A0A077Z1W3_TRITR Loading...

Ubiquitin domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z1W3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 187 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.5	Very low	45.8	Very low	177 Å²	177	103.7 Å²	103.7	87%	0.872	55%	0.549	S	S	*	.				0	104.4	0	-175.1	176.4	-165.7	0	0	105.7	H74	M1-H74 HydrophobicContact CE-CB 4.06Å; M1-H74 WeakPolarHBondContact CE-CE1 3.46Å; M1-H74 WeakPolarHBondContact CE-ND1 3.31Å; M1-H74 WeakPolarHBondContact CG-ND1 3.43Å
2	L	50.4	Low	45.1	Very low	69 Å²	69	103.8 Å²	103.8	36%	0.361	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.1	132	173.4	-85	104.9	0	0	0	108	F4 C75	L2-F4 HydrophobicContact CB-CD2 4.38Å; L2-F4 HydrophobicContact CB-CE2 3.78Å; L2-F4 HydrophobicContact CB-CZ 4.02Å; L2-F4 HydrophobicContact CD2-CE1 4.22Å; L2-F4 HydrophobicContact CD2-CE2 4.35Å; L2-F4 HydrophobicContact CD2-CZ 3.71Å; L2-F4 HydrophobicContact CG-CZ 4.47Å; L2-C75 PolarHBondContact O-N 3.09Å
3	V	48.4	Very low	44.4	Very low	78 Å²	78	111.5 Å²	111.5	47%	0.473	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.4	118.6	174.6	-171.6	0	0	0	0	106.4	V72 H74	V3-V72 HydrophobicContact CG1-CG1 3.36Å; V3-H74 VanDerWaalsContact CG2-CE1 3.47Å; V3-H74 WeakPolarHBondContact CG2-CE1 3.44Å
4	F	53.4	Low	43.5	Very low	68 Å²	68	113.3 Å²	113.3	30%	0.298	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.9	127.8	173.6	-65.7	-76.4	0	0	0	109.5	L2 V72 V73 C75	L2-F4 HydrophobicContact CB-CD2 4.38Å; L2-F4 HydrophobicContact CB-CE2 3.78Å; L2-F4 HydrophobicContact CB-CZ 4.02Å; L2-F4 HydrophobicContact CD2-CE1 4.22Å; L2-F4 HydrophobicContact CD2-CE2 4.35Å; L2-F4 HydrophobicContact CD2-CZ 3.71Å; L2-F4 HydrophobicContact CG-CZ 4.47Å; F4-V72 CarbonylContact O-C 3.55Å; F4-V72 VanDerWaalsContact O-CA 3.3Å; F4-V72 WeakPolarHBondContact O-CA 3.32Å; F4-V73 PolarHBondContact N-O 3.49Å; F4-V73 PolarHBondContact O-N 2.99Å; F4-C75 HydrophobicContact CD2-CB 4.04Å; F4-C75 HydrophobicContact CE2-CB 3.69Å; F4-C75 WeakPolarHBondContact CE2-SG 3.36Å
5	V	50.1	Low	42.9	Very low	84 Å²	84	117.4 Å²	117.4	51%	0.509	62%	0.616	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.1	111.7	174.1	-176.3	0	0	0	0	107.9	Q7 V72	V5-Q7 PolarHBondContact O-N 3.36Å; V5-V72 HydrophobicContact CG2-CG2 4.24Å
6	L	51.9	Low	42.3	Very low	77 Å²	77	121.2 Å²	121.2	40%	0.403	63%	0.629	S	S	.	*			trans	-80.3	90.4	172.4	-82.1	163.5	0	0	0	109	G8 L67 N70 C71 V73	L6-G8 PolarHBondContact O-N 3.4Å; L6-L67 HydrophobicContact CD1-CD2 3.98Å; L6-N70 WeakPolarHBondContact O-CA 3.42Å; L6-N70 PolarHBondContact O-N 3.46Å; L6-N70 PolarHBondContact O-OD1 3.43Å; L6-C71 PolarHBondContact N-O 3.27Å; L6-V73 HydrophobicContact CD1-CG2 4.48Å
7	Q	43	Very low	42.1	Very low	159 Å²	159	123.3 Å²	123.3	74%	0.743	64%	0.64	S	S	*	*			trans	-81.5	107.3	-179.4	-145.8	174.4	-38.8	0	0	110.4	V5 N70	V5-Q7 PolarHBondContact O-N 3.36Å; Q7-N70 WeakPolarHBondContact CA-OD1 3.02Å
8	G	41.2	Very low	42	Very low	19 Å²	19	124.2 Å²	124.2	20%	0.196	65%	0.646	C	S	.	*			trans	-88.2	122.5	170.5	0	0	0	0	0	109.4	L6 N70	L6-G8 PolarHBondContact O-N 3.4Å; G8-N70 PolarHBondContact N-OD1 3.41Å
9	H	43.9	Very low	41.8	Very low	164 Å²	164	126.7 Å²	126.7	76%	0.759	65%	0.654	S	S	*	*	S	Bend	trans	89.3	120.6	169.7	-146.5	-16.3	0	0	0	116.8
10	L	39.2	Very low	41.8	Very low	136 Å²	136	127.9 Å²	127.9	71%	0.712	66%	0.659	S	S	*	*			trans	87.6	123	173	-71.8	102.7	0	0	0	117.3
11	P	37.3	Very low	41.9	Very low	110 Å²	110	129.7 Å²	129.7	71%	0.714	66%	0.664	S	S	*	*			trans	-81.3	162.6	171	36.1	-31.2	0	0	0	109.7
12	T	36.6	Very low	42	Very low	104 Å²	104	129.4 Å²	129.4	64%	0.638	65%	0.653	S	S	*	*			trans	78.5	121.7	172.1	-9.4	0	0	0	0	112.7
13	Y	37	Very low	41.7	Very low	205 Å²	205	132 Å²	132	80%	0.804	68%	0.676	S	S	*	*			cis	-150.2	147.4	40.5	-77	-95.2	0	0	0	112.4
14	T	31.2	Very low	41.9	Very low	136 Å²	136	131.6 Å²	131.6	83%	0.834	67%	0.668	S	S	*	*			trans	-33.5	122.5	165.8	-2.9	0	0	0	0	114.8
15	L	34.7	Very low	41.6	Very low	175 Å²	175	136.7 Å²	136.7	92%	0.916	69%	0.692	S	S	*	*			trans	-141.4	130.7	152	-99.9	167	0	0	0	110.7	L17	L15-L17 PolarHBondContact O-N 3.48Å
16	H	33.3	Very low	41.6	Very low	178 Å²	178	135.6 Å²	135.6	82%	0.824	69%	0.693	S	S	*	*			trans	-86.3	95.7	-161.5	176.2	-84.2	0	0	0	110.9
17	L	39.3	Very low	41.6	Very low	157 Å²	157	138 Å²	138	82%	0.822	71%	0.713	S	S	*	*			trans	-142.7	101.1	167.8	-74.1	174.9	0	0	0	110.8	L15	L15-L17 PolarHBondContact O-N 3.48Å
18	N	39.1	Very low	42	Very low	139 Å²	139	135.8 Å²	135.8	74%	0.743	71%	0.705	S	S	*	*	S	Bend	trans	38.3	108.8	138.9	-140.4	-30.2	0	0	0	118.3
19	Q	39.5	Very low	42.5	Very low	173 Å²	173	137.8 Å²	137.8	81%	0.808	71%	0.711	S	S	*	*	S	Bend	trans	71.6	98.8	157.1	-95.2	170	-58.9	0	0	118.4
20	M	41.5	Very low	42.8	Very low	150 Å²	150	134.5 Å²	134.5	74%	0.739	70%	0.703	S	S	*	*			trans	65.9	59.5	151.2	-74.8	-163.9	159.7	0	0	117.7
21	E	43.7	Very low	43.4	Very low	166 Å²	166	131.4 Å²	131.4	78%	0.776	69%	0.687	S	S	*	*			trans	-93.8	98.7	155.5	-61.4	-167.2	148	0	0	108.9	C23	E21-C23 PolarHBondContact O-N 3.18Å
22	R	46.8	Very low	44.3	Very low	171 Å²	171	130.7 Å²	130.7	65%	0.645	67%	0.672	S	S	*	*			trans	-82.1	106.8	163.5	-74.3	-163.1	-171.1	-166.7	9.6	107.7	F24	R22-F24 PolarHBondContact O-N 3.26Å
23	C	44.2	Very low	45	Very low	124 Å²	124	132.2 Å²	132.2	84%	0.838	67%	0.666	S	S	*	*			trans	-64.4	112.3	166.3	-68.3	0	0	0	0	109	E21	E21-C23 PolarHBondContact O-N 3.18Å
24	F	53.3	Low	45.9	Very low	69 Å²	69	129.1 Å²	129.1	30%	0.303	66%	0.659	S	S	.	*			trans	-100.8	110.1	172.9	-138.1	-98.6	0	0	0	109.2	R22 N31 F32 N35	R22-F24 PolarHBondContact O-N 3.26Å; F24-N31 HydrophobicContact CE1-CB 4.27Å; F24-F32 HydrophobicContact CB-CE2 3.99Å; F24-F32 AromaticContact CD1-CD2 3.7Å; F24-F32 HydrophobicContact CD1-CD2 3.7Å; F24-F32 AromaticContact CD1-CE2 3.78Å; F24-F32 HydrophobicContact CD1-CE2 3.78Å; F24-F32 AromaticContact CE1-CD2 3.99Å; F24-F32 HydrophobicContact CE1-CD2 3.99Å; F24-F32 HydrophobicContact CE1-CE2 4.43Å; F24-F32 HydrophobicContact CG-CD2 4.21Å; F24-F32 AromaticContact CG-CE2 3.83Å; F24-F32 HydrophobicContact CG-CE2 3.83Å; F24-N35 HydrophobicContact CE2-CB 3.62Å; F24-N35 HydrophobicContact CZ-CB 3.5Å
25	Q	46.9	Very low	47	Very low	174 Å²	174	125.1 Å²	125.1	81%	0.813	63%	0.633	S	S	*	*			trans	-84.6	134.3	174.4	-158.9	100.7	-28.8	0	0	108.6
26	A	49.9	Very low	48.1	Very low	62 Å²	62	119.3 Å²	119.3	51%	0.512	60%	0.6	S	S	.	*	S	Bend	trans	97.8	134.3	165.7	0	0	0	0	0	117.8	L28	A26-L28 PolarHBondContact O-N 3.44Å
27	P	53	Low	49	Very low	128 Å²	128	112.8 Å²	112.8	83%	0.831	58%	0.578	S	S	*	*			trans	-87.4	14.1	-153.5	36.4	-39.3	0	0	0	115.8
28	L	49.9	Very low	49.7	Very low	111 Å²	111	109.3 Å²	109.3	58%	0.581	57%	0.566	S	S	*	*			trans	-97.7	120.6	-175.9	-88.4	111	0	0	0	112.6	A26 V30 N31	A26-L28 PolarHBondContact O-N 3.44Å; L28-V30 PolarHBondContact O-N 2.97Å; L28-N31 PolarHBondContact O-N 3.03Å
29	L	51.4	Low	50.4	Low	62 Å²	62	105.1 Å²	105.1	33%	0.325	54%	0.544	S	S	.	.	H	α-helix	trans	-49.5	-30.6	171.1	-156.5	85.7	0	0	0	112.5	N31 F32 R33 L62	L29-N31 VanDerWaalsContact C-N 3.34Å; L29-N31 PolarHBondContact O-N 3.19Å; L29-F32 PolarHBondContact O-N 3.29Å; L29-R33 PolarHBondContact O-N 2.97Å; L29-L62 HydrophobicContact CD1-CD1 3.29Å
30	V	50.4	Low	51.2	Low	95 Å²	95	101.1 Å²	101.1	58%	0.576	53%	0.528	S	S	*	.	H	α-helix	trans	-59.9	-38.8	177.2	132.9	0	0	0	0	112.7	L28	L28-V30 PolarHBondContact O-N 2.97Å
31	N	52.8	Low	51.7	Low	70 Å²	70	102.4 Å²	102.4	37%	0.374	53%	0.532	S	S	.	.	H	α-helix	trans	-77.8	-25.1	179.6	-93.3	-17.9	0	0	0	112.5	F24 L28 L29 Q34 N35	F24-N31 HydrophobicContact CE1-CB 4.27Å; L28-N31 PolarHBondContact O-N 3.03Å; L29-N31 VanDerWaalsContact C-N 3.34Å; L29-N31 PolarHBondContact O-N 3.19Å; N31-Q34 PolarHBondContact O-N 3.05Å; N31-N35 PolarHBondContact O-N 3.33Å
32	F	55.3	Low	52.3	Low	95 Å²	95	100.5 Å²	100.5	42%	0.417	52%	0.523	S	S	.	.	H	α-helix	trans	-68.8	-37.6	178.2	-131.5	-94.7	0	0	0	111.5	F24 L29 Q34 N35 F36	F24-F32 HydrophobicContact CB-CE2 3.99Å; F24-F32 AromaticContact CD1-CD2 3.7Å; F24-F32 HydrophobicContact CD1-CD2 3.7Å; F24-F32 AromaticContact CD1-CE2 3.78Å; F24-F32 HydrophobicContact CD1-CE2 3.78Å; F24-F32 AromaticContact CE1-CD2 3.99Å; F24-F32 HydrophobicContact CE1-CD2 3.99Å; F24-F32 HydrophobicContact CE1-CE2 4.43Å; F24-F32 HydrophobicContact CG-CD2 4.21Å; F24-F32 AromaticContact CG-CE2 3.83Å; F24-F32 HydrophobicContact CG-CE2 3.83Å; L29-F32 PolarHBondContact O-N 3.29Å; F32-Q34 VanDerWaalsContact C-N 3.32Å; F32-Q34 PolarHBondContact O-N 3.43Å; F32-N35 PolarHBondContact O-N 3.13Å; F32-F36 AromaticContact CD1-CD2 3.73Å; F32-F36 HydrophobicContact CD1-CD2 3.73Å; F32-F36 AromaticContact CD1-CE2 3.67Å; F32-F36 HydrophobicContact CD1-CE2 3.67Å; F32-F36 AromaticContact CE1-CD2 3.87Å; F32-F36 HydrophobicContact CE1-CD2 3.87Å; F32-F36 AromaticContact CE1-CE2 3.29Å; F32-F36 HydrophobicContact CE1-CE2 3.29Å; F32-F36 HydrophobicContact CE1-CZ 4.21Å; F32-F36 HydrophobicContact CZ-CE2 4.05Å; F32-F36 WeakPolarHBondContact O-CD2 3.47Å; F32-F36 PolarHBondContact O-N 2.8Å
33	R	52.4	Low	52.4	Low	136 Å²	136	93.9 Å²	93.9	51%	0.513	51%	0.508	S	S	.	.	H	α-helix	trans	-67.2	-30.3	176.3	-70	-170.8	70.8	144.9	2.7	113.4	L29 A37	L29-R33 PolarHBondContact O-N 2.97Å; R33-A37 PolarHBondContact O-N 3.32Å; R33-A37 VanDerWaalsContact O-N 3.13Å
34	Q	55.6	Low	52.7	Low	140 Å²	140	89.6 Å²	89.6	65%	0.654	48%	0.475	S	S	*	.	H	α-helix	trans	-72.7	-37.3	175.9	-72.8	-177.5	-3.1	0	0	112	N31 F32 F36 A37	N31-Q34 PolarHBondContact O-N 3.05Å; F32-Q34 VanDerWaalsContact C-N 3.32Å; F32-Q34 PolarHBondContact O-N 3.43Å; Q34-F36 VanDerWaalsContact C-N 3.31Å; Q34-F36 PolarHBondContact O-N 3.33Å; Q34-A37 WeakPolarHBondContact O-CB 3.46Å; Q34-A37 PolarHBondContact O-N 3.22Å
35	N	54.5	Low	52.6	Low	52 Å²	52	88.4 Å²	88.4	28%	0.278	47%	0.473	S	S	.	.	H	α-helix	trans	-76.6	-17.4	179.4	-173.8	81.6	0	0	0	113.9	F24 N31 F32	F24-N35 HydrophobicContact CE2-CB 3.62Å; F24-N35 HydrophobicContact CZ-CB 3.5Å; N31-N35 PolarHBondContact O-N 3.33Å; F32-N35 PolarHBondContact O-N 3.13Å
36	F	56.5	Low	53	Low	53 Å²	53	82.6 Å²	82.6	23%	0.232	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	10.2	171.6	-75.8	-85.5	0	0	0	112.9	F32 Q34 S38 D39 L40	F32-F36 AromaticContact CD1-CD2 3.73Å; F32-F36 HydrophobicContact CD1-CD2 3.73Å; F32-F36 AromaticContact CD1-CE2 3.67Å; F32-F36 HydrophobicContact CD1-CE2 3.67Å; F32-F36 AromaticContact CE1-CD2 3.87Å; F32-F36 HydrophobicContact CE1-CD2 3.87Å; F32-F36 AromaticContact CE1-CE2 3.29Å; F32-F36 HydrophobicContact CE1-CE2 3.29Å; F32-F36 HydrophobicContact CE1-CZ 4.21Å; F32-F36 HydrophobicContact CZ-CE2 4.05Å; F32-F36 WeakPolarHBondContact O-CD2 3.47Å; F32-F36 PolarHBondContact O-N 2.8Å; Q34-F36 VanDerWaalsContact C-N 3.31Å; Q34-F36 PolarHBondContact O-N 3.33Å; F36-S38 VanDerWaalsContact C-N 3.29Å; F36-S38 PolarHBondContact O-N 3.18Å; F36-D39 HydrophobicContact CD1-CB 4.1Å; F36-D39 CarbonylContact O-C 3.57Å; F36-D39 PolarHBondContact O-N 3.49Å; F36-L40 VanDerWaalsContact O-CB 3.32Å; F36-L40 WeakPolarHBondContact O-CB 3.47Å; F36-L40 PolarHBondContact O-N 3.02Å
37	A	53.2	Low	53.3	Low	42 Å²	42	83.7 Å²	83.7	35%	0.347	44%	0.441	S	S	.	.	H	α-helix	trans	-57.8	-42.5	-179.4	0	0	0	0	0	111.9	R33 Q34 D39 L40 E41	R33-A37 PolarHBondContact O-N 3.32Å; R33-A37 VanDerWaalsContact O-N 3.13Å; Q34-A37 WeakPolarHBondContact O-CB 3.46Å; Q34-A37 PolarHBondContact O-N 3.22Å; A37-D39 VanDerWaalsContact C-N 3.33Å; A37-D39 PolarHBondContact O-N 2.84Å; A37-L40 PolarHBondContact O-N 3.43Å; A37-E41 WeakPolarHBondContact O-CG 3.3Å; A37-E41 PolarHBondContact O-N 3.27Å
38	S	54.5	Low	53.5	Low	84 Å²	84	79.8 Å²	79.8	59%	0.587	41%	0.413	S	S	*	.	H	α-helix	trans	-68.8	-26.7	176.3	45	0	0	0	0	114	F36	F36-S38 VanDerWaalsContact C-N 3.29Å; F36-S38 PolarHBondContact O-N 3.18Å
39	D	53.4	Low	54	Low	51 Å²	51	77.7 Å²	77.7	27%	0.273	40%	0.401	S	S	.	.	H	α-helix	trans	-86.7	-24.5	175.5	-83.6	-53.8	0	0	0	112.2	F36 A37 E42 K44	F36-D39 HydrophobicContact CD1-CB 4.1Å; F36-D39 CarbonylContact O-C 3.57Å; F36-D39 PolarHBondContact O-N 3.49Å; A37-D39 VanDerWaalsContact C-N 3.33Å; A37-D39 PolarHBondContact O-N 2.84Å; D39-E42 PolarHBondContact O-N 3.4Å; D39-K44 HydrophobicContact CB-CD 4.27Å; D39-K44 WeakPolarHBondContact O-CB 3.24Å; D39-K44 IonicContact OD1-NZ 2.77Å; D39-K44 PolarHBondContact OD1-NZ 2.77Å
40	L	55.4	Low	54.2	Low	89 Å²	89	75.8 Å²	75.8	47%	0.466	39%	0.39	S	S	.	.	H	α-helix	trans	-79.6	-32.5	177.1	-159.5	73	0	0	0	111.5	F36 A37 E42 G43	F36-L40 VanDerWaalsContact O-CB 3.32Å; F36-L40 WeakPolarHBondContact O-CB 3.47Å; F36-L40 PolarHBondContact O-N 3.02Å; A37-L40 PolarHBondContact O-N 3.43Å; L40-E42 PolarHBondContact O-N 3.02Å; L40-G43 PolarHBondContact O-N 3.22Å
41	E	53.6	Low	54.4	Low	176 Å²	176	80.8 Å²	80.8	82%	0.822	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-24.3	168.8	-77	-177.3	161.5	0	0	112.4	A37 G43	A37-E41 WeakPolarHBondContact O-CG 3.3Å; A37-E41 PolarHBondContact O-N 3.27Å; E41-G43 VanDerWaalsContact C-N 3.26Å; E41-G43 PolarHBondContact O-N 2.77Å
42	E	54.7	Low	54.6	Low	126 Å²	126	81.1 Å²	81.1	59%	0.589	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	4.8	177.1	-124.2	178.2	-162.3	0	0	113.8	D39 L40 K44	D39-E42 PolarHBondContact O-N 3.4Å; L40-E42 PolarHBondContact O-N 3.02Å; E42-K44 VanDerWaalsContact C-N 3.3Å; E42-K44 PolarHBondContact O-N 3Å; E42-K44 IonicContact OE2-NZ 2.77Å; E42-K44 PolarHBondContact OE2-NZ 3.22Å
43	G	48.8	Very low	54.6	Low	33 Å²	33	82.2 Å²	82.2	34%	0.34	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	15.7	178.2	0	0	0	0	0	114.7	L40 E41 V45	L40-G43 PolarHBondContact O-N 3.22Å; E41-G43 VanDerWaalsContact C-N 3.26Å; E41-G43 PolarHBondContact O-N 2.77Å; G43-V45 PolarHBondContact O-N 3.37Å
44	K	50.4	Low	54.9	Low	33 Å²	33	78.7 Å²	78.7	14%	0.143	42%	0.416	C	S	.	.			trans	-73	127	174.7	-77.6	166.3	-179.6	144.7	0	110.7	D39 E42 I77 H79	D39-K44 HydrophobicContact CB-CD 4.27Å; D39-K44 WeakPolarHBondContact O-CB 3.24Å; D39-K44 IonicContact OD1-NZ 2.77Å; D39-K44 PolarHBondContact OD1-NZ 2.77Å; E42-K44 VanDerWaalsContact C-N 3.3Å; E42-K44 PolarHBondContact O-N 3Å; E42-K44 IonicContact OE2-NZ 2.77Å; E42-K44 PolarHBondContact OE2-NZ 3.22Å; K44-I77 HydrophobicContact CB-CG2 4.15Å; K44-I77 HydrophobicContact CD-CG2 4.01Å; K44-I77 HydrophobicContact CG-CG2 4.13Å; K44-H79 WeakPolarHBondContact CE-CE1 3.38Å; K44-H79 WeakPolarHBondContact CE-NE2 3Å
45	V	51.5	Low	54.9	Low	44 Å²	44	73 Å²	73	27%	0.267	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	110.3	169.5	-179	0	0	0	0	108.1	G43 R47 S78 V80	G43-V45 PolarHBondContact O-N 3.37Å; V45-R47 HydrophobicContact CG1-CG 4.18Å; V45-S78 PolarHBondContact N-O 3.18Å; V45-S78 PolarHBondContact O-N 2.89Å; V45-S78 PolarHBondContact O-OG 3.39Å; V45-V80 VanDerWaalsContact CG2-O 3.31Å; V45-V80 WeakPolarHBondContact CG2-O 3.18Å
46	V	54.9	Low	55.1	Low	53 Å²	53	79.1 Å²	79.1	32%	0.321	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	105	174.2	-176.2	0	0	0	0	108.5	L48 I77	V46-L48 HydrophobicContact CG1-CD1 4.1Å; V46-I77 HydrophobicContact CG1-CG1 4.22Å; V46-I77 HydrophobicContact CG2-CG1 4.14Å; V46-I77 HydrophobicContact CG2-CG2 4.38Å
47	R	56.4	Low	54.9	Low	85 Å²	85	80.7 Å²	80.7	32%	0.321	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	110.6	172.6	-76.7	173.9	178.7	-167.3	6.3	108.7	V45 L54 H76	V45-R47 HydrophobicContact CG1-CG 4.18Å; R47-L54 HydrophobicContact CB-CD1 3.82Å; R47-L54 HydrophobicContact CG-CD1 4.04Å; R47-H76 PolarHBondContact N-O 2.95Å; R47-H76 PolarHBondContact O-N 3.37Å
48	L	58.1	Low	55	Low	46 Å²	46	84.2 Å²	84.2	24%	0.241	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	125.3	170.1	-120.6	73.2	0	0	0	109.3	V46 L55 V73 C75	V46-L48 HydrophobicContact CG1-CD1 4.1Å; L48-L55 HydrophobicContact CB-CB 4.49Å; L48-L55 PolarHBondContact O-N 2.89Å; L48-L55 VanDerWaalsContact O-N 3.09Å; L48-V73 HydrophobicContact CD2-CG1 3.73Å; L48-V73 HydrophobicContact CG-CG1 3.61Å; L48-C75 HydrophobicContact CD1-CB 4Å
49	I	59.6	Low	54.8	Low	67 Å²	67	85.2 Å²	85.2	34%	0.344	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.4	176.2	-57.6	169.8	0	0	0	107.7	L54 H74 H76	I49-L54 HydrophobicContact CD1-CD1 4.46Å; I49-L54 HydrophobicContact CG1-CD1 3.86Å; I49-H74 PolarHBondContact N-O 3.09Å; I49-H74 PolarHBondContact O-N 3.34Å; I49-H76 HydrophobicContact CD1-CB 4.44Å
50	Y	56.6	Low	54.5	Low	21 Å²	21	89.7 Å²	89.7	8%	0.082	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	131.3	175.7	-178.7	-108.9	0	0	0	110	G52 Q53 L67 C71 V73	Y50-G52 PolarHBondContact O-N 3.34Å; Y50-Q53 PolarHBondContact N-O 3.46Å; Y50-Q53 VanDerWaalsContact N-O 3.09Å; Y50-Q53 PolarHBondContact O-N 3.19Å; Y50-L67 HydrophobicContact CD1-CD1 3.24Å; Y50-L67 HydrophobicContact CD1-CG 3.99Å; Y50-L67 HydrophobicContact CD2-CD1 3.96Å; Y50-L67 HydrophobicContact CD2-CD2 4.31Å; Y50-L67 HydrophobicContact CD2-CG 4.2Å; Y50-L67 HydrophobicContact CE1-CD1 3.45Å; Y50-L67 VanDerWaalsContact CE1-CD1 3.45Å; Y50-L67 HydrophobicContact CE1-CG 3.7Å; Y50-L67 HydrophobicContact CE2-CD1 4.18Å; Y50-L67 HydrophobicContact CE2-CD2 4.23Å; Y50-L67 HydrophobicContact CE2-CG 3.98Å; Y50-L67 HydrophobicContact CG-CD1 3.51Å; Y50-L67 HydrophobicContact CG-CG 4.22Å; Y50-C71 HydrophobicContact CE2-CB 3.65Å; Y50-C71 PolarHBondContact OH-SG 2.9Å; Y50-V73 HydrophobicContact CD2-CG2 4.04Å
51	R	54.3	Low	54.3	Low	201 Å²	201	88.6 Å²	88.6	76%	0.758	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	37.6	-176.8	-71.2	-173.8	172	-168.3	-2.6	115	Q53	R51-Q53 PolarHBondContact O-N 2.97Å
52	G	57.6	Low	54.3	Low	76 Å²	76	82.5 Å²	82.5	78%	0.784	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	7.9	-177.6	0	0	0	0	0	114.2	Y50	Y50-G52 PolarHBondContact O-N 3.34Å
53	Q	55.1	Low	54.3	Low	118 Å²	118	80.3 Å²	80.3	55%	0.551	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.9	171.2	-62.8	-164.8	-14.4	0	0	109.6	Y50 R51 L55	Y50-Q53 PolarHBondContact N-O 3.46Å; Y50-Q53 VanDerWaalsContact N-O 3.09Å; Y50-Q53 PolarHBondContact O-N 3.19Å; R51-Q53 PolarHBondContact O-N 2.97Å; Q53-L55 PolarHBondContact O-N 3.48Å
54	L	57.3	Low	54.5	Low	62 Å²	62	81.6 Å²	81.6	33%	0.325	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	107.1	170.2	-172.4	74.8	0	0	0	107.3	R47 I49 R56	R47-L54 HydrophobicContact CB-CD1 3.82Å; R47-L54 HydrophobicContact CG-CD1 4.04Å; I49-L54 HydrophobicContact CD1-CD1 4.46Å; I49-L54 HydrophobicContact CG1-CD1 3.86Å; L54-R56 HydrophobicContact CD2-CG 3.82Å; L54-R56 HydrophobicContact CG-CG 4.12Å; L54-R56 PolarHBondContact O-N 3.06Å
55	L	56.7	Low	54.6	Low	22 Å²	22	82.7 Å²	82.7	12%	0.115	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	98.8	171.8	-98	66.7	0	0	0	107.6	L48 Q53 Y65	L48-L55 HydrophobicContact CB-CB 4.49Å; L48-L55 PolarHBondContact O-N 2.89Å; L48-L55 VanDerWaalsContact O-N 3.09Å; Q53-L55 PolarHBondContact O-N 3.48Å; L55-Y65 HydrophobicContact CD1-CD1 3.71Å; L55-Y65 HydrophobicContact CD1-CD2 4.17Å; L55-Y65 HydrophobicContact CD1-CE1 3.67Å; L55-Y65 HydrophobicContact CD1-CE2 4.12Å; L55-Y65 HydrophobicContact CD1-CG 3.96Å; L55-Y65 HydrophobicContact CD2-CD2 3.78Å; L55-Y65 HydrophobicContact CD2-CE2 3.88Å; L55-Y65 HydrophobicContact CD2-CG 4.25Å; L55-Y65 HydrophobicContact CG-CD1 4.33Å; L55-Y65 HydrophobicContact CG-CD2 3.96Å; L55-Y65 HydrophobicContact CG-CE1 4.06Å; L55-Y65 HydrophobicContact CG-CE2 3.65Å; L55-Y65 HydrophobicContact CG-CG 4.28Å
56	R	57.6	Low	54.7	Low	179 Å²	179	81.9 Å²	81.9	68%	0.675	44%	0.437	S	S	*	.			trans	-91.3	-15.8	171.9	-77.7	-178.6	167.7	164.6	-1.6	112.5	L54 D58	L54-R56 HydrophobicContact CD2-CG 3.82Å; L54-R56 HydrophobicContact CG-CG 4.12Å; L54-R56 PolarHBondContact O-N 3.06Å; R56-D58 PolarHBondContact O-N 3.42Å
57	D	53.9	Low	54.7	Low	86 Å²	86	80.6 Å²	80.6	46%	0.46	43%	0.428	S	S	.	.			trans	-97.9	94.5	-175.7	-71.1	-36	0	0	0	111.2	S59 R60	D57-S59 PolarHBondContact O-N 3.11Å; D57-R60 PolarHBondContact O-N 3.41Å
58	D	54.9	Low	54.7	Low	117 Å²	117	84.3 Å²	84.3	63%	0.626	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-4.1	169.5	-79.1	-17.3	0	0	0	113.7	R56	R56-D58 PolarHBondContact O-N 3.42Å
59	S	49.4	Very low	54.6	Low	104 Å²	104	88.4 Å²	88.4	73%	0.727	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-9.1	-175.4	60.7	0	0	0	0	114.3	D57	D57-S59 PolarHBondContact O-N 3.11Å
60	R	48.1	Very low	54.1	Low	145 Å²	145	89.9 Å²	89.9	55%	0.547	48%	0.477	S	S	.	.	S	Bend	trans	-111	132.3	-179.7	-80.3	-173.8	177.7	-134.1	4.5	111.9	D57 S64 Y65	D57-R60 PolarHBondContact O-N 3.41Å; R60-S64 PolarHBondContact NH1-OG 3.14Å; R60-Y65 HydrophobicContact CB-CE2 4.24Å
61	S	51.6	Low	54	Low	67 Å²	67	89.7 Å²	89.7	47%	0.469	48%	0.479	S	S	.	.			trans	-58.6	142.9	175.1	60	0	0	0	0	110.8	A63 S64	S61-A63 PolarHBondContact O-N 3Å; S61-S64 VanDerWaalsContact O-CB 3.24Å; S61-S64 WeakPolarHBondContact O-CB 3.14Å; S61-S64 PolarHBondContact O-N 3.44Å
62	L	53.1	Low	53.9	Low	47 Å²	47	83.2 Å²	83.2	25%	0.246	46%	0.462	C	S	.	.	G	3₁₀ helix	trans	-52.1	-27.7	174.5	-111.4	82.5	0	0	0	112.8	L29 S64 Y65 L67	L29-L62 HydrophobicContact CD1-CD1 3.29Å; L62-S64 VanDerWaalsContact C-N 3.3Å; L62-S64 PolarHBondContact O-N 3.29Å; L62-Y65 PolarHBondContact O-N 3.41Å; L62-Y65 VanDerWaalsContact O-N 3.11Å; L62-L67 HydrophobicContact CB-CB 4.42Å; L62-L67 HydrophobicContact CD2-CB 4.22Å; L62-L67 HydrophobicContact CD2-CD1 4.04Å; L62-L67 HydrophobicContact CD2-CD2 3.68Å; L62-L67 HydrophobicContact CD2-CG 4.17Å; L62-L67 HydrophobicContact CG-CB 4.47Å; L62-L67 HydrophobicContact CG-CD1 4.05Å; L62-L67 PolarHBondContact O-N 2.85Å
63	A	54.9	Low	53.9	Low	80 Å²	80	80 Å²	80	66%	0.661	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-61.6	-33.9	173.9	0	0	0	0	0	113.1	S61 Y65 G66	S61-A63 PolarHBondContact O-N 3Å; A63-Y65 PolarHBondContact O-N 3.12Å; A63-G66 PolarHBondContact O-N 2.95Å; A63-G66 VanDerWaalsContact O-N 3.14Å
64	S	52.6	Low	53.9	Low	61 Å²	61	77.2 Å²	77.2	43%	0.427	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-65.5	-21.8	174.9	172.7	0	0	0	0	112.9	R60 S61 L62 G66	R60-S64 PolarHBondContact NH1-OG 3.14Å; S61-S64 VanDerWaalsContact O-CB 3.24Å; S61-S64 WeakPolarHBondContact O-CB 3.14Å; S61-S64 PolarHBondContact O-N 3.44Å; L62-S64 VanDerWaalsContact C-N 3.3Å; L62-S64 PolarHBondContact O-N 3.29Å; S64-G66 VanDerWaalsContact C-N 3.34Å
65	Y	52	Low	53.8	Low	56 Å²	56	74.5 Å²	74.5	22%	0.22	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-93	5.3	177.7	-79.5	-82.4	0	0	0	112.8	L55 R60 L62 A63 L67	L55-Y65 HydrophobicContact CD1-CD1 3.71Å; L55-Y65 HydrophobicContact CD1-CD2 4.17Å; L55-Y65 HydrophobicContact CD1-CE1 3.67Å; L55-Y65 HydrophobicContact CD1-CE2 4.12Å; L55-Y65 HydrophobicContact CD1-CG 3.96Å; L55-Y65 HydrophobicContact CD2-CD2 3.78Å; L55-Y65 HydrophobicContact CD2-CE2 3.88Å; L55-Y65 HydrophobicContact CD2-CG 4.25Å; L55-Y65 HydrophobicContact CG-CD1 4.33Å; L55-Y65 HydrophobicContact CG-CD2 3.96Å; L55-Y65 HydrophobicContact CG-CE1 4.06Å; L55-Y65 HydrophobicContact CG-CE2 3.65Å; L55-Y65 HydrophobicContact CG-CG 4.28Å; R60-Y65 HydrophobicContact CB-CE2 4.24Å; L62-Y65 PolarHBondContact O-N 3.41Å; L62-Y65 VanDerWaalsContact O-N 3.11Å; A63-Y65 PolarHBondContact O-N 3.12Å; Y65-L67 VanDerWaalsContact C-N 3.28Å; Y65-L67 PolarHBondContact O-N 3.48Å
66	G	53.5	Low	53.6	Low	26 Å²	26	78 Å²	78	27%	0.268	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	32	-177.9	0	0	0	0	0	112.6	A63 S64 F68	A63-G66 PolarHBondContact O-N 2.95Å; A63-G66 VanDerWaalsContact O-N 3.14Å; S64-G66 VanDerWaalsContact C-N 3.34Å; G66-F68 WeakPolarHBondContact O-CD2 3Å; G66-F68 PolarHBondContact O-N 2.97Å
67	L	55.4	Low	53.6	Low	26 Å²	26	72.5 Å²	72.5	14%	0.136	40%	0.399	C	S	.	.			trans	-73.9	105.4	167.2	-103.9	110.2	0	0	0	108.7	L6 Y50 L62 Y65 C71 V73	L6-L67 HydrophobicContact CD1-CD2 3.98Å; Y50-L67 HydrophobicContact CD1-CD1 3.24Å; Y50-L67 HydrophobicContact CD1-CG 3.99Å; Y50-L67 HydrophobicContact CD2-CD1 3.96Å; Y50-L67 HydrophobicContact CD2-CD2 4.31Å; Y50-L67 HydrophobicContact CD2-CG 4.2Å; Y50-L67 HydrophobicContact CE1-CD1 3.45Å; Y50-L67 VanDerWaalsContact CE1-CD1 3.45Å; Y50-L67 HydrophobicContact CE1-CG 3.7Å; Y50-L67 HydrophobicContact CE2-CD1 4.18Å; Y50-L67 HydrophobicContact CE2-CD2 4.23Å; Y50-L67 HydrophobicContact CE2-CG 3.98Å; Y50-L67 HydrophobicContact CG-CD1 3.51Å; Y50-L67 HydrophobicContact CG-CG 4.22Å; L62-L67 HydrophobicContact CB-CB 4.42Å; L62-L67 HydrophobicContact CD2-CB 4.22Å; L62-L67 HydrophobicContact CD2-CD1 4.04Å; L62-L67 HydrophobicContact CD2-CD2 3.68Å; L62-L67 HydrophobicContact CD2-CG 4.17Å; L62-L67 HydrophobicContact CG-CB 4.47Å; L62-L67 HydrophobicContact CG-CD1 4.05Å; L62-L67 PolarHBondContact O-N 2.85Å; Y65-L67 VanDerWaalsContact C-N 3.28Å; Y65-L67 PolarHBondContact O-N 3.48Å; L67-C71 HydrophobicContact CD2-CB 3.52Å; L67-C71 HydrophobicContact CG-CB 4.03Å; L67-V73 HydrophobicContact CD2-CG2 3.59Å
68	F	56.3	Low	53.5	Low	163 Å²	163	69.6 Å²	69.6	72%	0.715	39%	0.385	S	S	*	.			trans	-92.5	167.4	168.1	-64.6	-84.5	0	0	0	109.6	G66 C71	G66-F68 WeakPolarHBondContact O-CD2 3Å; G66-F68 PolarHBondContact O-N 2.97Å; F68-C71 PolarHBondContact O-N 3.44Å; F68-C71 PolarHBondContact O-SG 2.87Å
69	D	55.6	Low	53.4	Low	132 Å²	132	70 Å²	70	71%	0.706	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	144.7	173	-71.8	-30.8	0	0	0	111.6
70	N	50.2	Low	53.6	Low	98 Å²	98	70 Å²	70	52%	0.524	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	18.6	-175	-57.4	-27.7	0	0	0	116.8	L6 Q7 G8	L6-N70 WeakPolarHBondContact O-CA 3.42Å; L6-N70 PolarHBondContact O-N 3.46Å; L6-N70 PolarHBondContact O-OD1 3.43Å; Q7-N70 WeakPolarHBondContact CA-OD1 3.02Å; G8-N70 PolarHBondContact N-OD1 3.41Å
71	C	53.9	Low	53.7	Low	17 Å²	17	67 Å²	67	12%	0.115	38%	0.377	C	S	.	.			trans	-78.9	127.9	173.4	-71.9	0	0	0	0	112.2	L6 Y50 L67 F68	L6-C71 PolarHBondContact N-O 3.27Å; Y50-C71 HydrophobicContact CE2-CB 3.65Å; Y50-C71 PolarHBondContact OH-SG 2.9Å; L67-C71 HydrophobicContact CD2-CB 3.52Å; L67-C71 HydrophobicContact CG-CB 4.03Å; F68-C71 PolarHBondContact O-N 3.44Å; F68-C71 PolarHBondContact O-SG 2.87Å
72	V	53	Low	53.3	Low	66 Å²	66	71.5 Å²	71.5	40%	0.4	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	118.3	170.9	-175.1	0	0	0	0	108.5	V3 F4 V5	V3-V72 HydrophobicContact CG1-CG1 3.36Å; F4-V72 CarbonylContact O-C 3.55Å; F4-V72 VanDerWaalsContact O-CA 3.3Å; F4-V72 WeakPolarHBondContact O-CA 3.32Å; V5-V72 HydrophobicContact CG2-CG2 4.24Å
73	V	57.9	Low	53	Low	8 Å²	8	75 Å²	75	5%	0.048	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	125.2	178.6	-177	0	0	0	0	108.6	F4 L6 L48 Y50 L67	F4-V73 PolarHBondContact N-O 3.49Å; F4-V73 PolarHBondContact O-N 2.99Å; L6-V73 HydrophobicContact CD1-CG2 4.48Å; L48-V73 HydrophobicContact CD2-CG1 3.73Å; L48-V73 HydrophobicContact CG-CG1 3.61Å; Y50-V73 HydrophobicContact CD2-CG2 4.04Å; L67-V73 HydrophobicContact CD2-CG2 3.59Å
74	H	54.9	Low	52.5	Low	59 Å²	59	75.5 Å²	75.5	27%	0.273	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	115.7	171.8	-75.2	-91.7	0	0	0	108.4	M1 V3 I49	M1-H74 HydrophobicContact CE-CB 4.06Å; M1-H74 WeakPolarHBondContact CE-CE1 3.46Å; M1-H74 WeakPolarHBondContact CE-ND1 3.31Å; M1-H74 WeakPolarHBondContact CG-ND1 3.43Å; V3-H74 VanDerWaalsContact CG2-CE1 3.47Å; V3-H74 WeakPolarHBondContact CG2-CE1 3.44Å; I49-H74 PolarHBondContact N-O 3.09Å; I49-H74 PolarHBondContact O-N 3.34Å
75	C	55.4	Low	52.1	Low	6 Å²	6	78.4 Å²	78.4	4%	0.041	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	140.4	170	100.3	0	0	0	0	109.7	L2 F4 L48	L2-C75 PolarHBondContact O-N 3.09Å; F4-C75 HydrophobicContact CD2-CB 4.04Å; F4-C75 HydrophobicContact CE2-CB 3.69Å; F4-C75 WeakPolarHBondContact CE2-SG 3.36Å; L48-C75 HydrophobicContact CD1-CB 4Å
76	H	52.1	Low	51.7	Low	96 Å²	96	78.5 Å²	78.5	44%	0.444	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	106.7	167.7	-173.7	-93.8	0	0	0	108.7	R47 I49	R47-H76 PolarHBondContact N-O 2.95Å; R47-H76 PolarHBondContact O-N 3.37Å; I49-H76 HydrophobicContact CD1-CB 4.44Å
77	I	56.1	Low	51.3	Low	63 Å²	63	85.2 Å²	85.2	32%	0.323	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	114.6	175.3	-54.9	176.7	0	0	0	107	K44 V46	K44-I77 HydrophobicContact CB-CG2 4.15Å; K44-I77 HydrophobicContact CD-CG2 4.01Å; K44-I77 HydrophobicContact CG-CG2 4.13Å; V46-I77 HydrophobicContact CG1-CG1 4.22Å; V46-I77 HydrophobicContact CG2-CG1 4.14Å; V46-I77 HydrophobicContact CG2-CG2 4.38Å
78	S	52.1	Low	50.8	Low	25 Å²	25	90.4 Å²	90.4	18%	0.175	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	130.9	174.2	52.5	0	0	0	0	110.2	V45 V80	V45-S78 PolarHBondContact N-O 3.18Å; V45-S78 PolarHBondContact O-N 2.89Å; V45-S78 PolarHBondContact O-OG 3.39Å; S78-V80 PolarHBondContact O-N 2.99Å; S78-V80 VanDerWaalsContact O-N 3.12Å
79	H	53.9	Low	50.2	Low	126 Å²	126	88.1 Å²	88.1	58%	0.583	51%	0.505	S	S	*	.			trans	-78.6	23.7	-178.7	-81.4	-105.4	0	0	0	114.5	K44 P81	K44-H79 WeakPolarHBondContact CE-CE1 3.38Å; K44-H79 WeakPolarHBondContact CE-NE2 3Å; H79-P81 WeakPolarHBondContact O-CD 3.19Å
80	V	53.2	Low	49.3	Very low	104 Å²	104	85.7 Å²	85.7	63%	0.63	51%	0.511	S	S	*	.			trans	-97.9	107.3	-175.6	-168	0	0	0	0	109	V45 S78 Y82	V45-V80 VanDerWaalsContact CG2-O 3.31Å; V45-V80 WeakPolarHBondContact CG2-O 3.18Å; S78-V80 PolarHBondContact O-N 2.99Å; S78-V80 VanDerWaalsContact O-N 3.12Å; V80-Y82 PolarHBondContact O-N 3.19Å
81	P	50	Low	48.8	Very low	80 Å²	80	84.9 Å²	84.9	52%	0.519	53%	0.526	S	S	.	.			trans	-62.3	120.1	175.6	24.7	-31.7	0	0	0	109	H79 T83	H79-P81 WeakPolarHBondContact O-CD 3.19Å; P81-T83 PolarHBondContact O-N 3.19Å
82	Y	44.3	Very low	48	Very low	162 Å²	162	89 Å²	89	64%	0.635	56%	0.561	S	S	*	*			trans	-81.4	67.9	176.2	-153	-94.3	0	0	0	108.7	V80 V85	V80-Y82 PolarHBondContact O-N 3.19Å; Y82-V85 HydrophobicContact CD1-CG2 4.29Å; Y82-V85 HydrophobicContact CE1-CG2 3.46Å; Y82-V85 VanDerWaalsContact CE1-CG2 3.46Å
83	T	46.7	Very low	47.7	Very low	120 Å²	120	90 Å²	90	74%	0.736	58%	0.576	S	S	*	*			trans	-106.4	129.8	166.4	53	0	0	0	0	107.9	P81	P81-T83 PolarHBondContact O-N 3.19Å
84	A	44.3	Very low	46.9	Very low	91 Å²	91	95.5 Å²	95.5	75%	0.752	62%	0.615	S	S	*	*			trans	81.3	68.5	179.6	0	0	0	0	0	116	G86	A84-G86 VanDerWaalsContact C-N 3.34Å; A84-G86 PolarHBondContact O-N 3.21Å
85	V	44.1	Very low	46.6	Very low	123 Å²	123	98.1 Å²	98.1	75%	0.745	64%	0.64	S	S	*	*			trans	-56.6	106.6	132.2	176.5	0	0	0	0	106.4	Y82	Y82-V85 HydrophobicContact CD1-CG2 4.29Å; Y82-V85 HydrophobicContact CE1-CG2 3.46Å; Y82-V85 VanDerWaalsContact CE1-CG2 3.46Å
86	G	42.5	Very low	46.3	Very low	57 Å²	57	102.5 Å²	102.5	59%	0.588	67%	0.666	S	S	*	*			trans	164.3	86.2	178.8	0	0	0	0	0	112.4	A84	A84-G86 VanDerWaalsContact C-N 3.34Å; A84-G86 PolarHBondContact O-N 3.21Å
87	E	45	Very low	45.9	Very low	167 Å²	167	104.1 Å²	104.1	78%	0.78	68%	0.678	S	S	*	*			trans	65.7	102.3	144	-140	170.3	127.3	0	0	118.6	T89	E87-T89 PolarHBondContact O-N 3.46Å; E87-T89 VanDerWaalsContact O-N 3.15Å
88	P	44.9	Very low	45.8	Very low	136 Å²	136	110.5 Å²	110.5	88%	0.883	70%	0.698	S	S	*	*			trans	-85.1	83.5	165.7	33.9	-27.5	0	0	0	109.3
89	T	44.6	Very low	45.9	Very low	115 Å²	115	116.4 Å²	116.4	71%	0.706	73%	0.728	S	S	*	*			trans	-85.9	128.6	155	-62.4	0	0	0	0	107.3	E87	E87-T89 PolarHBondContact O-N 3.46Å; E87-T89 VanDerWaalsContact O-N 3.15Å
90	G	37	Very low	45.8	Very low	80 Å²	80	113.7 Å²	113.7	83%	0.825	72%	0.723	S	S	*	*			trans	-57.9	153.6	-161.9	0	0	0	0	0	116.7
91	G	38.1	Very low	45.8	Very low	81 Å²	81	113.5 Å²	113.5	84%	0.835	72%	0.718	S	S	*	*			trans	167.7	117.7	171.3	0	0	0	0	0	111.5
92	A	39.1	Very low	46	Very low	104 Å²	104	119.1 Å²	119.1	86%	0.86	73%	0.731	S	S	*	*			trans	-70.9	135.9	-175.2	0	0	0	0	0	113.8
93	A	45	Very low	46.3	Very low	87 Å²	87	122 Å²	122	72%	0.719	74%	0.74	S	S	*	*			trans	-173.5	101	149.5	0	0	0	0	0	107.2
94	S	42.1	Very low	46.5	Very low	124 Å²	124	118.2 Å²	118.2	87%	0.867	73%	0.725	S	S	*	*				58.5	64.2	76.2	-47.2	0	0	0	0	113.3
95	S	49	Very low	46.9	Very low	114 Å²	114	115.9 Å²	115.9	80%	0.797	71%	0.706	S	S	*	*			trans	-121.1	121.9	154.5	55.6	0	0	0	0	109.4	D97	S95-D97 PolarHBondContact O-N 3.48Å
96	V	48	Very low	47.3	Very low	97 Å²	97	116 Å²	116	59%	0.588	70%	0.7	S	S	*	*			trans	-84.5	106	-171.9	173.2	0	0	0	0	107.6	R98	V96-R98 HydrophobicContact CG1-CG 3.65Å
97	D	44.6	Very low	47.8	Very low	130 Å²	130	115.9 Å²	115.9	70%	0.695	69%	0.694	S	S	*	*			trans	-122	78.4	169.7	-126	-15.4	0	0	0	109.2	S95 N99 S100	S95-D97 PolarHBondContact O-N 3.48Å; D97-N99 PolarHBondContact O-N 3.34Å; D97-S100 PolarHBondContact O-OG 3.29Å
98	R	52.5	Low	48.1	Very low	197 Å²	197	111.1 Å²	111.1	74%	0.743	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	12.9	-169.9	-75.9	175	178.2	147.9	0.7	115	V96	V96-R98 HydrophobicContact CG1-CG 3.65Å
99	N	54.5	Low	48.5	Very low	150 Å²	150	109 Å²	109	80%	0.802	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	0.2	-174.1	-152.9	5.6	0	0	0	114.1	D97	D97-N99 PolarHBondContact O-N 3.34Å
100	S	52.7	Low	48.9	Very low	69 Å²	69	107.8 Å²	107.8	48%	0.483	66%	0.656	S	S	.	*	S	Bend	trans	-100.8	-3.6	175.6	48.6	0	0	0	0	114.5	D97 Y102 R103 G104	D97-S100 PolarHBondContact O-OG 3.29Å; S100-Y102 VanDerWaalsContact C-N 3.34Å; S100-Y102 PolarHBondContact O-N 3.06Å; S100-R103 PolarHBondContact O-N 3.19Å; S100-G104 PolarHBondContact O-N 2.99Å
101	D	52.3	Low	49.8	Very low	99 Å²	99	112.3 Å²	112.3	53%	0.529	65%	0.653	S	S	.	*	H	α-helix	trans	-69.5	-25.2	-167.6	-69.6	-36.1	0	0	0	114.1	A105	D101-A105 WeakPolarHBondContact O-CB 3.11Å; D101-A105 PolarHBondContact O-N 3.17Å
102	Y	54.8	Low	51.2	Low	198 Å²	198	112 Å²	112	78%	0.776	63%	0.632	S	S	*	*	H	α-helix	trans	-83.7	-29.4	177.6	-57.8	-71.1	0	0	0	113.9	S100 M106	S100-Y102 VanDerWaalsContact C-N 3.34Å; S100-Y102 PolarHBondContact O-N 3.06Å; Y102-M106 PolarHBondContact O-N 3.28Å; Y102-M106 VanDerWaalsContact O-N 3.17Å
103	R	51.5	Low	52.9	Low	222 Å²	222	112.3 Å²	112.3	84%	0.838	62%	0.618	S	S	*	*	H	α-helix	trans	-79.9	-35	173.9	-76.5	177.8	69.5	160.2	-0.4	111.4	S100 A105 A107	S100-R103 PolarHBondContact O-N 3.19Å; R103-A105 VanDerWaalsContact C-N 3.35Å; R103-A107 PolarHBondContact O-N 3.32Å
104	G	50.1	Low	54.3	Low	41 Å²	41	109.5 Å²	109.5	42%	0.423	60%	0.598	S	S	.	*	H	α-helix	trans	-63.6	-38.3	166.9	0	0	0	0	0	112.2	S100 A107 S108	S100-G104 PolarHBondContact O-N 2.99Å; G104-A107 CarbonylContact O-C 3.54Å; G104-A107 PolarHBondContact O-N 3.48Å; G104-S108 WeakPolarHBondContact O-CB 3.4Å; G104-S108 PolarHBondContact O-N 3.41Å; G104-S108 PolarHBondContact O-OG 3.37Å
105	A	52.5	Low	55.9	Low	42 Å²	42	106.7 Å²	106.7	35%	0.347	57%	0.573	S	S	.	*	H	α-helix	trans	-66	-38.4	175.6	0	0	0	0	0	113.3	D101 R103 S108 I109	D101-A105 WeakPolarHBondContact O-CB 3.11Å; D101-A105 PolarHBondContact O-N 3.17Å; R103-A105 VanDerWaalsContact C-N 3.35Å; A105-S108 VanDerWaalsContact CA-OG 3.23Å; A105-S108 WeakPolarHBondContact CA-OG 3.17Å; A105-S108 PolarHBondContact O-N 3.39Å; A105-S108 PolarHBondContact O-OG 2.94Å; A105-I109 WeakPolarHBondContact O-CG1 3.41Å; A105-I109 PolarHBondContact O-N 3.03Å
106	M	53.2	Low	57.1	Low	125 Å²	125	105.7 Å²	105.7	62%	0.616	56%	0.558	S	S	*	*	H	α-helix	trans	-71	-36.9	174.2	-103	-68.3	160	0	0	112.5	Y102 S108 I109 S110	Y102-M106 PolarHBondContact O-N 3.28Å; Y102-M106 VanDerWaalsContact O-N 3.17Å; M106-S108 VanDerWaalsContact C-N 3.28Å; M106-S108 PolarHBondContact O-N 2.79Å; M106-I109 HydrophobicContact CE-CD1 3.52Å; M106-I109 HydrophobicContact CG-CD1 4.44Å; M106-I109 PolarHBondContact O-N 3.37Å; M106-I109 HydrophobicContact SD-CD1 3.76Å; M106-S110 PolarHBondContact O-OG 2.75Å
107	A	51.2	Low	58.7	Low	55 Å²	55	104.3 Å²	104.3	46%	0.455	55%	0.547	S	S	.	.	H	α-helix	trans	-68.9	-26.9	170.2	0	0	0	0	0	112.3	R103 G104 S110 F111	R103-A107 PolarHBondContact O-N 3.32Å; G104-A107 CarbonylContact O-C 3.54Å; G104-A107 PolarHBondContact O-N 3.48Å; A107-S110 WeakPolarHBondContact O-CA 3.23Å; A107-S110 WeakPolarHBondContact O-CB 3.34Å; A107-S110 PolarHBondContact O-N 3.05Å; A107-S110 VanDerWaalsContact O-N 3.14Å; A107-S110 PolarHBondContact O-OG 3.14Å; A107-F111 PolarHBondContact O-N 3.44Å
108	S	52.9	Low	60.3	Low	67 Å²	67	100.5 Å²	100.5	47%	0.469	52%	0.523	S	S	.	.	H	α-helix	trans	-77.6	-21.6	174.4	70.8	0	0	0	0	113.1	G104 A105 M106 S110 F111	G104-S108 WeakPolarHBondContact O-CB 3.4Å; G104-S108 PolarHBondContact O-N 3.41Å; G104-S108 PolarHBondContact O-OG 3.37Å; A105-S108 VanDerWaalsContact CA-OG 3.23Å; A105-S108 WeakPolarHBondContact CA-OG 3.17Å; A105-S108 PolarHBondContact O-N 3.39Å; A105-S108 PolarHBondContact O-OG 2.94Å; M106-S108 VanDerWaalsContact C-N 3.28Å; M106-S108 PolarHBondContact O-N 2.79Å; S108-S110 PolarHBondContact O-N 3.32Å; S108-F111 WeakPolarHBondContact O-CA 3.5Å; S108-F111 WeakPolarHBondContact O-CB 3.47Å; S108-F111 PolarHBondContact O-N 3.15Å; S108-F111 VanDerWaalsContact O-O 3.07Å
109	I	53.5	Low	61.6	Low	92 Å²	92	95 Å²	95	47%	0.472	51%	0.511	S	S	.	.	H	α-helix	trans	-66.5	-26.4	166	-65.8	163.2	0	0	0	110.2	A105 M106 F111 I113	A105-I109 WeakPolarHBondContact O-CG1 3.41Å; A105-I109 PolarHBondContact O-N 3.03Å; M106-I109 HydrophobicContact CE-CD1 3.52Å; M106-I109 HydrophobicContact CG-CD1 4.44Å; M106-I109 PolarHBondContact O-N 3.37Å; M106-I109 HydrophobicContact SD-CD1 3.76Å; I109-F111 VanDerWaalsContact C-N 3.29Å; I109-I113 VanDerWaalsContact O-CD1 3.24Å; I109-I113 WeakPolarHBondContact O-CD1 3.4Å
110	S	53.1	Low	62.9	Low	90 Å²	90	92.6 Å²	92.6	63%	0.629	50%	0.498	S	S	*	.	S	Bend	trans	-76.7	-17.9	171.3	-37.8	0	0	0	0	112.5	M106 A107 S108 D112	M106-S110 PolarHBondContact O-OG 2.75Å; A107-S110 WeakPolarHBondContact O-CA 3.23Å; A107-S110 WeakPolarHBondContact O-CB 3.34Å; A107-S110 PolarHBondContact O-N 3.05Å; A107-S110 VanDerWaalsContact O-N 3.14Å; A107-S110 PolarHBondContact O-OG 3.14Å; S108-S110 PolarHBondContact O-N 3.32Å; S110-D112 PolarHBondContact O-N 3.42Å
111	F	55.9	Low	64.4	Low	174 Å²	174	94.6 Å²	94.6	76%	0.763	50%	0.498	S	S	*	.	S	Bend	trans	-84.5	111.3	174.7	-109.2	-106.5	0	0	0	108.5	A107 S108 I109	A107-F111 PolarHBondContact O-N 3.44Å; S108-F111 WeakPolarHBondContact O-CA 3.5Å; S108-F111 WeakPolarHBondContact O-CB 3.47Å; S108-F111 PolarHBondContact O-N 3.15Å; S108-F111 VanDerWaalsContact O-O 3.07Å; I109-F111 VanDerWaalsContact C-N 3.29Å
112	D	65.7	Low	65.9	Low	76 Å²	76	91.2 Å²	91.2	41%	0.406	49%	0.486	S	S	.	.			trans	73	47.5	163.1	-121.3	-8.5	0	0	0	114.2	S110 G114 N115 L116 R165	S110-D112 PolarHBondContact O-N 3.42Å; D112-G114 CarbonylContact O-C 3.53Å; D112-G114 PolarHBondContact O-N 2.83Å; D112-N115 HydrophobicContact CB-CB 3.66Å; D112-N115 VanDerWaalsContact CG-CB 3.41Å; D112-N115 CarbonylContact O-C 3.57Å; D112-N115 WeakPolarHBondContact O-CA 3.24Å; D112-N115 PolarHBondContact O-N 3.44Å; D112-N115 WeakPolarHBondContact OD2-CB 3.31Å; D112-L116 PolarHBondContact O-N 2.83Å; D112-R165 IonicContact OD1-NH2 3.56Å; D112-R165 IonicContact OD2-NH2 3.02Å; D112-R165 PolarHBondContact OD2-NH2 3.03Å
113	I	75.5	Confident	67.3	Low	110 Å²	110	86.3 Å²	86.3	56%	0.564	48%	0.477	S	S	*	.	H	α-helix	trans	-42.8	-38.5	161	-105.4	88.4	0	0	0	110.2	I109 L116 I117	I109-I113 VanDerWaalsContact O-CD1 3.24Å; I109-I113 WeakPolarHBondContact O-CD1 3.4Å; I113-L116 PolarHBondContact O-N 2.83Å; I113-I117 WeakPolarHBondContact O-CB 3.33Å; I113-I117 VanDerWaalsContact O-CG2 3.31Å; I113-I117 WeakPolarHBondContact O-CG2 3.42Å; I113-I117 PolarHBondContact O-N 3.02Å
114	G	74.8	Confident	68.5	Low	28 Å²	28	82.7 Å²	82.7	29%	0.289	47%	0.467	S	S	.	.	H	α-helix	trans	-53.5	-58.5	171.2	0	0	0	0	0	112.2	D112 L116 I117 Y118	D112-G114 CarbonylContact O-C 3.53Å; D112-G114 PolarHBondContact O-N 2.83Å; G114-L116 PolarHBondContact O-N 2.94Å; G114-I117 WeakPolarHBondContact O-CG2 3.31Å; G114-I117 PolarHBondContact O-N 2.86Å; G114-Y118 VanDerWaalsContact C-CD2 3.49Å; G114-Y118 WeakPolarHBondContact O-CD2 3.35Å; G114-Y118 WeakPolarHBondContact O-CE2 3.37Å; G114-Y118 PolarHBondContact O-N 3.02Å
115	N	75.1	Confident	70.1	Confident	65 Å²	65	82.3 Å²	82.3	35%	0.348	45%	0.454	S	S	.	.	H	α-helix	trans	-62.4	-41	177.4	-160.6	41	0	0	0	113.2	D112 I117 Y118 V119	D112-N115 HydrophobicContact CB-CB 3.66Å; D112-N115 VanDerWaalsContact CG-CB 3.41Å; D112-N115 CarbonylContact O-C 3.57Å; D112-N115 WeakPolarHBondContact O-CA 3.24Å; D112-N115 PolarHBondContact O-N 3.44Å; D112-N115 WeakPolarHBondContact OD2-CB 3.31Å; N115-I117 VanDerWaalsContact C-N 3.32Å; N115-I117 PolarHBondContact O-N 3.25Å; N115-Y118 WeakPolarHBondContact O-CB 3.48Å; N115-Y118 PolarHBondContact O-N 3.44Å; N115-V119 WeakPolarHBondContact O-CG2 3.28Å; N115-V119 PolarHBondContact O-N 3.23Å
116	L	75	Confident	71.6	Confident	93 Å²	93	83.1 Å²	83.1	49%	0.487	46%	0.461	S	S	.	.	H	α-helix	trans	-60.8	-42.6	176.5	-175.1	72.1	0	0	0	111.2	D112 I113 G114 Y118 V119 L120	D112-L116 PolarHBondContact O-N 2.83Å; I113-L116 PolarHBondContact O-N 2.83Å; G114-L116 PolarHBondContact O-N 2.94Å; L116-Y118 VanDerWaalsContact C-N 3.34Å; L116-V119 PolarHBondContact O-N 3.48Å; L116-L120 HydrophobicContact CD1-CD1 4.46Å; L116-L120 HydrophobicContact CD2-CD1 4.29Å; L116-L120 HydrophobicContact CG-CD1 3.88Å; L116-L120 HydrophobicContact CG-CG 4.37Å; L116-L120 WeakPolarHBondContact O-CB 3.13Å; L116-L120 WeakPolarHBondContact O-CG 3.12Å; L116-L120 PolarHBondContact O-N 3.31Å
117	I	80.5	Confident	73	Confident	68 Å²	68	84.7 Å²	84.7	35%	0.349	46%	0.464	S	S	.	.	H	α-helix	trans	-65.4	-40.2	178.6	-165.1	56.3	0	0	0	110.6	I113 G114 N115 V119 L120 F121	I113-I117 WeakPolarHBondContact O-CB 3.33Å; I113-I117 VanDerWaalsContact O-CG2 3.31Å; I113-I117 WeakPolarHBondContact O-CG2 3.42Å; I113-I117 PolarHBondContact O-N 3.02Å; G114-I117 WeakPolarHBondContact O-CG2 3.31Å; G114-I117 PolarHBondContact O-N 2.86Å; N115-I117 VanDerWaalsContact C-N 3.32Å; N115-I117 PolarHBondContact O-N 3.25Å; I117-V119 PolarHBondContact O-N 3.07Å; I117-L120 PolarHBondContact O-N 3.28Å; I117-F121 HydrophobicContact CD1-CD2 3.61Å; I117-F121 HydrophobicContact CD1-CE2 3.27Å; I117-F121 HydrophobicContact CD1-CZ 4.15Å; I117-F121 HydrophobicContact CG1-CD2 3.58Å; I117-F121 HydrophobicContact CG1-CE2 3.38Å; I117-F121 WeakPolarHBondContact O-CB 3.17Å; I117-F121 WeakPolarHBondContact O-CD2 3.49Å; I117-F121 PolarHBondContact O-N 3.5Å
118	Y	79.5	Confident	74.3	Confident	49 Å²	49	85.5 Å²	85.5	19%	0.192	46%	0.461	C	S	.	.	H	α-helix	trans	-59.7	-46.4	172.9	-69.3	-65.3	0	0	0	112	G114 N115 L116 G122 F157 C158 A161	G114-Y118 VanDerWaalsContact C-CD2 3.49Å; G114-Y118 WeakPolarHBondContact O-CD2 3.35Å; G114-Y118 WeakPolarHBondContact O-CE2 3.37Å; G114-Y118 PolarHBondContact O-N 3.02Å; N115-Y118 WeakPolarHBondContact O-CB 3.48Å; N115-Y118 PolarHBondContact O-N 3.44Å; L116-Y118 VanDerWaalsContact C-N 3.34Å; Y118-G122 PolarHBondContact O-N 2.94Å; Y118-F157 HydrophobicContact CD1-CD1 4.15Å; Y118-F157 HydrophobicContact CD1-CE1 4.16Å; Y118-F157 AromaticContact CE1-CD1 3.27Å; Y118-F157 HydrophobicContact CE1-CD1 3.27Å; Y118-F157 AromaticContact CE1-CE1 3.17Å; Y118-F157 HydrophobicContact CE1-CE1 3.17Å; Y118-F157 HydrophobicContact CE1-CG 4.22Å; Y118-F157 HydrophobicContact CE1-CZ 4.1Å; Y118-F157 AromaticContact CZ-CD1 3.96Å; Y118-F157 AromaticContact CZ-CE1 3.42Å; Y118-F157 VanDerWaalsContact CZ-CE1 3.42Å; Y118-F157 AromaticContact CZ-CZ 3.93Å; Y118-F157 WeakPolarHBondContact OH-CE1 2.94Å; Y118-F157 WeakPolarHBondContact OH-CZ 3.39Å; Y118-C158 VanDerWaalsContact CD1-SG 3.56Å; Y118-A161 HydrophobicContact CE1-CB 4Å; Y118-A161 HydrophobicContact CE2-CB 3.85Å; Y118-A161 VanDerWaalsContact CZ-CB 3.45Å; Y118-A161 VanDerWaalsContact OH-CB 3.28Å; Y118-A161 WeakPolarHBondContact OH-CB 2.81Å
119	V	79.3	Confident	75.6	Confident	83 Å²	83	89 Å²	89	50%	0.503	46%	0.464	S	S	.	.	H	α-helix	trans	-64.9	-46.9	179.4	173.9	0	0	0	0	111.3	N115 L116 I117 F121 G122 V123	N115-V119 WeakPolarHBondContact O-CG2 3.28Å; N115-V119 PolarHBondContact O-N 3.23Å; L116-V119 PolarHBondContact O-N 3.48Å; I117-V119 PolarHBondContact O-N 3.07Å; V119-F121 PolarHBondContact O-N 3.46Å; V119-G122 PolarHBondContact O-N 3.44Å; V119-V123 HydrophobicContact CG1-CG2 4.49Å; V119-V123 WeakPolarHBondContact O-CG2 3.36Å; V119-V123 PolarHBondContact O-N 2.85Å
120	L	81.1	Confident	76.8	Confident	99 Å²	99	86.9 Å²	86.9	52%	0.518	46%	0.46	S	S	.	.	H	α-helix	trans	-59.7	-45.6	179.7	-79	168.5	0	0	0	112.2	L116 I117 V123 K124	L116-L120 HydrophobicContact CD1-CD1 4.46Å; L116-L120 HydrophobicContact CD2-CD1 4.29Å; L116-L120 HydrophobicContact CG-CD1 3.88Å; L116-L120 HydrophobicContact CG-CG 4.37Å; L116-L120 WeakPolarHBondContact O-CB 3.13Å; L116-L120 WeakPolarHBondContact O-CG 3.12Å; L116-L120 PolarHBondContact O-N 3.31Å; I117-L120 PolarHBondContact O-N 3.28Å; L120-V123 PolarHBondContact O-N 3.27Å; L120-K124 PolarHBondContact O-N 2.98Å; L120-K124 VanDerWaalsContact O-N 3.11Å
121	F	84.1	Confident	77.9	Confident	111 Å²	111	84.3 Å²	84.3	49%	0.487	44%	0.444	S	S	.	.	H	α-helix	trans	-66	-40.2	176.2	-83.4	-65.8	0	0	0	112.1	I117 V119 V123 K124 F125 F154	I117-F121 HydrophobicContact CD1-CD2 3.61Å; I117-F121 HydrophobicContact CD1-CE2 3.27Å; I117-F121 HydrophobicContact CD1-CZ 4.15Å; I117-F121 HydrophobicContact CG1-CD2 3.58Å; I117-F121 HydrophobicContact CG1-CE2 3.38Å; I117-F121 WeakPolarHBondContact O-CB 3.17Å; I117-F121 WeakPolarHBondContact O-CD2 3.49Å; I117-F121 PolarHBondContact O-N 3.5Å; V119-F121 PolarHBondContact O-N 3.46Å; F121-V123 VanDerWaalsContact C-N 3.35Å; F121-V123 PolarHBondContact O-N 3.11Å; F121-K124 WeakPolarHBondContact O-CB 3.35Å; F121-K124 PolarHBondContact O-N 3.22Å; F121-F125 WeakPolarHBondContact O-CB 3.47Å; F121-F125 PolarHBondContact O-N 2.94Å; F121-F154 HydrophobicContact CB-CD2 3.99Å; F121-F154 HydrophobicContact CB-CE1 4.33Å; F121-F154 HydrophobicContact CB-CE2 3.15Å; F121-F154 HydrophobicContact CB-CZ 3.35Å; F121-F154 HydrophobicContact CD2-CE2 4.18Å; F121-F154 HydrophobicContact CG-CD2 4.42Å; F121-F154 AromaticContact CG-CE2 3.85Å; F121-F154 HydrophobicContact CG-CE2 3.85Å; F121-F154 HydrophobicContact CG-CZ 4.49Å
122	G	84.7	Confident	78.7	Confident	27 Å²	27	77.1 Å²	77.1	28%	0.278	41%	0.413	S	S	.	.	H	α-helix	trans	-59.6	-43.2	176.1	0	0	0	0	0	112.7	Y118 V119 F125 A126	Y118-G122 PolarHBondContact O-N 2.94Å; V119-G122 PolarHBondContact O-N 3.44Å; G122-F125 PolarHBondContact O-N 3Å; G122-A126 WeakPolarHBondContact O-CB 3.47Å; G122-A126 PolarHBondContact O-N 3.45Å
123	V	83.9	Confident	79.1	Confident	95 Å²	95	82.5 Å²	82.5	58%	0.576	43%	0.429	S	S	*	.	H	α-helix	trans	-62.8	-45.4	175.9	173.2	0	0	0	0	111.3	V119 L120 F121 F125 A126 F127	V119-V123 HydrophobicContact CG1-CG2 4.49Å; V119-V123 WeakPolarHBondContact O-CG2 3.36Å; V119-V123 PolarHBondContact O-N 2.85Å; L120-V123 PolarHBondContact O-N 3.27Å; F121-V123 VanDerWaalsContact C-N 3.35Å; F121-V123 PolarHBondContact O-N 3.11Å; V123-F125 VanDerWaalsContact C-N 3.27Å; V123-F125 PolarHBondContact O-N 3.45Å; V123-A126 PolarHBondContact O-N 3.47Å; V123-F127 PolarHBondContact O-N 2.99Å
124	K	78	Confident	78.9	Confident	147 Å²	147	83 Å²	83	64%	0.639	43%	0.433	S	S	*	.	H	α-helix	trans	-56.4	-44.1	174.5	-88.8	-78	-175.1	174	0	111.5	L120 F121 F127 L128	L120-K124 PolarHBondContact O-N 2.98Å; L120-K124 VanDerWaalsContact O-N 3.11Å; F121-K124 WeakPolarHBondContact O-CB 3.35Å; F121-K124 PolarHBondContact O-N 3.22Å; K124-F127 PolarHBondContact O-N 3.34Å; K124-L128 WeakPolarHBondContact O-CD1 3.48Å; K124-L128 WeakPolarHBondContact O-CG 3.45Å; K124-L128 PolarHBondContact O-N 2.83Å
125	F	82.8	Confident	78.6	Confident	32 Å²	32	88.9 Å²	88.9	14%	0.14	45%	0.447	C	S	.	.	H	α-helix	trans	-68.1	-41.8	-178.8	-141.7	-84.3	0	0	0	112.6	F121 G122 V123 F127 L128 W129 L147 S151	F121-F125 WeakPolarHBondContact O-CB 3.47Å; F121-F125 PolarHBondContact O-N 2.94Å; G122-F125 PolarHBondContact O-N 3Å; V123-F125 VanDerWaalsContact C-N 3.27Å; V123-F125 PolarHBondContact O-N 3.45Å; F125-F127 VanDerWaalsContact C-N 3.28Å; F125-F127 PolarHBondContact O-N 3.33Å; F125-L128 PolarHBondContact O-N 2.74Å; F125-W129 WeakPolarHBondContact O-CB 3.38Å; F125-W129 PolarHBondContact O-N 2.93Å; F125-L147 HydrophobicContact CE1-CD2 3.81Å; F125-L147 HydrophobicContact CZ-CD2 3.56Å; F125-L147 HydrophobicContact CZ-CG 3.95Å; F125-L147 WeakPolarHBondContact CZ-O 3.39Å; F125-S151 WeakPolarHBondContact CE1-OG 3.36Å
126	A	83.2	Confident	78.1	Confident	60 Å²	60	90.1 Å²	90.1	50%	0.496	46%	0.459	S	S	.	.	H	α-helix	trans	-61	-39.1	174.3	0	0	0	0	0	111.7	G122 V123 W129 A130	G122-A126 WeakPolarHBondContact O-CB 3.47Å; G122-A126 PolarHBondContact O-N 3.45Å; V123-A126 PolarHBondContact O-N 3.47Å; A126-W129 PolarHBondContact O-N 3.07Å; A126-A130 WeakPolarHBondContact O-CB 3.46Å; A126-A130 PolarHBondContact O-N 3.38Å
127	F	83.2	Confident	77.4	Confident	157 Å²	157	93.3 Å²	93.3	69%	0.689	48%	0.476	S	S	*	.	H	α-helix	trans	-65.5	-43.3	176	-169.2	-94.4	0	0	0	112.3	V123 K124 F125 W129 A130 A131	V123-F127 PolarHBondContact O-N 2.99Å; K124-F127 PolarHBondContact O-N 3.34Å; F125-F127 VanDerWaalsContact C-N 3.28Å; F125-F127 PolarHBondContact O-N 3.33Å; F127-W129 VanDerWaalsContact C-N 3.34Å; F127-A130 PolarHBondContact O-N 2.87Å; F127-A131 WeakPolarHBondContact O-CB 3.25Å; F127-A131 PolarHBondContact O-N 3.27Å
128	L	79.3	Confident	76.5	Confident	73 Å²	73	99.8 Å²	99.8	38%	0.382	50%	0.498	S	S	.	.	H	α-helix	trans	-61.7	-42.6	174.3	-75.9	152.9	0	0	0	111.6	K124 F125 A131 L132 L147	K124-L128 WeakPolarHBondContact O-CD1 3.48Å; K124-L128 WeakPolarHBondContact O-CG 3.45Å; K124-L128 PolarHBondContact O-N 2.83Å; F125-L128 PolarHBondContact O-N 2.74Å; L128-A131 PolarHBondContact O-N 2.97Å; L128-L132 WeakPolarHBondContact O-CB 3.39Å; L128-L132 VanDerWaalsContact O-CG 3.31Å; L128-L132 WeakPolarHBondContact O-CG 3.49Å; L128-L132 PolarHBondContact O-N 3.17Å; L128-L147 HydrophobicContact CB-CD1 4.1Å; L128-L147 HydrophobicContact CD1-CD1 4.45Å; L128-L147 HydrophobicContact CD2-CD1 3.98Å; L128-L147 HydrophobicContact CG-CD1 4.41Å
129	W	80.4	Confident	75.4	Confident	141 Å²	141	102 Å²	102	53%	0.534	51%	0.509	S	S	.	.	H	α-helix	trans	-64.9	-39.3	175.9	-167.4	-91	0	0	0	112.2	F125 A126 F127 L132 Y133 L148	F125-W129 WeakPolarHBondContact O-CB 3.38Å; F125-W129 PolarHBondContact O-N 2.93Å; A126-W129 PolarHBondContact O-N 3.07Å; F127-W129 VanDerWaalsContact C-N 3.34Å; W129-L132 WeakPolarHBondContact O-CB 3.33Å; W129-L132 PolarHBondContact O-N 3.44Å; W129-Y133 WeakPolarHBondContact O-CB 3.43Å; W129-Y133 PolarHBondContact O-N 3.24Å; W129-L148 HydrophobicContact CZ3-CD2 4.28Å
130	A	78.7	Confident	75	Confident	46 Å²	46	103.9 Å²	103.9	38%	0.38	52%	0.516	S	S	.	.	H	α-helix	trans	-66.2	-40.6	174.4	0	0	0	0	0	111.7	A126 F127 L132 Y133 L134	A126-A130 WeakPolarHBondContact O-CB 3.46Å; A126-A130 PolarHBondContact O-N 3.38Å; F127-A130 PolarHBondContact O-N 2.87Å; A130-L132 VanDerWaalsContact C-N 3.32Å; A130-L132 PolarHBondContact O-N 3.33Å; A130-Y133 PolarHBondContact O-N 3.26Å; A130-L134 WeakPolarHBondContact O-CB 3.42Å; A130-L134 WeakPolarHBondContact O-CD1 3.47Å; A130-L134 PolarHBondContact O-N 3.38Å
131	A	75.2	Confident	74.4	Confident	37 Å²	37	103.8 Å²	103.8	31%	0.306	52%	0.524	S	S	.	.	H	α-helix	trans	-63.6	-39.1	174.3	0	0	0	0	0	111.7	F127 L128 Y133 L134 Y135	F127-A131 WeakPolarHBondContact O-CB 3.25Å; F127-A131 PolarHBondContact O-N 3.27Å; L128-A131 PolarHBondContact O-N 2.97Å; A131-Y133 VanDerWaalsContact C-N 3.35Å; A131-L134 PolarHBondContact O-N 3.49Å; A131-Y135 PolarHBondContact O-N 3.44Å
132	L	73.2	Confident	74.2	Confident	23 Å²	23	103.6 Å²	103.6	12%	0.12	53%	0.532	C	S	.	.	H	α-helix	trans	-64.2	-37.8	172	-78.6	163.7	0	0	0	112.5	L128 W129 A130 F139 L144 L147	L128-L132 WeakPolarHBondContact O-CB 3.39Å; L128-L132 VanDerWaalsContact O-CG 3.31Å; L128-L132 WeakPolarHBondContact O-CG 3.49Å; L128-L132 PolarHBondContact O-N 3.17Å; W129-L132 WeakPolarHBondContact O-CB 3.33Å; W129-L132 PolarHBondContact O-N 3.44Å; A130-L132 VanDerWaalsContact C-N 3.32Å; A130-L132 PolarHBondContact O-N 3.33Å; L132-F139 HydrophobicContact CD2-CB 4Å; L132-F139 HydrophobicContact CD2-CD1 4.08Å; L132-F139 HydrophobicContact CD2-CD2 4.31Å; L132-F139 HydrophobicContact CD2-CG 3.85Å; L132-L144 HydrophobicContact CD1-CD2 4.24Å; L132-L144 HydrophobicContact CD2-CD2 3.42Å; L132-L144 VanDerWaalsContact CD2-CD2 3.42Å; L132-L144 HydrophobicContact CD2-CG 4.31Å; L132-L144 HydrophobicContact CG-CD2 4.43Å; L132-L147 HydrophobicContact CD1-CD1 4.06Å; L132-L147 HydrophobicContact CD1-CD2 3.6Å; L132-L147 HydrophobicContact CD1-CG 4.38Å
133	Y	73.3	Confident	74	Confident	189 Å²	189	104.7 Å²	104.7	74%	0.741	54%	0.535	S	S	*	.	H	α-helix	trans	-72.9	-35.4	178.3	-166.2	-98.3	0	0	0	112.4	W129 A130 A131	W129-Y133 WeakPolarHBondContact O-CB 3.43Å; W129-Y133 PolarHBondContact O-N 3.24Å; A130-Y133 PolarHBondContact O-N 3.26Å; A131-Y133 VanDerWaalsContact C-N 3.35Å
134	L	71.6	Confident	73.6	Confident	121 Å²	121	103.4 Å²	103.4	63%	0.634	52%	0.524	S	S	*	.	H	α-helix	trans	-81	-26.4	179.1	-94.9	70.2	0	0	0	113.3	A130 A131 P136	A130-L134 WeakPolarHBondContact O-CB 3.42Å; A130-L134 WeakPolarHBondContact O-CD1 3.47Å; A130-L134 PolarHBondContact O-N 3.38Å; A131-L134 PolarHBondContact O-N 3.49Å; L134-P136 VanDerWaalsContact C-CD 3.46Å
135	Y	68.2	Low	73.8	Confident	150 Å²	150	102.3 Å²	102.3	59%	0.588	53%	0.525	S	S	*	.			trans	-129.7	65	-179	-61.3	-81.6	0	0	0	111.9	A131 D137	A131-Y135 PolarHBondContact O-N 3.44Å; Y135-D137 PolarHBondContact O-N 3.23Å
136	P	64.5	Low	73.9	Confident	92 Å²	92	104.3 Å²	104.3	60%	0.597	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-62.5	-22.4	177.4	26	-33.9	0	0	0	113	L134	L134-P136 VanDerWaalsContact C-CD 3.46Å
137	D	60.4	Low	73.6	Confident	159 Å²	159	102.6 Å²	102.6	85%	0.85	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-84.4	-9	-173.6	-71.7	-60.9	0	0	0	115.6	Y135	Y135-D137 PolarHBondContact O-N 3.23Å
138	Y	61.2	Low	73.6	Confident	205 Å²	205	99.5 Å²	99.5	80%	0.804	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-105.8	-5.4	-173.6	-112.7	-89.2	0	0	0	115.2
139	F	58.1	Low	73.9	Confident	96 Å²	96	103 Å²	103	42%	0.421	53%	0.528	S	S	.	.			trans	-110.4	106.5	-166.1	-99	-93.2	0	0	0	113.7	L132	L132-F139 HydrophobicContact CD2-CB 4Å; L132-F139 HydrophobicContact CD2-CD1 4.08Å; L132-F139 HydrophobicContact CD2-CD2 4.31Å; L132-F139 HydrophobicContact CD2-CG 3.85Å
140	D	69.8	Low	74	Confident	121 Å²	121	99.7 Å²	99.7	65%	0.647	53%	0.525	S	S	*	.			trans	-43.5	133.6	168	-106.5	-44.6	0	0	0	112.5	T142 S143 L144	D140-T142 PolarHBondContact O-N 3.43Å; D140-S143 WeakPolarHBondContact O-CB 3.46Å; D140-S143 PolarHBondContact O-N 3.33Å; D140-L144 PolarHBondContact O-N 2.77Å
141	S	69.4	Low	74.3	Confident	98 Å²	98	99 Å²	99	69%	0.685	52%	0.518	S	S	*	.	H	α-helix	trans	-50.9	-31.6	178	-57	0	0	0	0	113.1	L145	S141-L145 WeakPolarHBondContact O-CB 3.37Å; S141-L145 PolarHBondContact O-N 3.5Å
142	T	79.8	Confident	74.8	Confident	107 Å²	107	102.3 Å²	102.3	66%	0.656	53%	0.53	S	S	*	.	H	α-helix	trans	-67.1	-41.1	177.6	-46.7	0	0	0	0	112	D140 L145 S146	D140-T142 PolarHBondContact O-N 3.43Å; T142-L145 PolarHBondContact O-N 3.14Å; T142-S146 PolarHBondContact O-N 3.31Å
143	S	80.5	Confident	75.3	Confident	50 Å²	50	105 Å²	105	35%	0.35	55%	0.547	S	S	.	.	H	α-helix	trans	-68.8	-42.5	178.5	-64.3	0	0	0	0	110.5	D140 L145 S146 L147	D140-S143 WeakPolarHBondContact O-CB 3.46Å; D140-S143 PolarHBondContact O-N 3.33Å; S143-L145 PolarHBondContact O-N 2.65Å; S143-S146 PolarHBondContact O-N 3.49Å; S143-S146 PolarHBondContact O-OG 3.31Å; S143-L147 WeakPolarHBondContact O-CB 3.38Å; S143-L147 PolarHBondContact O-N 3.19Å
144	L	75.1	Confident	75.8	Confident	67 Å²	67	98 Å²	98	35%	0.351	52%	0.52	S	S	.	.	H	α-helix	trans	-57.7	-46.8	171.8	-80.1	169.9	0	0	0	112.1	L132 D140 S146 L147 L148	L132-L144 HydrophobicContact CD1-CD2 4.24Å; L132-L144 HydrophobicContact CD2-CD2 3.42Å; L132-L144 VanDerWaalsContact CD2-CD2 3.42Å; L132-L144 HydrophobicContact CD2-CG 4.31Å; L132-L144 HydrophobicContact CG-CD2 4.43Å; D140-L144 PolarHBondContact O-N 2.77Å; L144-S146 VanDerWaalsContact C-N 3.34Å; L144-S146 PolarHBondContact O-N 3.01Å; L144-L147 PolarHBondContact O-N 2.86Å; L144-L148 WeakPolarHBondContact O-CB 3.4Å; L144-L148 WeakPolarHBondContact O-CG 3.32Å; L144-L148 PolarHBondContact O-N 3.01Å
145	L	81.8	Confident	76.3	Confident	124 Å²	124	96.5 Å²	96.5	65%	0.649	51%	0.513	S	S	*	.	H	α-helix	trans	-61.3	-43.9	178.9	-174.1	64.3	0	0	0	111.4	S141 T142 S143 L147 L148 F149	S141-L145 WeakPolarHBondContact O-CB 3.37Å; S141-L145 PolarHBondContact O-N 3.5Å; T142-L145 PolarHBondContact O-N 3.14Å; S143-L145 PolarHBondContact O-N 2.65Å; L145-L147 VanDerWaalsContact C-N 3.3Å; L145-L147 PolarHBondContact O-N 3.41Å; L145-L148 PolarHBondContact O-N 2.89Å; L145-F149 WeakPolarHBondContact O-CB 3.49Å; L145-F149 PolarHBondContact O-N 3.35Å
146	S	84.2	Confident	77	Confident	75 Å²	75	93.4 Å²	93.4	52%	0.524	51%	0.509	S	S	.	.	H	α-helix	trans	-63.3	-38	177	78.2	0	0	0	0	112.1	T142 S143 L144 F149 C150	T142-S146 PolarHBondContact O-N 3.31Å; S143-S146 PolarHBondContact O-N 3.49Å; S143-S146 PolarHBondContact O-OG 3.31Å; L144-S146 VanDerWaalsContact C-N 3.34Å; L144-S146 PolarHBondContact O-N 3.01Å; S146-F149 PolarHBondContact O-N 3.27Å; S146-C150 WeakPolarHBondContact O-CB 3.2Å; S146-C150 PolarHBondContact O-N 3.04Å
147	L	78.6	Confident	77.9	Confident	23 Å²	23	94.2 Å²	94.2	12%	0.12	50%	0.504	C	S	.	.	H	α-helix	trans	-73.6	-42	-179.1	-163	136.3	0	0	0	111.2	F125 L128 L132 S143 L144 L145 F149 C150 S151	F125-L147 HydrophobicContact CE1-CD2 3.81Å; F125-L147 HydrophobicContact CZ-CD2 3.56Å; F125-L147 HydrophobicContact CZ-CG 3.95Å; F125-L147 WeakPolarHBondContact CZ-O 3.39Å; L128-L147 HydrophobicContact CB-CD1 4.1Å; L128-L147 HydrophobicContact CD1-CD1 4.45Å; L128-L147 HydrophobicContact CD2-CD1 3.98Å; L128-L147 HydrophobicContact CG-CD1 4.41Å; L132-L147 HydrophobicContact CD1-CD1 4.06Å; L132-L147 HydrophobicContact CD1-CD2 3.6Å; L132-L147 HydrophobicContact CD1-CG 4.38Å; S143-L147 WeakPolarHBondContact O-CB 3.38Å; S143-L147 PolarHBondContact O-N 3.19Å; L144-L147 PolarHBondContact O-N 2.86Å; L145-L147 VanDerWaalsContact C-N 3.3Å; L145-L147 PolarHBondContact O-N 3.41Å; L147-F149 VanDerWaalsContact C-N 3.33Å; L147-F149 PolarHBondContact O-N 3.35Å; L147-C150 PolarHBondContact O-N 3.38Å; L147-S151 WeakPolarHBondContact O-CB 3.4Å; L147-S151 PolarHBondContact O-N 2.79Å
148	L	81.7	Confident	78.8	Confident	93 Å²	93	88.6 Å²	88.6	49%	0.487	48%	0.476	S	S	.	.	H	α-helix	trans	-59.7	-43.8	172.9	-74.4	173.5	0	0	0	111.5	W129 L144 L145 S151 L152	W129-L148 HydrophobicContact CZ3-CD2 4.28Å; L144-L148 WeakPolarHBondContact O-CB 3.4Å; L144-L148 WeakPolarHBondContact O-CG 3.32Å; L144-L148 PolarHBondContact O-N 3.01Å; L145-L148 PolarHBondContact O-N 2.89Å; L148-S151 WeakPolarHBondContact O-CB 3.47Å; L148-S151 PolarHBondContact O-N 3.49Å; L148-L152 PolarHBondContact O-N 2.97Å
149	F	86.8	Confident	79.7	Confident	146 Å²	146	82.8 Å²	82.8	64%	0.64	46%	0.459	S	S	*	.	H	α-helix	trans	-61.5	-45.8	176.1	-174.6	-99.2	0	0	0	111.7	L145 S146 L147 S151 L152 V153	L145-F149 WeakPolarHBondContact O-CB 3.49Å; L145-F149 PolarHBondContact O-N 3.35Å; S146-F149 PolarHBondContact O-N 3.27Å; L147-F149 VanDerWaalsContact C-N 3.33Å; L147-F149 PolarHBondContact O-N 3.35Å; F149-S151 PolarHBondContact O-N 3.49Å; F149-L152 PolarHBondContact O-N 3.31Å; F149-V153 HydrophobicContact CD1-CG2 4.49Å; F149-V153 HydrophobicContact CE1-CG2 4.14Å; F149-V153 HydrophobicContact CZ-CG2 4.34Å; F149-V153 WeakPolarHBondContact O-CG2 3.44Å; F149-V153 PolarHBondContact O-N 3.48Å; F149-V153 VanDerWaalsContact O-N 3.14Å
150	C	82.5	Confident	80.9	Confident	71 Å²	71	80.6 Å²	80.6	48%	0.48	46%	0.455	S	S	.	.	H	α-helix	trans	-62.9	-40.9	176.5	-167.9	0	0	0	0	112.1	S146 L147 L152 V153 F154	S146-C150 WeakPolarHBondContact O-CB 3.2Å; S146-C150 PolarHBondContact O-N 3.04Å; L147-C150 PolarHBondContact O-N 3.38Å; C150-L152 VanDerWaalsContact C-N 3.34Å; C150-L152 PolarHBondContact O-N 2.9Å; C150-V153 PolarHBondContact O-N 3.25Å; C150-F154 WeakPolarHBondContact O-CB 3.17Å; C150-F154 PolarHBondContact O-N 3.46Å
151	S	84.8	Confident	81.1	Confident	32 Å²	32	75.8 Å²	75.8	22%	0.224	43%	0.432	C	S	.	.	H	α-helix	trans	-55.9	-48.4	174.4	-164.6	0	0	0	0	111.4	F125 L147 L148 F149 F154 L155	F125-S151 WeakPolarHBondContact CE1-OG 3.36Å; L147-S151 WeakPolarHBondContact O-CB 3.4Å; L147-S151 PolarHBondContact O-N 2.79Å; L148-S151 WeakPolarHBondContact O-CB 3.47Å; L148-S151 PolarHBondContact O-N 3.49Å; F149-S151 PolarHBondContact O-N 3.49Å; S151-F154 PolarHBondContact O-N 3.44Å; S151-L155 WeakPolarHBondContact O-CB 3.42Å; S151-L155 PolarHBondContact O-N 3.28Å
152	L	84.5	Confident	81.2	Confident	107 Å²	107	72.6 Å²	72.6	56%	0.56	42%	0.415	S	S	*	.	H	α-helix	trans	-61.4	-48.8	-178.3	-169.3	163.8	0	0	0	110.6	L148 F149 C150 F154 L155 V156	L148-L152 PolarHBondContact O-N 2.97Å; F149-L152 PolarHBondContact O-N 3.31Å; C150-L152 VanDerWaalsContact C-N 3.34Å; C150-L152 PolarHBondContact O-N 2.9Å; L152-F154 VanDerWaalsContact C-N 3.32Å; L152-F154 PolarHBondContact O-N 2.95Å; L152-L155 PolarHBondContact O-N 3.42Å; L152-V156 HydrophobicContact CD2-CG2 3.81Å; L152-V156 WeakPolarHBondContact O-CB 3.45Å; L152-V156 WeakPolarHBondContact O-CG2 3.36Å; L152-V156 PolarHBondContact O-N 2.87Å
153	V	84.4	Confident	81	Confident	78 Å²	78	75.5 Å²	75.5	47%	0.473	41%	0.414	S	S	.	.	H	α-helix	trans	-60	-44.1	178	174.3	0	0	0	0	110.9	F149 C150 V156 F157	F149-V153 HydrophobicContact CD1-CG2 4.49Å; F149-V153 HydrophobicContact CE1-CG2 4.14Å; F149-V153 HydrophobicContact CZ-CG2 4.34Å; F149-V153 WeakPolarHBondContact O-CG2 3.44Å; F149-V153 PolarHBondContact O-N 3.48Å; F149-V153 VanDerWaalsContact O-N 3.14Å; C150-V153 PolarHBondContact O-N 3.25Å; V153-V156 PolarHBondContact O-N 3.28Å; V153-F157 WeakPolarHBondContact O-CB 3.39Å; V153-F157 PolarHBondContact O-N 2.81Å
154	F	83.8	Confident	80.3	Confident	42 Å²	42	82.7 Å²	82.7	18%	0.184	43%	0.433	C	S	.	.	H	α-helix	trans	-63.6	-43.5	177.7	-178.3	-106.1	0	0	0	112.3	F121 C150 S151 L152 F157 C158	F121-F154 HydrophobicContact CB-CD2 3.99Å; F121-F154 HydrophobicContact CB-CE1 4.33Å; F121-F154 HydrophobicContact CB-CE2 3.15Å; F121-F154 HydrophobicContact CB-CZ 3.35Å; F121-F154 HydrophobicContact CD2-CE2 4.18Å; F121-F154 HydrophobicContact CG-CD2 4.42Å; F121-F154 AromaticContact CG-CE2 3.85Å; F121-F154 HydrophobicContact CG-CE2 3.85Å; F121-F154 HydrophobicContact CG-CZ 4.49Å; C150-F154 WeakPolarHBondContact O-CB 3.17Å; C150-F154 PolarHBondContact O-N 3.46Å; S151-F154 PolarHBondContact O-N 3.44Å; L152-F154 VanDerWaalsContact C-N 3.32Å; L152-F154 PolarHBondContact O-N 2.95Å; F154-F157 PolarHBondContact O-N 3.37Å; F154-C158 VanDerWaalsContact CE1-SG 3.51Å; F154-C158 WeakPolarHBondContact CZ-SG 3.17Å; F154-C158 WeakPolarHBondContact O-CB 3.31Å; F154-C158 PolarHBondContact O-N 3.42Å; F154-C158 PolarHBondContact O-SG 3.4Å; F154-C158 VanDerWaalsContact O-SG 3.34Å
155	L	81.7	Confident	79.7	Confident	91 Å²	91	85.8 Å²	85.8	48%	0.476	44%	0.44	S	S	.	.	H	α-helix	trans	-63.3	-45.4	177	-153.6	-169.9	0	0	0	110.7	S151 L152 F157 C158 L159	S151-L155 WeakPolarHBondContact O-CB 3.42Å; S151-L155 PolarHBondContact O-N 3.28Å; L152-L155 PolarHBondContact O-N 3.42Å; L155-F157 VanDerWaalsContact C-N 3.29Å; L155-F157 PolarHBondContact O-N 2.82Å; L155-C158 PolarHBondContact O-N 3.28Å; L155-L159 HydrophobicContact CD2-CD1 3.35Å; L155-L159 HydrophobicContact CD2-CD2 4.23Å; L155-L159 HydrophobicContact CD2-CG 3.42Å; L155-L159 VanDerWaalsContact CD2-CG 3.42Å; L155-L159 WeakPolarHBondContact O-CB 3.36Å; L155-L159 WeakPolarHBondContact O-CG 3.41Å; L155-L159 PolarHBondContact O-N 2.85Å
156	V	83.4	Confident	78.7	Confident	85 Å²	85	85 Å²	85	52%	0.515	44%	0.437	S	S	.	.	H	α-helix	trans	-59.6	-41.9	175.1	170	0	0	0	0	110.7	L152 V153 L159 S160	L152-V156 HydrophobicContact CD2-CG2 3.81Å; L152-V156 WeakPolarHBondContact O-CB 3.45Å; L152-V156 WeakPolarHBondContact O-CG2 3.36Å; L152-V156 PolarHBondContact O-N 2.87Å; V153-V156 PolarHBondContact O-N 3.28Å; V156-L159 PolarHBondContact O-N 3.19Å; V156-S160 VanDerWaalsContact O-CB 3.25Å; V156-S160 WeakPolarHBondContact O-CB 3.44Å; V156-S160 PolarHBondContact O-N 3.36Å; V156-S160 PolarHBondContact O-OG 3.33Å
157	F	83.4	Confident	77.6	Confident	109 Å²	109	85.9 Å²	85.9	48%	0.478	44%	0.442	S	S	.	.	H	α-helix	trans	-64.9	-45.8	176.2	-173.6	-113.6	0	0	0	112	Y118 V153 F154 L155 L159 S160 A161	Y118-F157 HydrophobicContact CD1-CD1 4.15Å; Y118-F157 HydrophobicContact CD1-CE1 4.16Å; Y118-F157 AromaticContact CE1-CD1 3.27Å; Y118-F157 HydrophobicContact CE1-CD1 3.27Å; Y118-F157 AromaticContact CE1-CE1 3.17Å; Y118-F157 HydrophobicContact CE1-CE1 3.17Å; Y118-F157 HydrophobicContact CE1-CG 4.22Å; Y118-F157 HydrophobicContact CE1-CZ 4.1Å; Y118-F157 AromaticContact CZ-CD1 3.96Å; Y118-F157 AromaticContact CZ-CE1 3.42Å; Y118-F157 VanDerWaalsContact CZ-CE1 3.42Å; Y118-F157 AromaticContact CZ-CZ 3.93Å; Y118-F157 WeakPolarHBondContact OH-CE1 2.94Å; Y118-F157 WeakPolarHBondContact OH-CZ 3.39Å; V153-F157 WeakPolarHBondContact O-CB 3.39Å; V153-F157 PolarHBondContact O-N 2.81Å; F154-F157 PolarHBondContact O-N 3.37Å; L155-F157 VanDerWaalsContact C-N 3.29Å; L155-F157 PolarHBondContact O-N 2.82Å; F157-L159 PolarHBondContact O-N 3.49Å; F157-S160 WeakPolarHBondContact CA-OG 3.33Å; F157-S160 PolarHBondContact O-N 2.89Å; F157-S160 PolarHBondContact O-OG 2.85Å; F157-A161 PolarHBondContact O-N 3.25Å
158	C	80.2	Confident	76.6	Confident	40 Å²	40	92.7 Å²	92.7	27%	0.27	47%	0.474	S	S	.	.	H	α-helix	trans	-59.6	-45.4	173.7	-74.4	0	0	0	0	112.4	Y118 F154 L155 S160 A161 G162	Y118-C158 VanDerWaalsContact CD1-SG 3.56Å; F154-C158 VanDerWaalsContact CE1-SG 3.51Å; F154-C158 WeakPolarHBondContact CZ-SG 3.17Å; F154-C158 WeakPolarHBondContact O-CB 3.31Å; F154-C158 PolarHBondContact O-N 3.42Å; F154-C158 PolarHBondContact O-SG 3.4Å; F154-C158 VanDerWaalsContact O-SG 3.34Å; L155-C158 PolarHBondContact O-N 3.28Å; C158-S160 VanDerWaalsContact C-N 3.33Å; C158-A161 PolarHBondContact O-N 2.92Å; C158-G162 PolarHBondContact O-N 3.14Å
159	L	80.5	Confident	75.3	Confident	84 Å²	84	99 Å²	99	44%	0.44	49%	0.491	S	S	.	.	H	α-helix	trans	-67.2	-34.4	175.5	-72.4	178.3	0	0	0	111.8	L155 V156 F157 A161 G162 R163	L155-L159 HydrophobicContact CD2-CD1 3.35Å; L155-L159 HydrophobicContact CD2-CD2 4.23Å; L155-L159 HydrophobicContact CD2-CG 3.42Å; L155-L159 VanDerWaalsContact CD2-CG 3.42Å; L155-L159 WeakPolarHBondContact O-CB 3.36Å; L155-L159 WeakPolarHBondContact O-CG 3.41Å; L155-L159 PolarHBondContact O-N 2.85Å; V156-L159 PolarHBondContact O-N 3.19Å; F157-L159 PolarHBondContact O-N 3.49Å; L159-A161 VanDerWaalsContact C-N 3.3Å; L159-A161 PolarHBondContact O-N 2.86Å; L159-G162 PolarHBondContact O-N 3.19Å; L159-R163 WeakPolarHBondContact O-CB 3.43Å; L159-R163 WeakPolarHBondContact O-CG 3.34Å; L159-R163 PolarHBondContact O-N 3.49Å
160	S	82.7	Confident	73.9	Confident	50 Å²	50	100.1 Å²	100.1	35%	0.35	50%	0.498	S	S	.	.	H	α-helix	trans	-64.8	-38.7	176.3	76.9	0	0	0	0	110.9	V156 F157 C158 R164	V156-S160 VanDerWaalsContact O-CB 3.25Å; V156-S160 WeakPolarHBondContact O-CB 3.44Å; V156-S160 PolarHBondContact O-N 3.36Å; V156-S160 PolarHBondContact O-OG 3.33Å; F157-S160 WeakPolarHBondContact CA-OG 3.33Å; F157-S160 PolarHBondContact O-N 2.89Å; F157-S160 PolarHBondContact O-OG 2.85Å; C158-S160 VanDerWaalsContact C-N 3.33Å; S160-R164 WeakPolarHBondContact O-CG 3.42Å; S160-R164 PolarHBondContact O-N 2.96Å; S160-R164 VanDerWaalsContact O-N 3.14Å
161	A	73.8	Confident	72.2	Confident	19 Å²	19	101.6 Å²	101.6	16%	0.157	51%	0.509	C	S	.	.	H	α-helix	trans	-70.3	-42.6	174.5	0	0	0	0	0	112	Y118 F157 C158 L159 R164 R165	Y118-A161 HydrophobicContact CE1-CB 4Å; Y118-A161 HydrophobicContact CE2-CB 3.85Å; Y118-A161 VanDerWaalsContact CZ-CB 3.45Å; Y118-A161 VanDerWaalsContact OH-CB 3.28Å; Y118-A161 WeakPolarHBondContact OH-CB 2.81Å; F157-A161 PolarHBondContact O-N 3.25Å; C158-A161 PolarHBondContact O-N 2.92Å; L159-A161 VanDerWaalsContact C-N 3.3Å; L159-A161 PolarHBondContact O-N 2.86Å; A161-R164 PolarHBondContact O-N 3.38Å; A161-R165 PolarHBondContact O-N 2.75Å
162	G	71.9	Confident	70.6	Confident	31 Å²	31	104.9 Å²	104.9	32%	0.32	53%	0.53	S	S	.	.	H	α-helix	trans	-64.6	-38.6	175.3	0	0	0	0	0	112.8	C158 L159 R165 N166	C158-G162 PolarHBondContact O-N 3.14Å; L159-G162 PolarHBondContact O-N 3.19Å; G162-R165 PolarHBondContact O-N 3.32Å; G162-N166 PolarHBondContact O-N 2.95Å; G162-N166 VanDerWaalsContact O-N 3.07Å
163	R	75.9	Confident	68.8	Low	169 Å²	169	111 Å²	111	64%	0.638	55%	0.546	S	S	*	.	H	α-helix	trans	-63.8	-39.9	175.3	-81.6	179.2	160.6	126.9	-0.5	111.5	L159 R165 N166 S167	L159-R163 WeakPolarHBondContact O-CB 3.43Å; L159-R163 WeakPolarHBondContact O-CG 3.34Å; L159-R163 PolarHBondContact O-N 3.49Å; R163-R165 VanDerWaalsContact C-N 3.32Å; R163-R165 PolarHBondContact O-N 3.48Å; R163-N166 PolarHBondContact O-N 3.46Å; R163-S167 PolarHBondContact O-N 3.44Å; R163-S167 PolarHBondContact O-OG 2.89Å
164	R	65.6	Low	67.3	Low	201 Å²	201	112.7 Å²	112.7	76%	0.758	56%	0.556	S	S	*	*	H	α-helix	trans	-59.4	-42.4	173.7	-76.5	-178.2	-179.7	-126.4	1.8	112	S160 A161 N166 S167 E168	S160-R164 WeakPolarHBondContact O-CG 3.42Å; S160-R164 PolarHBondContact O-N 2.96Å; S160-R164 VanDerWaalsContact O-N 3.14Å; A161-R164 PolarHBondContact O-N 3.38Å; R164-N166 VanDerWaalsContact C-N 3.32Å; R164-N166 PolarHBondContact O-N 3.21Å; R164-S167 PolarHBondContact O-N 2.95Å; R164-E168 PolarHBondContact O-N 2.83Å
165	R	62.2	Low	65.6	Low	131 Å²	131	116 Å²	116	49%	0.494	58%	0.579	S	S	.	*	H	α-helix	trans	-65.3	-33.8	176.3	-69.7	-179.8	176	-177	-5.5	112.7	D112 A161 G162 R163	D112-R165 IonicContact OD1-NH2 3.56Å; D112-R165 IonicContact OD2-NH2 3.02Å; D112-R165 PolarHBondContact OD2-NH2 3.03Å; A161-R165 PolarHBondContact O-N 2.75Å; G162-R165 PolarHBondContact O-N 3.32Å; R163-R165 VanDerWaalsContact C-N 3.32Å; R163-R165 PolarHBondContact O-N 3.48Å
166	N	61.2	Low	64.3	Low	109 Å²	109	117.7 Å²	117.7	58%	0.583	59%	0.594	S	S	*	*	H	α-helix	trans	-75.9	-32.7	177.3	-75.7	-10.8	0	0	0	113.3	G162 R163 R164 E168 R169	G162-N166 PolarHBondContact O-N 2.95Å; G162-N166 VanDerWaalsContact O-N 3.07Å; R163-N166 PolarHBondContact O-N 3.46Å; R164-N166 VanDerWaalsContact C-N 3.32Å; R164-N166 PolarHBondContact O-N 3.21Å; N166-E168 PolarHBondContact O-N 3.38Å; N166-R169 PolarHBondContact O-N 3.01Å
167	S	59.6	Low	62.9	Low	92 Å²	92	117.9 Å²	117.9	64%	0.643	60%	0.595	S	S	*	*	H	α-helix	trans	-63.5	-28.4	174.8	-63.6	0	0	0	0	112.9	R163 R164 Q170	R163-S167 PolarHBondContact O-N 3.44Å; R163-S167 PolarHBondContact O-OG 2.89Å; R164-S167 PolarHBondContact O-N 2.95Å; S167-Q170 PolarHBondContact O-N 3.3Å
168	E	58.1	Low	61.4	Low	167 Å²	167	117.7 Å²	117.7	78%	0.78	61%	0.614	S	S	*	*	H	α-helix	trans	-75.5	-25.1	179.5	-150.8	177.7	121.2	0	0	113.2	R164 N166 Q170	R164-E168 PolarHBondContact O-N 2.83Å; N166-E168 PolarHBondContact O-N 3.38Å; E168-Q170 VanDerWaalsContact C-N 3.28Å; E168-Q170 PolarHBondContact O-N 3.45Å
169	R	54.8	Low	60.3	Low	225 Å²	225	122.4 Å²	122.4	85%	0.849	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-9.6	174.9	-73.2	-172.4	177.9	-106.4	0.6	114	N166	N166-R169 PolarHBondContact O-N 3.01Å
170	Q	56.7	Low	59	Low	169 Å²	169	122.3 Å²	122.3	79%	0.79	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	19.1	-172.6	-155.9	109.9	13.1	0	0	113.6	S167 E168	S167-Q170 PolarHBondContact O-N 3.3Å; E168-Q170 VanDerWaalsContact C-N 3.28Å; E168-Q170 PolarHBondContact O-N 3.45Å
171	S	47.7	Very low	57.6	Low	102 Å²	102	124.5 Å²	124.5	71%	0.713	66%	0.661	S	S	*	*	S	Bend	trans	-88.8	131.2	168.6	-155.5	0	0	0	0	110.2
172	P	49.9	Very low	56.8	Low	101 Å²	101	129.2 Å²	129.2	66%	0.656	69%	0.688	S	S	*	*			trans	-77.3	133.7	-144.4	30.3	-34.7	0	0	0	113.9	V174	P172-V174 HydrophobicContact CG-CG2 4.43Å; P172-V174 PolarHBondContact O-N 2.99Å
173	R	46.6	Very low	55.8	Low	236 Å²	236	135 Å²	135	89%	0.891	71%	0.712	S	S	*	*			trans	-59.5	83.8	160.2	-172.8	-178.7	-173.4	168.1	1.8	108.8	T175	R173-T175 VanDerWaalsContact C-N 3.27Å; R173-T175 PolarHBondContact O-N 3.47Å
174	V	54.3	Low	54.6	Low	113 Å²	113	131.1 Å²	131.1	69%	0.685	72%	0.716	S	S	*	*			trans	-73.4	92.6	166.9	-178	0	0	0	0	107	P172 V176	P172-V174 HydrophobicContact CG-CG2 4.43Å; P172-V174 PolarHBondContact O-N 2.99Å; V174-V176 VanDerWaalsContact C-N 3.33Å; V174-V176 HydrophobicContact CG1-CG2 3.97Å; V174-V176 PolarHBondContact O-N 2.99Å
175	T	48.4	Very low	54.3	Low	111 Å²	111	128.5 Å²	128.5	68%	0.681	72%	0.722	S	S	*	*			trans	-43.3	93.6	155.3	-56.8	0	0	0	0	109.5	R173	R173-T175 VanDerWaalsContact C-N 3.27Å; R173-T175 PolarHBondContact O-N 3.47Å
176	V	54.7	Low	53.9	Low	128 Å²	128	126.9 Å²	126.9	78%	0.776	74%	0.737	S	S	*	*			trans	-95.2	94.6	161.2	-176.4	0	0	0	0	107	V174 A178	V174-V176 VanDerWaalsContact C-N 3.33Å; V174-V176 HydrophobicContact CG1-CG2 3.97Å; V174-V176 PolarHBondContact O-N 2.99Å; V176-A178 PolarHBondContact O-N 3.21Å
177	T	53.2	Low	53.8	Low	89 Å²	89	131 Å²	131	55%	0.546	77%	0.774	S	S	.	*			trans	-35.2	109.5	162	-47	0	0	0	0	111.5	I179	T177-I179 HydrophobicContact CG2-CB 4.27Å; T177-I179 HydrophobicContact CG2-CG1 3.84Å; T177-I179 HydrophobicContact CG2-CG2 4.21Å; T177-I179 VanDerWaalsContact O-CG1 3.31Å; T177-I179 WeakPolarHBondContact O-CG1 3.39Å; T177-I179 PolarHBondContact O-N 3.01Å
178	A	52.2	Low	53.5	Low	105 Å²	105	132.9 Å²	132.9	87%	0.868	78%	0.781	S	S	*	*			trans	-73.3	81.3	155.5	0	0	0	0	0	107.1	V176	V176-A178 PolarHBondContact O-N 3.21Å
179	I	56.8	Low	53.3	Low	139 Å²	139	131.1 Å²	131.1	71%	0.713	78%	0.781	S	S	*	*			trans	-62.7	128.1	166.1	-4.2	178	0	0	0	106.7	T177	T177-I179 HydrophobicContact CG2-CB 4.27Å; T177-I179 HydrophobicContact CG2-CG1 3.84Å; T177-I179 HydrophobicContact CG2-CG2 4.21Å; T177-I179 VanDerWaalsContact O-CG1 3.31Å; T177-I179 WeakPolarHBondContact O-CG1 3.39Å; T177-I179 PolarHBondContact O-N 3.01Å
180	A	53.7	Low	53.2	Low	81 Å²	81	125.9 Å²	125.9	67%	0.669	78%	0.777	S	S	*	*			trans	29.6	132.5	130.6	0	0	0	0	0	116
181	S	52.1	Low	53	Low	96 Å²	96	123.4 Å²	123.4	67%	0.671	78%	0.776	S	S	*	*			cis	160.8	156.6	39	25.5	0	0	0	0	106.6
182	T	57	Low	53.3	Low	119 Å²	119	124.7 Å²	124.7	73%	0.73	78%	0.78	S	S	*	*			trans	64.4	119.5	143.7	56.7	0	0	0	0	120.3
183	N	50.3	Low	53.5	Low	152 Å²	152	126.3 Å²	126.3	81%	0.813	79%	0.788	S	S	*	*			trans	148.9	95.3	138.3	-73.6	-7	0	0	0	106.2
184	A	51.1	Low	54	Low	87 Å²	87	118.4 Å²	118.4	72%	0.719	78%	0.781	S	S	*	*			cis	43.8	106.9	46.5	0	0	0	0	0	112.5
185	T	60.3	Low	54	Low	146 Å²	146	118.8 Å²	118.8	90%	0.896	79%	0.788	S	S	*	*			trans	119.6	124.6	153.7	-38.4	0	0	0	0	115.9
186	A	53.8	Low	54.5	Low	98 Å²	98	119.5 Å²	119.5	81%	0.81	80%	0.797	S	S	*	*			trans	79.4	96.8	155.7	0	0	0	0	0	119.7
187	S	58.3	Low	54.4	Low	194 Å²	194	118.7 Å²	118.7	100%	1.357	80%	0.799	S	S	*	*				-158.4	0	107.2	-168.5	0	0	0	0	111.1

Retrieved 187 of 187 residues in 504.3 ms (Link to these results)

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