O-N 3.31Å
81	M	89.4	Confident	93.7	Very high	31 Å²	31	49.1 Å²	49.1	15%	0.153	24%	0.243	C	C	.	.			trans	58.8	26.3	-172.5	-60.5	-172.9	-69.6	0	0	113.8	F4 L49 L52 D78 N79 G108 I111	F4-M81 HydrophobicContact CD1-SD 4.38Å; F4-M81 HydrophobicContact CE1-SD 3.92Å; L49-M81 HydrophobicContact CD2-CG 3.71Å; L52-M81 HydrophobicContact CD1-CG 4.12Å; L52-M81 HydrophobicContact CD1-SD 4.11Å; D78-M81 PolarHBondContact O-N 3.07Å; D78-M81 PolarHBondContact OD1-N 3.27Å; N79-M81 VanDerWaalsContact C-N 3.33Å; M81-G108 VanDerWaalsContact C-CA 3.45Å; M81-G108 WeakPolarHBondContact O-CA 3.31Å; M81-G108 PolarHBondContact O-N 3.15Å; M81-I111 WeakPolarHBondContact O-CD1 3.49Å
82	N	92.1	Very high	93.6	Very high	15 Å²	15	46.2 Å²	46.2	8%	0.08	23%	0.228	C	C	.	.			trans	-68.3	133.7	160.1	-50.2	-44.4	0	0	0	107.8	C77 D78 W80 Y105 I106 R107 G108	C77-N82 WeakPolarHBondContact CA-O 3.47Å; D78-N82 PolarHBondContact N-O 3.41Å; D78-N82 PolarHBondContact OD1-N 3.47Å; D78-N82 VanDerWaalsContact OD2-CB 3.27Å; D78-N82 WeakPolarHBondContact OD2-CB 3.44Å; D78-N82 VanDerWaalsContact OD2-CG 3.32Å; D78-N82 PolarHBondContact OD2-ND2 2.59Å; W80-N82 PolarHBondContact O-N 3.31Å; N82-Y105 HydrophobicContact CB-CE2 4.13Å; N82-Y105 WeakPolarHBondContact CB-OH 3.45Å; N82-Y105 PolarHBondContact ND2-OH 2.98Å; N82-I106 CarbonylContact C-O 3.58Å; N82-I106 VanDerWaalsContact CA-O 3.29Å; N82-I106 WeakPolarHBondContact CA-O 3.31Å; N82-R107 WeakPolarHBondContact OD1-CA 3.29Å; N82-R107 WeakPolarHBondContact OD1-CG 3.38Å; N82-G108 PolarHBondContact OD1-N 3.37Å
83	I	94.4	Very high	93.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	144.4	-172.6	60	178.3	0	0	0	110.9	V62 L74 S76 C77 L85 I106 I111 L114	V62-I83 HydrophobicContact CG1-CD1 4.17Å; V62-I83 HydrophobicContact CG2-CD1 3.81Å; L74-I83 HydrophobicContact CD1-CB 3.82Å; L74-I83 HydrophobicContact CD1-CG2 3.89Å; S76-I83 WeakPolarHBondContact O-CA 3.28Å; C77-I83 HydrophobicContact CB-CG2 4.1Å; I83-L85 HydrophobicContact CD1-CD1 4.47Å; I83-L85 HydrophobicContact CD1-CG 4.47Å; I83-I106 HydrophobicContact CD1-CB 4.36Å; I83-I106 HydrophobicContact CD1-CD1 4.41Å; I83-I106 HydrophobicContact CG1-CB 3.8Å; I83-I106 HydrophobicContact CG1-CG2 4.42Å; I83-I106 PolarHBondContact N-O 2.92Å; I83-I106 PolarHBondContact O-N 3.17Å; I83-I111 HydrophobicContact CD1-CD1 3.78Å; I83-I111 HydrophobicContact CG1-CD1 4.1Å; I83-L114 HydrophobicContact CD1-CD2 4.13Å
84	N	96.2	Very high	93.2	Very high	61 Å²	61	58.7 Å²	58.7	33%	0.326	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	130	168.8	-64.1	6.8	0	0	0	108.1	V75 S76 C104 Y105	V75-N84 HydrophobicContact CB-CB 4.14Å; V75-N84 PolarHBondContact N-O 2.77Å; S76-N84 PolarHBondContact O-N 3.06Å; S76-N84 WeakPolarHBondContact OG-CB 3.3Å; S76-N84 PolarHBondContact OG-ND2 2.83Å; N84-C104 WeakPolarHBondContact CA-O 3.41Å; N84-Y105 WeakPolarHBondContact OD1-CD2 3.43Å
85	L	96.9	Very high	92.8	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	146.6	176	-62.6	168	0	0	0	109.7	M60 V62 H73 L74 I83 V88 E103 C104 I106	M60-L85 HydrophobicContact CG-CD2 3.94Å; M60-L85 HydrophobicContact SD-CD2 4.18Å; V62-L85 HydrophobicContact CG2-CD1 3.94Å; H73-L85 CarbonylContact O-C 3.46Å; H73-L85 VanDerWaalsContact O-CA 3.23Å; H73-L85 WeakPolarHBondContact O-CA 3.12Å; L74-L85 HydrophobicContact CD1-CD2 4.4Å; I83-L85 HydrophobicContact CD1-CD1 4.47Å; I83-L85 HydrophobicContact CD1-CG 4.47Å; L85-V88 HydrophobicContact CB-CG2 3.42Å; L85-V88 VanDerWaalsContact CB-CG2 3.42Å; L85-V88 HydrophobicContact CD1-CG1 4.37Å; L85-E103 CarbonylContact O-C 3.52Å; L85-E103 VanDerWaalsContact O-CA 3.29Å; L85-E103 WeakPolarHBondContact O-CA 3.47Å; L85-C104 PolarHBondContact N-O 3.44Å; L85-C104 PolarHBondContact O-N 3.25Å; L85-I106 HydrophobicContact CD1-CD1 3.65Å
86	R	96.6	Very high	92.3	Very high	92 Å²	92	64 Å²	64	35%	0.347	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	155.4	169.4	67	175.3	-173.5	-145.5	-4.7	111.4	N57 H73 V75 P102	N57-R86 PolarHBondContact OD1-NH1 3.43Å; N57-R86 PolarHBondContact OD1-NH2 3.21Å; H73-R86 HydrophobicContact CB-CG 3.68Å; H73-R86 PolarHBondContact N-O 3.08Å; H73-R86 PolarHBondContact O-N 3.29Å; V75-R86 HydrophobicContact CG2-CB 3.69Å; V75-R86 HydrophobicContact CG2-CG 3.75Å; R86-P102 CarbonylContact C-O 3.55Å; R86-P102 VanDerWaalsContact CA-O 3.32Å; R86-P102 WeakPolarHBondContact CA-O 3.49Å
87	E	96.3	Very high	92.2	Very high	133 Å²	133	68.1 Å²	68.1	62%	0.621	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53	55.9	177.9	-59.2	176.5	160.1	0	0	111.7	H73 P102	H73-E87 IonicContact CE1-OE2 3.47Å; H73-E87 PolarHBondContact CE1-OE2 2.84Å; H73-E87 IonicContact ND1-OE2 3.41Å; H73-E87 PolarHBondContact ND1-OE2 3.3Å; E87-P102 PolarHBondContact N-O 3.36Å
88	V	96.7	Very high	92.4	Very high	1 Å²	1	73.3 Å²	73.3	1%	0.006	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	133.4	-163.6	-166.9	0	0	0	0	111	Y70 N71 L85 R100 M101 C104	Y70-V88 HydrophobicContact CD1-CG1 3.82Å; Y70-V88 HydrophobicContact CG-CG1 4.45Å; N71-V88 CarbonylContact O-C 3.59Å; N71-V88 VanDerWaalsContact O-CA 3.32Å; N71-V88 WeakPolarHBondContact O-CA 3.3Å; L85-V88 HydrophobicContact CB-CG2 3.42Å; L85-V88 VanDerWaalsContact CB-CG2 3.42Å; L85-V88 HydrophobicContact CD1-CG1 4.37Å; V88-R100 WeakPolarHBondContact O-CA 3.34Å; V88-M101 PolarHBondContact N-O 3.03Å; V88-M101 PolarHBondContact O-N 3.48Å; V88-C104 HydrophobicContact CB-CB 4.17Å; V88-C104 HydrophobicContact CG1-CB 4.16Å; V88-C104 HydrophobicContact CG2-CB 3.78Å
89	I	96	Very high	92.5	Very high	61 Å²	61	77.1 Å²	77.1	31%	0.313	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	109.6	167.7	-53.3	-179.7	0	0	0	107.5	N71 F98 W99 R100	N71-I89 PolarHBondContact N-O 2.9Å; N71-I89 PolarHBondContact O-N 2.92Å; I89-F98 HydrophobicContact CG2-CD1 4.05Å; I89-W99 CarbonylContact C-O 3.52Å; I89-W99 WeakPolarHBondContact CA-O 2.82Å; I89-R100 HydrophobicContact CG1-CG 4.36Å
90	C	95.1	Very high	92.9	Very high	9 Å²	9	82.3 Å²	82.3	6%	0.061	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	133.8	169.6	179.7	0	0	0	0	109.1	T69 Y70 F98 W99	T69-C90 CarbonylContact O-C 3.56Å; T69-C90 WeakPolarHBondContact O-CA 3.09Å; Y70-C90 HydrophobicContact CD1-CB 3.96Å; Y70-C90 HydrophobicContact CE1-CB 3.77Å; C90-F98 CarbonylContact O-C 3.53Å; C90-F98 VanDerWaalsContact O-CA 3.27Å; C90-F98 WeakPolarHBondContact O-CA 3.44Å; C90-W99 HydrophobicContact CB-CB 4.34Å; C90-W99 PolarHBondContact N-O 3.2Å; C90-W99 PolarHBondContact O-N 3.19Å
91	T	95.5	Very high	93.4	Very high	20 Å²	20	76.8 Å²	76.8	12%	0.123	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.7	174.1	-47.7	0	0	0	0	108.6	E68 T69 K97 F98	E68-T91 WeakPolarHBondContact CA-O 3.32Å; T69-T91 PolarHBondContact N-O 3.45Å; T69-T91 PolarHBondContact O-N 3.5Å; T69-T91 WeakPolarHBondContact OG1-CB 3.39Å; T91-K97 WeakPolarHBondContact CA-O 2.99Å; T91-F98 HydrophobicContact CG2-CD1 3.81Å; T91-F98 HydrophobicContact CG2-CE1 3.32Å; T91-F98 HydrophobicContact CG2-CZ 3.76Å; T91-F98 VanDerWaalsContact OG1-CD1 3.28Å; T91-F98 WeakPolarHBondContact OG1-CD1 3.45Å; T91-F98 VanDerWaalsContact OG1-CE1 3.23Å; T91-F98 WeakPolarHBondContact OG1-CE1 3.29Å
92	S	94.4	Very high	93.7	Very high	17 Å²	17	80.4 Å²	80.4	12%	0.119	38%	0.38	C	S	.	.			trans	-59.9	160.2	173.8	62.6	0	0	0	0	111.1	D94 G95 K97	S92-D94 PolarHBondContact O-N 2.87Å; S92-D94 VanDerWaalsContact O-N 3.16Å; S92-G95 PolarHBondContact O-N 3.43Å; S92-K97 PolarHBondContact N-O 3.38Å; S92-K97 PolarHBondContact OG-N 2.98Å
93	R	91.8	Very high	93.9	Very high	190 Å²	190	86.8 Å²	86.8	72%	0.717	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-37.3	175.8	-179.9	-179.6	179.9	-175.3	-2.8	113.4	G67 G95	G67-R93 WeakPolarHBondContact O-CA 3.19Å; R93-G95 VanDerWaalsContact C-N 3.31Å
94	D	89	Confident	93.9	Very high	126 Å²	126	87.5 Å²	87.5	67%	0.674	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-10.2	-177	-52.4	-48.1	0	0	0	112.8	S92 D96	S92-D94 PolarHBondContact O-N 2.87Å; S92-D94 VanDerWaalsContact O-N 3.16Å; D94-D96 VanDerWaalsContact C-N 3.27Å; D94-D96 PolarHBondContact O-N 2.89Å
95	G	86.5	Confident	93.9	Very high	32 Å²	32	91.3 Å²	91.3	33%	0.33	43%	0.425	S	S	.	.	S	Bend	trans	83.2	-5.2	179.1	0	0	0	0	0	115.1	S92 R93 F98	S92-G95 PolarHBondContact O-N 3.43Å; R93-G95 VanDerWaalsContact C-N 3.31Å; G95-F98 WeakPolarHBondContact O-CE2 3.44Å; G95-F98 VanDerWaalsContact O-CZ 3.22Å; G95-F98 WeakPolarHBondContact O-CZ 3.14Å
96	D	86	Confident	93.9	Very high	137 Å²	137	91.5 Å²	91.5	73%	0.733	43%	0.427	S	S	*	.			trans	-87.3	-21.6	-171.4	-63.2	-29.8	0	0	0	114.1	D94	D94-D96 VanDerWaalsContact C-N 3.27Å; D94-D96 PolarHBondContact O-N 2.89Å
97	K	91.3	Very high	93.8	Very high	130 Å²	130	94 Å²	94	57%	0.565	44%	0.436	S	S	*	.			trans	-119.4	130.1	-175.5	-60.8	-179.4	-179.1	177.8	0	110.7	T91 S92 W99	T91-K97 WeakPolarHBondContact CA-O 2.99Å; S92-K97 PolarHBondContact N-O 3.38Å; S92-K97 PolarHBondContact OG-N 2.98Å; K97-W99 HydrophobicContact CB-CE3 4.18Å; K97-W99 HydrophobicContact CB-CH2 3.2Å; K97-W99 HydrophobicContact CB-CZ2 3.9Å; K97-W99 HydrophobicContact CB-CZ3 3.35Å; K97-W99 HydrophobicContact CD-CH2 3.55Å; K97-W99 HydrophobicContact CD-CZ2 3.94Å; K97-W99 HydrophobicContact CG-CH2 4Å; K97-W99 WeakPolarHBondContact O-CZ3 3.46Å
98	F	93.6	Very high	93.5	Very high	130 Å²	130	87.8 Å²	87.8	57%	0.57	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.1	178.9	-61.2	-90.7	0	0	0	110.2	I89 C90 T91 G95	I89-F98 HydrophobicContact CG2-CD1 4.05Å; C90-F98 CarbonylContact O-C 3.53Å; C90-F98 VanDerWaalsContact O-CA 3.27Å; C90-F98 WeakPolarHBondContact O-CA 3.44Å; T91-F98 HydrophobicContact CG2-CD1 3.81Å; T91-F98 HydrophobicContact CG2-CE1 3.32Å; T91-F98 HydrophobicContact CG2-CZ 3.76Å; T91-F98 VanDerWaalsContact OG1-CD1 3.28Å; T91-F98 WeakPolarHBondContact OG1-CD1 3.45Å; T91-F98 VanDerWaalsContact OG1-CE1 3.23Å; T91-F98 WeakPolarHBondContact OG1-CE1 3.29Å; G95-F98 WeakPolarHBondContact O-CE2 3.44Å; G95-F98 VanDerWaalsContact O-CZ 3.22Å; G95-F98 WeakPolarHBondContact O-CZ 3.14Å
99	W	93.1	Very high	93.2	Very high	128 Å²	128	90.6 Å²	90.6	49%	0.485	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	137.7	172.7	-65.5	-95.5	0	0	0	109.5	I89 C90 K97	I89-W99 CarbonylContact C-O 3.52Å; I89-W99 WeakPolarHBondContact CA-O 2.82Å; C90-W99 HydrophobicContact CB-CB 4.34Å; C90-W99 PolarHBondContact N-O 3.2Å; C90-W99 PolarHBondContact O-N 3.19Å; K97-W99 HydrophobicContact CB-CE3 4.18Å; K97-W99 HydrophobicContact CB-CH2 3.2Å; K97-W99 HydrophobicContact CB-CZ2 3.9Å; K97-W99 HydrophobicContact CB-CZ3 3.35Å; K97-W99 HydrophobicContact CD-CH2 3.55Å; K97-W99 HydrophobicContact CD-CZ2 3.94Å; K97-W99 HydrophobicContact CG-CH2 4Å; K97-W99 WeakPolarHBondContact O-CZ3 3.46Å
100	R	94.8	Very high	93.1	Very high	218 Å²	218	90.2 Å²	90.2	82%	0.823	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	133.2	173.9	-65.1	-171.7	178.4	-178.3	0	109.4	V88 I89	V88-R100 WeakPolarHBondContact O-CA 3.34Å; I89-R100 HydrophobicContact CG1-CG 4.36Å
101	M	95.3	Very high	93	Very high	80 Å²	80	90 Å²	90	39%	0.394	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	138.7	-178.6	-60.8	169.8	70	0	0	108.8	V88 E103	V88-M101 PolarHBondContact N-O 3.03Å; V88-M101 PolarHBondContact O-N 3.48Å; M101-E103 VanDerWaalsContact C-N 3.34Å
102	P	96.1	Very high	92.7	Very high	107 Å²	107	93.2 Å²	93.2	70%	0.695	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66	-39.7	178.8	25.9	-32.9	0	0	0	111.4	R86 E87	R86-P102 CarbonylContact C-O 3.55Å; R86-P102 VanDerWaalsContact CA-O 3.32Å; R86-P102 WeakPolarHBondContact CA-O 3.49Å; E87-P102 PolarHBondContact N-O 3.36Å
103	E	95.8	Very high	92.5	Very high	149 Å²	149	94 Å²	94	70%	0.696	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.5	150.1	178.8	-65.1	-173.3	164.3	0	0	110.7	L85 M101	L85-E103 CarbonylContact O-C 3.52Å; L85-E103 VanDerWaalsContact O-CA 3.29Å; L85-E103 WeakPolarHBondContact O-CA 3.47Å; M101-E103 VanDerWaalsContact C-N 3.34Å
104	C	96	Very high	92.4	Very high	16 Å²	16	85 Å²	85	11%	0.108	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	130	176.1	-172.3	0	0	0	0	110.7	Y70 N84 L85 V88	Y70-C104 VanDerWaalsContact CE1-SG 3.59Å; N84-C104 WeakPolarHBondContact CA-O 3.41Å; L85-C104 PolarHBondContact N-O 3.44Å; L85-C104 PolarHBondContact O-N 3.25Å; V88-C104 HydrophobicContact CB-CB 4.17Å; V88-C104 HydrophobicContact CG1-CB 4.16Å; V88-C104 HydrophobicContact CG2-CB 3.78Å
105	Y	96.3	Very high	92.5	Very high	140 Å²	140	83.4 Å²	83.4	55%	0.549	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	124.7	170.5	177.6	-93.6	0	0	0	109.7	N82 N84	N82-Y105 HydrophobicContact CB-CE2 4.13Å; N82-Y105 WeakPolarHBondContact CB-OH 3.45Å; N82-Y105 PolarHBondContact ND2-OH 2.98Å; N84-Y105 WeakPolarHBondContact OD1-CD2 3.43Å
106	I	95.2	Very high	92.4	Very high	6 Å²	6	82.2 Å²	82.2	3%	0.031	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	128.4	178.6	-58.9	176.7	0	0	0	109.4	V62 L64 Y70 N82 I83 L85 I111	V62-I106 HydrophobicContact CG1-CD1 4.23Å; L64-I106 HydrophobicContact CD2-CG2 3.59Å; Y70-I106 HydrophobicContact CD1-CD1 4.05Å; Y70-I106 HydrophobicContact CD2-CD1 3.98Å; Y70-I106 HydrophobicContact CG-CD1 3.7Å; N82-I106 CarbonylContact C-O 3.58Å; N82-I106 VanDerWaalsContact CA-O 3.29Å; N82-I106 WeakPolarHBondContact CA-O 3.31Å; I83-I106 HydrophobicContact CD1-CB 4.36Å; I83-I106 HydrophobicContact CD1-CD1 4.41Å; I83-I106 HydrophobicContact CG1-CB 3.8Å; I83-I106 HydrophobicContact CG1-CG2 4.42Å; I83-I106 PolarHBondContact N-O 2.92Å; I83-I106 PolarHBondContact O-N 3.17Å; L85-I106 HydrophobicContact CD1-CD1 3.65Å; I106-I111 HydrophobicContact CG2-CD1 4.19Å; I106-I111 HydrophobicContact CG2-CG1 3.78Å
107	R	94.7	Very high	92.4	Very high	144 Å²	144	77.3 Å²	77.3	54%	0.543	35%	0.352	S	S	.	.			trans	-75.3	129.2	175.5	-173.1	179.7	169.2	79.5	-1.3	111	N82 S109 T110	N82-R107 WeakPolarHBondContact OD1-CA 3.29Å; N82-R107 WeakPolarHBondContact OD1-CG 3.38Å; R107-S109 VanDerWaalsContact CD-OG 3.28Å; R107-S109 WeakPolarHBondContact CD-OG 3.31Å; R107-S109 WeakPolarHBondContact CG-OG 3.05Å; R107-S109 PolarHBondContact NE-OG 3.43Å; R107-S109 PolarHBondContact O-N 3.44Å; R107-T110 HydrophobicContact CB-CG2 4.41Å; R107-T110 PolarHBondContact O-N 3.42Å; R107-T110 PolarHBondContact O-OG1 3Å
108	G	91.4	Very high	91.9	Very high	3 Å²	3	75.2 Å²	75.2	3%	0.031	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-57.5	-29.7	-177.1	0	0	0	0	0	114.7	M81 N82 T110 I111	M81-G108 VanDerWaalsContact C-CA 3.45Å; M81-G108 WeakPolarHBondContact O-CA 3.31Å; M81-G108 PolarHBondContact O-N 3.15Å; N82-G108 PolarHBondContact OD1-N 3.37Å; G108-T110 VanDerWaalsContact C-N 3.26Å; G108-T110 PolarHBondContact O-N 3.5Å; G108-I111 PolarHBondContact O-N 3.46Å
109	S	90.6	Very high	91.4	Very high	59 Å²	59	75.4 Å²	75.4	41%	0.413	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-67.5	-22.2	177.1	67	0	0	0	0	114.1	K65 R107	K65-S109 VanDerWaalsContact CE-O 3.3Å; K65-S109 WeakPolarHBondContact CE-O 3.41Å; K65-S109 PolarHBondContact NZ-O 3.06Å; R107-S109 VanDerWaalsContact CD-OG 3.28Å; R107-S109 WeakPolarHBondContact CD-OG 3.31Å; R107-S109 WeakPolarHBondContact CG-OG 3.05Å; R107-S109 PolarHBondContact NE-OG 3.43Å; R107-S109 PolarHBondContact O-N 3.44Å
110	T	92.1	Very high	90.9	Very high	54 Å²	54	69.3 Å²	69.3	33%	0.331	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-91.1	-15.2	179.5	66.1	0	0	0	0	112.4	L64 K65 R107 G108	L64-T110 WeakPolarHBondContact CA-O 3.01Å; K65-T110 WeakPolarHBondContact CB-O 3.47Å; K65-T110 WeakPolarHBondContact CG-O 3.46Å; K65-T110 PolarHBondContact N-O 2.95Å; R107-T110 HydrophobicContact CB-CG2 4.41Å; R107-T110 PolarHBondContact O-N 3.42Å; R107-T110 PolarHBondContact O-OG1 3Å; G108-T110 VanDerWaalsContact C-N 3.26Å; G108-T110 PolarHBondContact O-N 3.5Å
111	I	93.2	Very high	90.1	Very high	4 Å²	4	59.8 Å²	59.8	2%	0.021	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	135.8	177.7	-58.3	178	0	0	0	109.2	S6 V62 L64 M81 I83 I106 G108 L114	S6-I111 PolarHBondContact OG-O 3.26Å; V62-I111 HydrophobicContact CG1-CD1 4.45Å; V62-I111 HydrophobicContact CG1-CG1 4.2Å; V62-I111 HydrophobicContact CG1-CG2 4.16Å; L64-I111 HydrophobicContact CD2-CG1 4.16Å; M81-I111 WeakPolarHBondContact O-CD1 3.49Å; I83-I111 HydrophobicContact CD1-CD1 3.78Å; I83-I111 HydrophobicContact CG1-CD1 4.1Å; I106-I111 HydrophobicContact CG2-CD1 4.19Å; I106-I111 HydrophobicContact CG2-CG1 3.78Å; G108-I111 PolarHBondContact O-N 3.46Å; I111-L114 HydrophobicContact CG2-CD2 4.17Å; I111-L114 HydrophobicContact CG2-CG 4.17Å
112	K	90.3	Very high	89.3	Confident	87 Å²	87	59.9 Å²	59.9	38%	0.378	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-52.4	169.4	-177.5	-176.4	168.8	-167.9	0	109.6	S5 E63 K65	S5-K112 VanDerWaalsContact CA-O 3.3Å; S5-K112 WeakPolarHBondContact CA-O 3.25Å; S5-K112 WeakPolarHBondContact CB-O 3.23Å; S5-K112 PolarHBondContact OG-O 3.27Å; E63-K112 HydrophobicContact CG-CD 4.5Å; E63-K112 WeakPolarHBondContact O-CA 3.34Å; E63-K112 WeakPolarHBondContact O-CB 3.42Å; E63-K112 PolarHBondContact O-N 2.79Å; E63-K112 WeakPolarHBondContact OE1-CD 3Å; E63-K112 WeakPolarHBondContact OE1-CE 3.32Å; E63-K112 IonicContact OE1-NZ 2.72Å; E63-K112 PolarHBondContact OE1-NZ 3.45Å; K65-K112 HydrophobicContact CG-CB 4.15Å
113	Y	89.8	Confident	88.4	Confident	33 Å²	33	58.4 Å²	58.4	13%	0.129	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	163.1	170.8	70.2	-99.8	0	0	0	114.9	V3 F4 E63 R115	V3-Y113 HydrophobicContact CG1-CD1 4.12Å; V3-Y113 HydrophobicContact CG1-CD2 3.47Å; V3-Y113 VanDerWaalsContact CG1-CD2 3.47Å; V3-Y113 HydrophobicContact CG1-CE2 4.24Å; V3-Y113 HydrophobicContact CG1-CG 3.39Å; V3-Y113 HydrophobicContact CG2-CD2 4.45Å; F4-Y113 CarbonylContact O-C 3.54Å; F4-Y113 WeakPolarHBondContact O-CA 3.29Å; F4-Y113 VanDerWaalsContact O-CB 3.25Å; F4-Y113 WeakPolarHBondContact O-CB 3.32Å; E63-Y113 HydrophobicContact CB-CD1 4.05Å; E63-Y113 HydrophobicContact CB-CD2 4.36Å; E63-Y113 HydrophobicContact CB-CE1 3.67Å; E63-Y113 HydrophobicContact CB-CE2 4.03Å; E63-Y113 HydrophobicContact CB-CG 4.38Å; E63-Y113 HydrophobicContact CG-CE1 3.97Å; E63-Y113 PolarHBondContact N-O 3.5Å; E63-Y113 PolarHBondContact O-N 3.16Å; E63-Y113 WeakPolarHBondContact OE1-CE1 3.26Å; E63-Y113 WeakPolarHBondContact OE2-CE1 3.31Å; E63-Y113 PolarHBondContact OE2-OH 2.79Å; Y113-R115 HydrophobicContact CD2-CG 4.24Å; Y113-R115 HydrophobicContact CE2-CG 3.77Å; Y113-R115 PolarHBondContact OH-NH2 3.32Å
114	L	90.3	Very high	87.3	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.016	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	138.5	172.7	-58.4	170.3	0	0	0	110.3	V3 F4 L52 M60 V62 I83 I111 I116	V3-L114 WeakPolarHBondContact CA-O 3.23Å; F4-L114 PolarHBondContact N-O 3.42Å; F4-L114 VanDerWaalsContact N-O 3.08Å; F4-L114 PolarHBondContact O-N 2.98Å; L52-L114 HydrophobicContact CD1-CD1 4.08Å; L52-L114 HydrophobicContact CD2-CD1 3.52Å; L52-L114 HydrophobicContact CG-CD1 4.43Å; M60-L114 HydrophobicContact SD-CD2 4.34Å; V62-L114 HydrophobicContact CB-CD2 3.78Å; V62-L114 HydrophobicContact CG1-CD2 3.56Å; V62-L114 HydrophobicContact CG2-CD2 3.36Å; I83-L114 HydrophobicContact CD1-CD2 4.13Å; I111-L114 HydrophobicContact CG2-CD2 4.17Å; I111-L114 HydrophobicContact CG2-CG 4.17Å; L114-I116 HydrophobicContact CB-CG1 4.5Å
115	R	89.6	Confident	86	Confident	91 Å²	91	54.2 Å²	54.2	34%	0.343	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	119.8	166.1	-59	-170.8	177.8	178.2	2.1	108.9	L61 Y113	L61-R115 HydrophobicContact CB-CB 4.16Å; L61-R115 HydrophobicContact CB-CG 4.36Å; L61-R115 HydrophobicContact CD2-CG 4.17Å; L61-R115 PolarHBondContact O-N 2.7Å; Y113-R115 HydrophobicContact CD2-CG 4.24Å; Y113-R115 HydrophobicContact CE2-CG 3.77Å; Y113-R115 PolarHBondContact OH-NH2 3.32Å
116	I	85.1	Confident	84.6	Confident	8 Å²	8	54.2 Å²	54.2	4%	0.041	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	131.6	-175.8	-55.8	179.6	0	0	0	108.7	H2 F4 L51 L114 I120	H2-I116 PolarHBondContact O-N 2.9Å; F4-I116 HydrophobicContact CB-CD1 4.38Å; L51-I116 HydrophobicContact CD2-CD1 3.42Å; L51-I116 VanDerWaalsContact CD2-CD1 3.42Å; L51-I116 HydrophobicContact CG-CD1 3.98Å; L114-I116 HydrophobicContact CB-CG1 4.5Å; I116-I120 HydrophobicContact CG2-CB 3.97Å; I116-I120 HydrophobicContact CG2-CD1 3.85Å; I116-I120 HydrophobicContact CG2-CG1 4.44Å; I116-I120 HydrophobicContact CG2-CG2 4.22Å
117	P	85.8	Confident	83.2	Confident	34 Å²	34	58 Å²	58	22%	0.221	28%	0.279	C	S	.	.			trans	-54.5	142.8	169.6	-25.3	32.1	0	0	0	112.3	P59 E119 I120	P59-P117 HydrophobicContact CG-CG 4.46Å; P59-P117 VanDerWaalsContact O-CD 3.3Å; P59-P117 WeakPolarHBondContact O-CD 3.5Å; P59-P117 WeakPolarHBondContact O-CG 3.27Å; P117-E119 PolarHBondContact O-N 3.23Å; P117-I120 HydrophobicContact CB-CD1 4.19Å; P117-I120 HydrophobicContact CB-CG1 4.34Å; P117-I120 HydrophobicContact CG-CD1 3.96Å; P117-I120 PolarHBondContact O-N 3.3Å
118	D	81.4	Confident	81.7	Confident	85 Å²	85	53.3 Å²	53.3	46%	0.455	27%	0.266	S	S	.	.	H	α-helix	trans	-67.3	-26.5	-176.5	-62.1	-32	0	0	0	111.6	M1 H2 I120 I121 D122	M1-D118 PolarHBondContact N-OD1 3.28Å; H2-D118 IonicContact CD2-OD1 3.58Å; D118-I120 VanDerWaalsContact C-N 3.28Å; D118-I120 PolarHBondContact O-N 3.16Å; D118-I121 VanDerWaalsContact O-CB 3.31Å; D118-I121 WeakPolarHBondContact O-CB 3.27Å; D118-I121 PolarHBondContact O-N 3.02Å; D118-I121 VanDerWaalsContact O-N 3.08Å; D118-D122 PolarHBondContact O-N 3.36Å
119	E	83.5	Confident	80.2	Confident	134 Å²	134	57.2 Å²	57.2	63%	0.626	29%	0.289	S	S	*	.	H	α-helix	trans	-54.8	-40.2	174.7	-65.2	172.4	-171.6	0	0	113.1	P117 I121 D122 M123	P117-E119 PolarHBondContact O-N 3.23Å; E119-I121 VanDerWaalsContact C-N 3.26Å; E119-I121 PolarHBondContact O-N 3.34Å; E119-D122 PolarHBondContact O-N 2.84Å; E119-M123 WeakPolarHBondContact O-CG 3.38Å; E119-M123 PolarHBondContact O-N 3.3Å; E119-M123 VanDerWaalsContact O-N 3.07Å
120	I	81.8	Confident	78.7	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-68.6	-32.8	-177.8	-55.7	172.7	0	0	0	110.6	L51 A55 H58 I116 P117 D118 D122 M123 V124	L51-I120 HydrophobicContact CD1-CG2 3.88Å; A55-I120 HydrophobicContact CB-CD1 3.65Å; A55-I120 HydrophobicContact CB-CG2 3.89Å; H58-I120 HydrophobicContact CB-CD1 3.39Å; H58-I120 HydrophobicContact CB-CG1 4.17Å; I116-I120 HydrophobicContact CG2-CB 3.97Å; I116-I120 HydrophobicContact CG2-CD1 3.85Å; I116-I120 HydrophobicContact CG2-CG1 4.44Å; I116-I120 HydrophobicContact CG2-CG2 4.22Å; P117-I120 HydrophobicContact CB-CD1 4.19Å; P117-I120 HydrophobicContact CB-CG1 4.34Å; P117-I120 HydrophobicContact CG-CD1 3.96Å; P117-I120 PolarHBondContact O-N 3.3Å; D118-I120 VanDerWaalsContact C-N 3.28Å; D118-I120 PolarHBondContact O-N 3.16Å; I120-D122 VanDerWaalsContact C-N 3.29Å; I120-D122 PolarHBondContact O-N 3.27Å; I120-M123 HydrophobicContact CB-CE 4.2Å; I120-M123 HydrophobicContact CG1-CE 4Å; I120-M123 HydrophobicContact CG2-CE 4.38Å; I120-M123 PolarHBondContact O-N 3.39Å; I120-V124 WeakPolarHBondContact O-CG2 3.2Å; I120-V124 PolarHBondContact O-N 3.44Å
121	I	79	Confident	76.9	Confident	19 Å²	19	63 Å²	63	10%	0.097	31%	0.314	C	S	.	.	H	α-helix	trans	-67.2	-38.6	179.1	-55.8	177.7	0	0	0	109.7	H2 D118 E119 K125	H2-I121 HydrophobicContact CB-CD1 3.85Å; H2-I121 WeakPolarHBondContact CD2-CD1 3.22Å; H2-I121 VanDerWaalsContact CG-CD1 3.42Å; D118-I121 VanDerWaalsContact O-CB 3.31Å; D118-I121 WeakPolarHBondContact O-CB 3.27Å; D118-I121 PolarHBondContact O-N 3.02Å; D118-I121 VanDerWaalsContact O-N 3.08Å; E119-I121 VanDerWaalsContact C-N 3.26Å; E119-I121 PolarHBondContact O-N 3.34Å; I121-K125 VanDerWaalsContact O-CG 3.31Å; I121-K125 WeakPolarHBondContact O-CG 3.28Å; I121-K125 PolarHBondContact O-N 2.93Å; I121-K125 VanDerWaalsContact O-N 3.17Å
122	D	78.3	Confident	75	Confident	82 Å²	82	65.7 Å²	65.7	44%	0.439	34%	0.341	S	S	.	.	H	α-helix	trans	-71.7	-38.5	178.1	-66.4	-24.6	0	0	0	111.7	D118 E119 I120 V124 K125 E126	D118-D122 PolarHBondContact O-N 3.36Å; E119-D122 PolarHBondContact O-N 2.84Å; I120-D122 VanDerWaalsContact C-N 3.29Å; I120-D122 PolarHBondContact O-N 3.27Å; D122-V124 PolarHBondContact O-N 3.5Å; D122-K125 WeakPolarHBondContact O-CB 3.41Å; D122-K125 PolarHBondContact O-N 3Å; D122-K125 IonicContact OD1-NZ 2.74Å; D122-K125 PolarHBondContact OD1-NZ 3.07Å; D122-E126 PolarHBondContact O-N 3.19Å
123	M	76	Confident	73.1	Confident	76 Å²	76	71.9 Å²	71.9	37%	0.374	36%	0.362	S	S	.	.	H	α-helix	trans	-60.3	-43.8	172.8	-67.1	-168.8	-65.2	0	0	112.9	H58 E119 I120 K125 E126 E127	H58-M123 VanDerWaalsContact NE2-CE 3.32Å; H58-M123 WeakPolarHBondContact NE2-CE 3.39Å; E119-M123 WeakPolarHBondContact O-CG 3.38Å; E119-M123 PolarHBondContact O-N 3.3Å; E119-M123 VanDerWaalsContact O-N 3.07Å; I120-M123 HydrophobicContact CB-CE 4.2Å; I120-M123 HydrophobicContact CG1-CE 4Å; I120-M123 HydrophobicContact CG2-CE 4.38Å; I120-M123 PolarHBondContact O-N 3.39Å; M123-K125 VanDerWaalsContact C-N 3.32Å; M123-K125 PolarHBondContact O-N 2.75Å; M123-E126 PolarHBondContact O-N 3.36Å; M123-E127 PolarHBondContact O-N 2.67Å; M123-E127 VanDerWaalsContact O-N 3.16Å
124	V	72.4	Confident	71.2	Confident	6 Å²	6	73.4 Å²	73.4	4%	0.036	39%	0.388	C	S	.	.	H	α-helix	trans	-66.1	-36.1	178.6	173.9	0	0	0	0	111.7	I43 L51 T54 I120 D122 E126 E127 V128	I43-V124 HydrophobicContact CG2-CG1 4.05Å; L51-V124 HydrophobicContact CD1-CB 4.26Å; L51-V124 HydrophobicContact CD1-CG2 3.59Å; T54-V124 HydrophobicContact CG2-CG2 3.98Å; T54-V124 WeakPolarHBondContact OG1-CG2 3.31Å; I120-V124 WeakPolarHBondContact O-CG2 3.2Å; I120-V124 PolarHBondContact O-N 3.44Å; D122-V124 PolarHBondContact O-N 3.5Å; V124-E126 VanDerWaalsContact C-N 3.31Å; V124-E126 PolarHBondContact O-N 2.78Å; V124-E127 PolarHBondContact O-N 2.96Å; V124-V128 HydrophobicContact CG1-CG2 4.35Å; V124-V128 VanDerWaalsContact O-CG2 3.31Å; V124-V128 WeakPolarHBondContact O-CG2 3.11Å; V124-V128 PolarHBondContact O-N 3.2Å; V124-V128 VanDerWaalsContact O-N 3.15Å
125	K	70	Confident	69.3	Low	71 Å²	71	84.7 Å²	84.7	31%	0.309	43%	0.431	S	S	.	.	H	α-helix	trans	-57.3	-46.7	174.9	-77.3	170	-166.8	156.3	0	111.4	I43 I121 D122 M123 V128 V129	I43-K125 HydrophobicContact CD1-CD 3.71Å; I43-K125 HydrophobicContact CD1-CG 3.24Å; I43-K125 HydrophobicContact CG1-CG 3.58Å; I121-K125 VanDerWaalsContact O-CG 3.31Å; I121-K125 WeakPolarHBondContact O-CG 3.28Å; I121-K125 PolarHBondContact O-N 2.93Å; I121-K125 VanDerWaalsContact O-N 3.17Å; D122-K125 WeakPolarHBondContact O-CB 3.41Å; D122-K125 PolarHBondContact O-N 3Å; D122-K125 IonicContact OD1-NZ 2.74Å; D122-K125 PolarHBondContact OD1-NZ 3.07Å; M123-K125 VanDerWaalsContact C-N 3.32Å; M123-K125 PolarHBondContact O-N 2.75Å; K125-V128 PolarHBondContact O-N 3.27Å; K125-V129 VanDerWaalsContact O-CG2 3.29Å; K125-V129 WeakPolarHBondContact O-CG2 3.4Å; K125-V129 PolarHBondContact O-N 2.95Å
126	E	66.8	Low	67.3	Low	139 Å²	139	84.1 Å²	84.1	65%	0.65	45%	0.453	S	S	*	.	H	α-helix	trans	-66.4	-38.8	-178.4	-68.2	-176.7	173.3	0	0	112.3	D122 M123 V124 V128 V129 S130	D122-E126 PolarHBondContact O-N 3.19Å; M123-E126 PolarHBondContact O-N 3.36Å; V124-E126 VanDerWaalsContact C-N 3.31Å; V124-E126 PolarHBondContact O-N 2.78Å; E126-V128 PolarHBondContact O-N 3.46Å; E126-V129 PolarHBondContact O-N 2.82Å; E126-S130 WeakPolarHBondContact O-CB 3.38Å; E126-S130 PolarHBondContact O-N 3.03Å; E126-S130 PolarHBondContact O-OG 2.8Å
127	E	65.2	Low	65.3	Low	87 Å²	87	87.6 Å²	87.6	41%	0.407	49%	0.491	S	S	.	.	H	α-helix	trans	-62.1	-43	175.8	-86.1	-152	-153.8	0	0	113.2	M123 V124 S130 K131	M123-E127 PolarHBondContact O-N 2.67Å; M123-E127 VanDerWaalsContact O-N 3.16Å; V124-E127 PolarHBondContact O-N 2.96Å; E127-S130 PolarHBondContact O-N 3.47Å; E127-K131 PolarHBondContact O-N 2.93Å; E127-K131 IonicContact OE2-NZ 2.82Å; E127-K131 PolarHBondContact OE2-NZ 3.49Å
128	V	62.5	Low	63.5	Low	45 Å²	45	91.1 Å²	91.1	27%	0.273	52%	0.523	S	S	.	.	H	α-helix	trans	-66.9	-42	-179.3	175.3	0	0	0	0	111	M46 V124 K125 E126 S130 K131 G132	M46-V128 HydrophobicContact CE-CG1 3.92Å; M46-V128 HydrophobicContact CE-CG2 3.81Å; M46-V128 HydrophobicContact CG-CG2 3.72Å; M46-V128 HydrophobicContact SD-CG2 3.31Å; M46-V128 WeakPolarHBondContact SD-CG2 3.4Å; V124-V128 HydrophobicContact CG1-CG2 4.35Å; V124-V128 VanDerWaalsContact O-CG2 3.31Å; V124-V128 WeakPolarHBondContact O-CG2 3.11Å; V124-V128 PolarHBondContact O-N 3.2Å; V124-V128 VanDerWaalsContact O-N 3.15Å; K125-V128 PolarHBondContact O-N 3.27Å; E126-V128 PolarHBondContact O-N 3.46Å; V128-S130 VanDerWaalsContact C-N 3.3Å; V128-S130 PolarHBondContact O-N 3.5Å; V128-K131 PolarHBondContact O-N 3.04Å; V128-G132 PolarHBondContact O-N 3.37Å
129	V	59.8	Low	62.1	Low	85 Å²	85	95.2 Å²	95.2	52%	0.515	54%	0.539	S	S	.	.	H	α-helix	trans	-65.2	-37	177.9	174.2	0	0	0	0	111.1	K125 E126	K125-V129 VanDerWaalsContact O-CG2 3.29Å; K125-V129 WeakPolarHBondContact O-CG2 3.4Å; K125-V129 PolarHBondContact O-N 2.95Å; E126-V129 PolarHBondContact O-N 2.82Å
130	S	58.9	Low	60.2	Low	88 Å²	88	97.2 Å²	97.2	62%	0.615	55%	0.548	S	S	*	.	H	α-helix	trans	-71	-40.3	179.8	-59.8	0	0	0	0	112.6	E126 E127 V128	E126-S130 WeakPolarHBondContact O-CB 3.38Å; E126-S130 PolarHBondContact O-N 3.03Å; E126-S130 PolarHBondContact O-OG 2.8Å; E127-S130 PolarHBondContact O-N 3.47Å; V128-S130 VanDerWaalsContact C-N 3.3Å; V128-S130 PolarHBondContact O-N 3.5Å
131	K	56.3	Low	58.2	Low	147 Å²	147	104 Å²	104	64%	0.639	59%	0.585	S	S	*	*	H	α-helix	trans	-79.9	-26.4	178.7	-71.1	168.9	-179.8	159.3	0	113.1	E127 V128 R133 G134	E127-K131 PolarHBondContact O-N 2.93Å; E127-K131 IonicContact OE2-NZ 2.82Å; E127-K131 PolarHBondContact OE2-NZ 3.49Å; V128-K131 PolarHBondContact O-N 3.04Å; K131-R133 VanDerWaalsContact C-N 3.33Å; K131-R133 PolarHBondContact O-N 3.49Å; K131-G134 PolarHBondContact O-N 3.48Å
132	G	52	Low	56.4	Low	59 Å²	59	111 Å²	111	61%	0.608	62%	0.615	S	S	*	*	H	α-helix	trans	-71.7	-20.4	176.3	0	0	0	0	0	114.8	V128	V128-G132 PolarHBondContact O-N 3.37Å
133	R	51	Low	54.6	Low	217 Å²	217	115.2 Å²	115.2	82%	0.819	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-7.2	176.7	-79.4	179.8	163.7	173.4	-3.8	114.6	K131	K131-R133 VanDerWaalsContact C-N 3.33Å; K131-R133 PolarHBondContact O-N 3.49Å
134	G	49.8	Very low	52.8	Low	65 Å²	65	120.9 Å²	120.9	67%	0.67	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-2.9	-177	0	0	0	0	0	116	K131	K131-G134 PolarHBondContact O-N 3.48Å
135	R	50.9	Low	51.3	Low	241 Å²	241	124.2 Å²	124.2	91%	0.909	69%	0.693	S	S	*	*	S	Bend	trans	-137.2	56.4	-172.9	-80.2	-173.6	163.4	176.7	-4.2	113.2
136	G	47.1	Very low	49.7	Very low	78 Å²	78	130.9 Å²	130.9	80%	0.804	72%	0.722	S	S	*	*	S	Bend	trans	167.2	105.9	166.2	0	0	0	0	0	112.9
137	G	43.3	Very low	48.5	Very low	81 Å²	81	128 Å²	128	84%	0.835	73%	0.73	S	S	*	*			trans	125.7	49	160.7	0	0	0	0	0	117.3
138	A	47	Very low	47.2	Very low	108 Å²	108	135.8 Å²	135.8	89%	0.893	76%	0.756	S	S	*	*	S	Bend	trans	-133.4	46.2	154.7	0	0	0	0	0	110.2
139	Q	51.5	Low	45.9	Very low	171 Å²	171	137.6 Å²	137.6	80%	0.799	78%	0.783	S	S	*	*	S	Bend	trans	-145.8	122.1	164.1	-163.7	158.4	-34.8	0	0	110.2
140	Q	43.9	Very low	44.8	Very low	177 Å²	177	137.1 Å²	137.1	83%	0.827	80%	0.795	S	S	*	*			trans	74.6	110.5	168.4	-75.1	173.6	-11.2	0	0	118.6
141	N	40.4	Very low	44	Very low	142 Å²	142	139.2 Å²	139.2	76%	0.759	81%	0.807	S	S	*	*				-152.4	136.2	96.4	-149.1	5.2	0	0	0	114.9
142	K	41.4	Very low	43	Very low	167 Å²	167	136.2 Å²	136.2	73%	0.726	82%	0.818	S	S	*	*			trans	3.4	132.8	153.3	-75.1	170.7	176.3	172.9	0	120
143	Q	40.3	Very low	42.4	Very low	169 Å²	169	145.9 Å²	145.9	79%	0.79	84%	0.836	S	S	*	*				93.7	142.9	63	-161.1	158	25.2	0	0	113.1
144	Q	37.8	Very low	41.6	Very low	195 Å²	195	138.7 Å²	138.7	91%	0.911	83%	0.829	S	S	*	*			trans	86	118	-176.6	-59	177.3	4.5	0	0	113.1
145	G	41.8	Very low	40.9	Very low	77 Å²	77	141.7 Å²	141.7	79%	0.794	83%	0.834	S	S	*	*			cis	122.6	96.4	31.1	0	0	0	0	0	106.8
146	K	36.1	Very low	39.9	Very low	210 Å²	210	140.2 Å²	140.2	91%	0.913	84%	0.835	S	S	*	*			trans	-153.2	95.9	164.6	-124.6	172.5	-178.6	174.7	0	109.1
147	G	41.7	Very low	39.5	Very low	80 Å²	80	139.8 Å²	139.8	83%	0.825	83%	0.831	S	S	*	*			trans	-58	140.2	164.2	0	0	0	0	0	109.9
148	R	38	Very low	39.2	Very low	250 Å²	250	140.2 Å²	140.2	94%	0.943	83%	0.827	S	S	*	*			trans	-147.4	110.4	158.6	-135.1	171.1	176	176.3	-3.5	106.8
149	G	34	Very low	38.5	Very low	82 Å²	82	147.2 Å²	147.2	85%	0.845	83%	0.83	S	S	*	*			trans	-74.6	153.6	-175.2	0	0	0	0	0	113.8
150	G	36.6	Very low	37.8	Very low	75 Å²	75	142.5 Å²	142.5	77%	0.773	83%	0.827	S	S	*	*			trans	89.2	159.2	144.1	0	0	0	0	0	117.9
151	P	43	Very low	37.6	Very low	133 Å²	133	146.5 Å²	146.5	86%	0.864	83%	0.834	S	S	*	*			cis	-133.4	129.4	-32.8	33.6	-16	0	0	0	112
152	G	36.3	Very low	37.2	Very low	84 Å²	84	143.1 Å²	143.1	87%	0.866	83%	0.833	S	S	*	*			trans	-116.2	98	175.4	0	0	0	0	0	111.8
153	R	39.5	Very low	37.2	Very low	261 Å²	261	144 Å²	144	99%	0.985	84%	0.842	S	S	*	*			trans	-56.6	144.5	168.3	-87.9	169.3	155.3	162	-8.2	111.7
154	G	33.8	Very low	36.9	Very low	66 Å²	66	141.7 Å²	141.7	68%	0.68	85%	0.845	S	S	*	*			trans	142.9	78.3	163.1	0	0	0	0	0	113
155	V	34.8	Very low	36.8	Very low	129 Å²	129	136.1 Å²	136.1	78%	0.782	84%	0.84	S	S	*	*				85.1	105.9	90.9	170.3	0	0	0	0	113.3
156	F	29.9	Very low	37.3	Very low	209 Å²	209	139.1 Å²	139.1	92%	0.917	85%	0.845	S	S	*	*			trans	56	133.1	139.6	-78.6	-101.9	0	0	0	122.5
157	G	38.4	Very low	37.2	Very low	70 Å²	70	132.5 Å²	132.5	72%	0.722	84%	0.837	S	S	*	*			trans	136.1	66.6	156.1	0	0	0	0	0	112.7
158	A	36.3	Very low	36.9	Very low	90 Å²	90	141 Å²	141	74%	0.744	84%	0.844	S	S	*	*				52.6	121.5	90.1	0	0	0	0	0	115.5
159	R	33.5	Very low	36.7	Very low	254 Å²	254	132.5 Å²	132.5	96%	0.958	83%	0.834	S	S	*	*			trans	99.6	119.7	130.3	-119.6	173.1	175.9	116.1	-2.7	119.8
160	G	37.1	Very low	36.9	Very low	72 Å²	72	137.1 Å²	137.1	74%	0.742	83%	0.833	S	S	*	*			trans	115.7	100.3	154.9	0	0	0	0	0	112
161	R	37.8	Very low	37.3	Very low	261 Å²	261	142.2 Å²	142.2	99%	0.985	84%	0.837	S	S	*	*			cis	65.4	111.8	43	-152.5	-180	-170.7	-177.4	3	114.4
162	G	33.9	Very low	37.7	Very low	71 Å²	71	140.9 Å²	140.9	73%	0.732	83%	0.829	S	S	*	*			trans	137.9	94.9	167.7	0	0	0	0	0	109.3
163	M	39.6	Very low	38.5	Very low	185 Å²	185	143.2 Å²	143.2	91%	0.911	83%	0.828	S	S	*	*			cis	61.6	91.6	49.2	-159	87.1	102.5	0	0	113.9
164	S	35.2	Very low	38.7	Very low	122 Å²	122	136.5 Å²	136.5	85%	0.853	82%	0.817	S	S	*	*			trans	176.5	97.6	141.6	37.7	0	0	0	0	113.8
165	G	35.5	Very low	39.1	Very low	78 Å²	78	140.5 Å²	140.5	80%	0.804	82%	0.822	S	S	*	*				65	165.2	122	0	0	0	0	0	123.8
166	P	51.7	Low	39.6	Very low	139 Å²	139	144.6 Å²	144.6	90%	0.903	83%	0.83	S	S	*	*			trans	-119.2	165.6	-151	38.6	-22.9	0	0	0	115.5
167	G	34.1	Very low	40	Very low	72 Å²	72	144 Å²	144	74%	0.742	83%	0.826	S	S	*	*			trans	167.6	114.7	165.9	0	0	0	0	0	110.9
168	R	36.2	Very low	40.1	Very low	259 Å²	259	147.5 Å²	147.5	98%	0.977	83%	0.834	S	S	*	*				83.7	116.3	57.7	-155.8	-177.4	-162.9	-170.8	5.2	113.2
169	G	33.4	Very low	40.1	Very low	70 Å²	70	146.7 Å²	146.7	72%	0.722	84%	0.835	S	S	*	*			trans	94.7	151.9	164.4	0	0	0	0	0	114.9
170	Q	38.3	Very low	40.5	Very low	179 Å²	179	145.1 Å²	145.1	84%	0.836	84%	0.835	S	S	*	*			cis	-175.1	132.7	-1.9	-163.9	153.5	14.3	0	0	107
171	Q	44.1	Very low	40.7	Very low	182 Å²	182	145.9 Å²	145.9	85%	0.85	83%	0.834	S	S	*	*			trans	31.6	156.6	152.9	-78.5	-179.3	-4.9	0	0	124.9
172	P	52.3	Low	40.9	Very low	106 Å²	106	143.1 Å²	143.1	69%	0.688	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-95.2	168.5	-167	39.7	-33.7	0	0	0	113.5
173	P	52	Low	41.2	Very low	132 Å²	132	143.2 Å²	143.2	86%	0.857	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-98.7	138.7	170.2	29.6	-18.5	0	0	0	113.8
174	T	43.9	Very low	41.7	Very low	121 Å²	121	143.3 Å²	143.3	74%	0.742	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-97.2	149	172	46.8	0	0	0	0	112.8
175	D	42.9	Very low	42.3	Very low	150 Å²	150	147 Å²	147	80%	0.802	83%	0.834	S	S	*	*			trans	60.9	128.6	146.6	-65.8	-26.5	0	0	0	123
176	K	44.7	Very low	42.6	Very low	214 Å²	214	151.2 Å²	151.2	93%	0.93	84%	0.839	S	S	*	*				-163.8	138.3	114.3	-106.3	168.9	-173.2	178	0	114.6
177	K	39.2	Very low	42.5	Very low	196 Å²	196	152.6 Å²	152.6	85%	0.852	83%	0.833	S	S	*	*			trans	-75.1	156.6	179.5	-65.3	168.8	173.6	174.5	0	114.3
178	T	40.2	Very low	43.1	Very low	144 Å²	144	161.3 Å²	161.3	88%	0.883	85%	0.854	S	S	*	*				-162.7	116.8	129.6	33.6	0	0	0	0	106.6
179	G	36.1	Very low	43.4	Very low	74 Å²	74	156.4 Å²	156.4	76%	0.763	85%	0.848	S	S	*	*				69.4	127.2	76	0	0	0	0	0	110.4
180	K	41.7	Very low	43.9	Very low	220 Å²	220	160.9 Å²	160.9	96%	0.957	85%	0.854	S	S	*	*			cis	-166.7	169.6	21.7	-104.1	-179.7	175	-180	0	109.6
181	A	42.6	Very low	44.3	Very low	88 Å²	88	159.9 Å²	159.9	73%	0.727	86%	0.855	S	S	*	*			trans	-85.5	-174.2	-175.2	0	0	0	0	0	116.4
182	Q	42.2	Very low	44.3	Very low	204 Å²	204	158.6 Å²	158.6	95%	0.953	86%	0.855	S	S	*	*			trans	97.6	134.6	170.3	-65.3	175.4	-56.9	0	0	114.5
183	G	39	Very low	43.8	Very low	72 Å²	72	161.9 Å²	161.9	74%	0.742	87%	0.866	S	S	*	*			cis	145.7	124.1	11.4	0	0	0	0	0	108.2
184	M	49.8	Very low	43.2	Very low	187 Å²	187	163.9 Å²	163.9	92%	0.921	87%	0.866	S	S	*	*			trans	26.5	132.3	159.7	-72	165.8	146.2	0	0	120.9
185	K	48	Very low	43.2	Very low	200 Å²	200	167 Å²	167	87%	0.87	88%	0.875	S	S	*	*			trans	-161.6	112.8	134.2	-103	159.4	-168.2	-171.3	0	110.9
186	N	41.8	Very low	43.2	Very low	167 Å²	167	168.3 Å²	168.3	89%	0.893	88%	0.881	S	S	*	*			trans	-75.5	132	159.4	-77	-9	0	0	0	109.1
187	Q	49.2	Very low	43.1	Very low	167 Å²	167	164.5 Å²	164.5	78%	0.78	88%	0.877	S	S	*	*			trans	-155.9	144.3	155.3	-66.2	-176.4	-10.8	0	0	104.7
188	H	47	Very low	43.4	Very low	255 Å²	255	161.6 Å²	161.6	100%	1.181	88%	0.879	S	S	*	*			cis	-157.4	0	-6.2	-120.8	18.4	0	0	0	104.7

Retrieved 188 of 188 residues in 117.6 ms (Link to these results)

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