G4VIW8_SCHMA Loading...

DNA-binding protein

AlphaFold DB , UniProt , Accession G4VIW8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 178 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	46.8	Very low	46.8	Very low	247 Å²	247	146.1 Å²	146.1	100%	1.217	82%	0.823	S	S	*	*				0	125.3	0	-58.4	-161.1	-156.2	0	0	106.9
2	S	51.4	Low	46.8	Very low	134 Å²	134	141.1 Å²	141.1	94%	0.937	81%	0.813	S	S	*	*			trans	-70.5	127.6	177.8	-74.9	0	0	0	0	110
3	S	52.6	Low	46.6	Very low	120 Å²	120	140.2 Å²	140.2	84%	0.839	80%	0.804	S	S	*	*			trans	-87.7	126.1	173.1	-167.9	0	0	0	0	108.5
4	I	51.4	Low	46.2	Very low	152 Å²	152	143.4 Å²	143.4	78%	0.779	81%	0.808	S	S	*	*			trans	-102.4	114.5	173.4	-157.7	148.7	0	0	0	107.4	V6	I4-V6 HydrophobicContact CG2-CG2 4.32Å; I4-V6 PolarHBondContact O-N 2.83Å
5	A	48.1	Very low	46.3	Very low	97 Å²	97	142.6 Å²	142.6	80%	0.802	80%	0.799	S	S	*	*			trans	-79.1	104.7	171	0	0	0	0	0	107	Q7	A5-Q7 PolarHBondContact O-N 3.02Å
6	V	51.9	Low	46	Very low	112 Å²	112	142.5 Å²	142.5	68%	0.679	80%	0.797	S	S	*	*			trans	-77.6	101.3	170.7	-178.2	0	0	0	0	106.3	I4 T8	I4-V6 HydrophobicContact CG2-CG2 4.32Å; I4-V6 PolarHBondContact O-N 2.83Å; V6-T8 HydrophobicContact CG1-CG2 4.21Å; V6-T8 PolarHBondContact O-N 3.04Å; V6-T8 VanDerWaalsContact O-N 3.1Å
7	Q	39.2	Very low	45.9	Very low	187 Å²	187	138 Å²	138	87%	0.874	77%	0.773	S	S	*	*			trans	-74	96.1	168.5	-166	168.1	5.3	0	0	106.6	A5 E9	A5-Q7 PolarHBondContact O-N 3.02Å; Q7-E9 PolarHBondContact O-N 2.63Å; Q7-E9 VanDerWaalsContact O-N 3.13Å
8	T	45.7	Very low	45.8	Very low	118 Å²	118	135.9 Å²	135.9	72%	0.724	76%	0.76	S	S	*	*			trans	-72.3	100.3	167.3	39.1	0	0	0	0	107	V6 E10	V6-T8 HydrophobicContact CG1-CG2 4.21Å; V6-T8 PolarHBondContact O-N 3.04Å; V6-T8 VanDerWaalsContact O-N 3.1Å; T8-E10 PolarHBondContact O-N 2.91Å
9	E	43.3	Very low	46.1	Very low	166 Å²	166	130.2 Å²	130.2	78%	0.776	73%	0.73	S	S	*	*			trans	-63.1	95.5	159	-171.1	170.3	-166.9	0	0	106.2	Q7 T11	Q7-E9 PolarHBondContact O-N 2.63Å; Q7-E9 VanDerWaalsContact O-N 3.13Å; E9-T11 HydrophobicContact CG-CG2 4.45Å; E9-T11 PolarHBondContact O-N 3.28Å
10	E	42	Very low	46.5	Very low	177 Å²	177	128.1 Å²	128.1	83%	0.827	72%	0.724	S	S	*	*			trans	-65.6	88.4	166.9	-172	174.3	-170.4	0	0	105.9	T8 A12	T8-E10 PolarHBondContact O-N 2.91Å; E10-A12 PolarHBondContact O-N 3.43Å
11	T	42	Very low	46.8	Very low	97 Å²	97	126.5 Å²	126.5	60%	0.595	71%	0.713	S	S	*	*			trans	-65.7	92	161.3	32.6	0	0	0	0	104.8	E9 N13	E9-T11 HydrophobicContact CG-CG2 4.45Å; E9-T11 PolarHBondContact O-N 3.28Å; T11-N13 PolarHBondContact O-N 3.49Å
12	A	46.8	Very low	47.1	Very low	86 Å²	86	117.3 Å²	117.3	71%	0.711	67%	0.673	S	S	*	*			trans	-56.7	88.2	153.1	0	0	0	0	0	104.7	E10 E14	E10-A12 PolarHBondContact O-N 3.43Å; A12-E14 PolarHBondContact O-N 3.42Å
13	N	44.3	Very low	47.3	Very low	129 Å²	129	114 Å²	114	69%	0.69	64%	0.644	S	S	*	*			trans	-58.3	98.9	155.5	-72.5	-38.7	0	0	0	101.9	T11 I15	T11-N13 PolarHBondContact O-N 3.49Å; N13-I15 WeakPolarHBondContact O-CG1 3.37Å; N13-I15 PolarHBondContact O-N 2.87Å
14	E	41.7	Very low	47.7	Very low	186 Å²	186	110.3 Å²	110.3	87%	0.869	63%	0.625	S	S	*	*			trans	-59	87.5	164.7	-163	173.6	-152.3	0	0	103.2	A12 N16	A12-E14 PolarHBondContact O-N 3.42Å; E14-N16 PolarHBondContact O-N 3.28Å
15	I	47.2	Very low	48.3	Very low	131 Å²	131	105.7 Å²	105.7	67%	0.672	60%	0.602	S	S	*	*			trans	-64.8	101.9	171.6	-52.8	177.4	0	0	0	100.3	N13 V17	N13-I15 WeakPolarHBondContact O-CG1 3.37Å; N13-I15 PolarHBondContact O-N 2.87Å; I15-V17 HydrophobicContact CB-CG2 3.8Å; I15-V17 HydrophobicContact CG2-CB 4.42Å; I15-V17 HydrophobicContact CG2-CG2 3.31Å; I15-V17 PolarHBondContact O-N 2.73Å
16	N	41.3	Very low	49.1	Very low	141 Å²	141	106 Å²	106	75%	0.754	59%	0.585	S	S	*	*			trans	-66.2	68.1	164.1	-168.5	7.2	0	0	0	105.7	E14 D18	E14-N16 PolarHBondContact O-N 3.28Å; N16-D18 PolarHBondContact O-N 3.14Å
17	V	45.1	Very low	49.6	Very low	66 Å²	66	103.8 Å²	103.8	40%	0.4	57%	0.572	S	S	.	*			trans	-66.1	111.2	163.9	-168.5	0	0	0	0	101.5	I15 S19 C22	I15-V17 HydrophobicContact CB-CG2 3.8Å; I15-V17 HydrophobicContact CG2-CB 4.42Å; I15-V17 HydrophobicContact CG2-CG2 3.31Å; I15-V17 PolarHBondContact O-N 2.73Å; V17-S19 PolarHBondContact O-N 3.27Å; V17-C22 HydrophobicContact CG1-CB 4.44Å; V17-C22 WeakPolarHBondContact CG1-SG 3.45Å
18	D	44.4	Very low	50.7	Low	101 Å²	101	98.6 Å²	98.6	54%	0.54	55%	0.548	S	S	.	.			trans	-38.9	111.3	176.3	-79	-43.2	0	0	0	107.5	N16 S20 I21 C22	N16-D18 PolarHBondContact O-N 3.14Å; D18-S20 PolarHBondContact O-N 3.21Å; D18-I21 HydrophobicContact CB-CD1 4.06Å; D18-I21 HydrophobicContact CB-CG1 4.1Å; D18-I21 PolarHBondContact O-N 3.31Å; D18-C22 PolarHBondContact O-N 3.37Å
19	S	50.7	Low	51.6	Low	26 Å²	26	96.5 Å²	96.5	18%	0.182	53%	0.531	C	S	.	.	H	α-helix	trans	-57.2	-24.9	-170.7	58.8	0	0	0	0	111.3	V17 C22 N23	V17-S19 PolarHBondContact O-N 3.27Å; S19-C22 PolarHBondContact O-N 2.93Å; S19-N23 WeakPolarHBondContact O-CB 3.48Å; S19-N23 PolarHBondContact O-N 2.93Å; S19-N23 PolarHBondContact O-OD1 3.37Å
20	S	54.3	Low	52.5	Low	89 Å²	89	89.7 Å²	89.7	62%	0.622	50%	0.5	S	S	*	.	H	α-helix	trans	-59.8	-43.9	169.9	-179.5	0	0	0	0	113.9	D18 G24	D18-S20 PolarHBondContact O-N 3.21Å; S20-G24 PolarHBondContact O-N 3.41Å
21	I	53.4	Low	53.5	Low	94 Å²	94	84.8 Å²	84.8	48%	0.482	49%	0.485	S	S	.	.	H	α-helix	trans	-70.1	-44.4	177.4	-62.8	174	0	0	0	109.8	D18 G24 L25	D18-I21 HydrophobicContact CB-CD1 4.06Å; D18-I21 HydrophobicContact CB-CG1 4.1Å; D18-I21 PolarHBondContact O-N 3.31Å; I21-G24 PolarHBondContact O-N 2.99Å; I21-L25 HydrophobicContact CG2-CD1 3.96Å; I21-L25 HydrophobicContact CG2-CG 4.32Å; I21-L25 WeakPolarHBondContact O-CB 3.47Å; I21-L25 VanDerWaalsContact O-CG 3.3Å; I21-L25 WeakPolarHBondContact O-CG 3.34Å; I21-L25 PolarHBondContact O-N 3.46Å
22	C	53.1	Low	54.5	Low	55 Å²	55	82.5 Å²	82.5	37%	0.372	47%	0.469	S	S	.	.	H	α-helix	trans	-60.8	-45.1	176.1	-92.3	0	0	0	0	111.9	V17 D18 S19 L25 F26	V17-C22 HydrophobicContact CG1-CB 4.44Å; V17-C22 WeakPolarHBondContact CG1-SG 3.45Å; D18-C22 PolarHBondContact O-N 3.37Å; S19-C22 PolarHBondContact O-N 2.93Å; C22-L25 PolarHBondContact O-N 3.46Å; C22-F26 WeakPolarHBondContact O-CB 3.36Å; C22-F26 PolarHBondContact O-N 3.36Å
23	N	55.1	Low	55	Low	64 Å²	64	81.4 Å²	81.4	34%	0.342	45%	0.451	S	S	.	.	H	α-helix	trans	-64	-44.1	176.3	-74.6	-4.9	0	0	0	110.7	S19 L25 F26 T27	S19-N23 WeakPolarHBondContact O-CB 3.48Å; S19-N23 PolarHBondContact O-N 2.93Å; S19-N23 PolarHBondContact O-OD1 3.37Å; N23-L25 PolarHBondContact O-N 3.45Å; N23-F26 PolarHBondContact O-N 3.44Å; N23-T27 VanDerWaalsContact O-CB 3.31Å; N23-T27 WeakPolarHBondContact O-CB 3.41Å; N23-T27 PolarHBondContact O-N 2.95Å; N23-T27 PolarHBondContact O-OG1 3.47Å
24	G	61.2	Low	55.6	Low	42 Å²	42	78.6 Å²	78.6	43%	0.433	44%	0.436	S	S	.	.	H	α-helix	trans	-58.8	-46.2	176.3	0	0	0	0	0	112.7	S20 I21 Q28	S20-G24 PolarHBondContact O-N 3.41Å; I21-G24 PolarHBondContact O-N 2.99Å; G24-Q28 VanDerWaalsContact O-CB 3.27Å; G24-Q28 WeakPolarHBondContact O-CB 3.3Å; G24-Q28 PolarHBondContact O-N 3.14Å
25	L	63	Low	56	Low	55 Å²	55	72.2 Å²	72.2	29%	0.288	41%	0.408	S	S	.	.	H	α-helix	trans	-66.7	-43	176.5	-70.3	174.6	0	0	0	112	I21 C22 N23 Q28 I29 I137 L141	I21-L25 HydrophobicContact CG2-CD1 3.96Å; I21-L25 HydrophobicContact CG2-CG 4.32Å; I21-L25 WeakPolarHBondContact O-CB 3.47Å; I21-L25 VanDerWaalsContact O-CG 3.3Å; I21-L25 WeakPolarHBondContact O-CG 3.34Å; I21-L25 PolarHBondContact O-N 3.46Å; C22-L25 PolarHBondContact O-N 3.46Å; N23-L25 PolarHBondContact O-N 3.45Å; L25-Q28 PolarHBondContact O-N 3.49Å; L25-I29 WeakPolarHBondContact O-CB 3.31Å; L25-I29 WeakPolarHBondContact O-CD1 3.32Å; L25-I29 VanDerWaalsContact O-CG1 3.22Å; L25-I29 WeakPolarHBondContact O-CG1 3.4Å; L25-I29 PolarHBondContact O-N 2.96Å; L25-I137 HydrophobicContact CD2-CG2 4.4Å; L25-L141 HydrophobicContact CD2-CD1 3.58Å
26	F	65	Low	56.6	Low	103 Å²	103	74.1 Å²	74.1	45%	0.452	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-50.7	178.9	-173.7	-107	0	0	0	110.4	C22 N23 Q28 I29 L30	C22-F26 WeakPolarHBondContact O-CB 3.36Å; C22-F26 PolarHBondContact O-N 3.36Å; N23-F26 PolarHBondContact O-N 3.44Å; F26-Q28 VanDerWaalsContact C-N 3.3Å; F26-Q28 PolarHBondContact O-N 2.92Å; F26-I29 PolarHBondContact O-N 3.09Å; F26-L30 HydrophobicContact CD1-CD1 3.7Å; F26-L30 HydrophobicContact CD1-CG 4.26Å; F26-L30 HydrophobicContact CE1-CD1 3.29Å; F26-L30 HydrophobicContact CE1-CG 4.06Å; F26-L30 HydrophobicContact CE2-CD2 4.49Å; F26-L30 HydrophobicContact CG-CD1 4.49Å; F26-L30 HydrophobicContact CZ-CD1 3.79Å; F26-L30 HydrophobicContact CZ-CD2 4.25Å; F26-L30 HydrophobicContact CZ-CG 4.21Å; F26-L30 VanDerWaalsContact O-CG 3.28Å; F26-L30 WeakPolarHBondContact O-CG 3.29Å; F26-L30 PolarHBondContact O-N 3.43Å
27	T	62.4	Low	57.1	Low	66 Å²	66	73.7 Å²	73.7	41%	0.405	41%	0.407	S	S	.	.	H	α-helix	trans	-56.9	-43.3	174.4	-59.4	0	0	0	0	111.5	N23 L30 S31	N23-T27 VanDerWaalsContact O-CB 3.31Å; N23-T27 WeakPolarHBondContact O-CB 3.41Å; N23-T27 PolarHBondContact O-N 2.95Å; N23-T27 PolarHBondContact O-OG1 3.47Å; T27-L30 PolarHBondContact O-N 3.23Å; T27-S31 PolarHBondContact O-N 3.05Å; T27-S31 PolarHBondContact O-OG 2.91Å; T27-S31 VanDerWaalsContact O-OG 3.11Å
28	Q	62.1	Low	57.4	Low	79 Å²	79	74.7 Å²	74.7	37%	0.369	41%	0.41	S	S	.	.	H	α-helix	trans	-66.4	-40.3	178.8	-169.2	169.7	38.9	0	0	112.7	G24 L25 F26 L30 S31 I32 L141	G24-Q28 VanDerWaalsContact O-CB 3.27Å; G24-Q28 WeakPolarHBondContact O-CB 3.3Å; G24-Q28 PolarHBondContact O-N 3.14Å; L25-Q28 PolarHBondContact O-N 3.49Å; F26-Q28 VanDerWaalsContact C-N 3.3Å; F26-Q28 PolarHBondContact O-N 2.92Å; Q28-L30 VanDerWaalsContact C-N 3.33Å; Q28-S31 PolarHBondContact O-N 3.02Å; Q28-I32 HydrophobicContact CG-CD1 4.39Å; Q28-I32 WeakPolarHBondContact O-CD1 3.4Å; Q28-I32 VanDerWaalsContact O-CG1 3.24Å; Q28-I32 WeakPolarHBondContact O-CG1 3.47Å; Q28-I32 PolarHBondContact O-N 2.97Å; Q28-L141 HydrophobicContact CG-CD2 4.48Å; Q28-L141 VanDerWaalsContact OE1-CD2 3.3Å
29	I	65.4	Low	58	Low	74 Å²	74	74.8 Å²	74.8	38%	0.379	41%	0.406	S	S	.	.	H	α-helix	trans	-61.4	-44.6	172.9	-70	164.1	0	0	0	110	L25 F26 I32 L33	L25-I29 WeakPolarHBondContact O-CB 3.31Å; L25-I29 WeakPolarHBondContact O-CD1 3.32Å; L25-I29 VanDerWaalsContact O-CG1 3.22Å; L25-I29 WeakPolarHBondContact O-CG1 3.4Å; L25-I29 PolarHBondContact O-N 2.96Å; F26-I29 PolarHBondContact O-N 3.09Å; I29-I32 WeakPolarHBondContact O-CB 3.25Å; I29-I32 PolarHBondContact O-N 3.46Å; I29-I32 VanDerWaalsContact O-N 3.16Å; I29-L33 HydrophobicContact CG2-CD1 4.19Å; I29-L33 WeakPolarHBondContact O-CG 3.43Å; I29-L33 PolarHBondContact O-N 3.5Å
30	L	62.5	Low	58.3	Low	22 Å²	22	78 Å²	78	12%	0.115	42%	0.416	C	S	.	.	H	α-helix	trans	-63.7	-41.5	178.4	-67.4	-176	0	0	0	111.9	F26 T27 Q28 I32 L33 D34 Y42	F26-L30 HydrophobicContact CD1-CD1 3.7Å; F26-L30 HydrophobicContact CD1-CG 4.26Å; F26-L30 HydrophobicContact CE1-CD1 3.29Å; F26-L30 HydrophobicContact CE1-CG 4.06Å; F26-L30 HydrophobicContact CE2-CD2 4.49Å; F26-L30 HydrophobicContact CG-CD1 4.49Å; F26-L30 HydrophobicContact CZ-CD1 3.79Å; F26-L30 HydrophobicContact CZ-CD2 4.25Å; F26-L30 HydrophobicContact CZ-CG 4.21Å; F26-L30 VanDerWaalsContact O-CG 3.28Å; F26-L30 WeakPolarHBondContact O-CG 3.29Å; F26-L30 PolarHBondContact O-N 3.43Å; T27-L30 PolarHBondContact O-N 3.23Å; Q28-L30 VanDerWaalsContact C-N 3.33Å; L30-I32 PolarHBondContact O-N 2.93Å; L30-L33 HydrophobicContact CD2-CD1 4.35Å; L30-L33 CarbonylContact O-C 3.53Å; L30-L33 PolarHBondContact O-N 3.24Å; L30-L33 VanDerWaalsContact O-N 3.07Å; L30-D34 WeakPolarHBondContact O-CB 3.26Å; L30-D34 PolarHBondContact O-N 2.9Å; L30-Y42 HydrophobicContact CB-CD2 4.24Å; L30-Y42 HydrophobicContact CB-CE2 4.1Å; L30-Y42 HydrophobicContact CD1-CD1 4.22Å; L30-Y42 HydrophobicContact CD1-CD2 3.38Å; L30-Y42 HydrophobicContact CD1-CE2 3.77Å; L30-Y42 HydrophobicContact CD1-CG 3.61Å; L30-Y42 HydrophobicContact CD2-CD1 4.48Å; L30-Y42 HydrophobicContact CD2-CD2 3.87Å; L30-Y42 HydrophobicContact CD2-CE1 4.01Å; L30-Y42 HydrophobicContact CD2-CE2 3.28Å; L30-Y42 HydrophobicContact CD2-CG 4.41Å; L30-Y42 HydrophobicContact CG-CD2 3.99Å; L30-Y42 HydrophobicContact CG-CE2 3.86Å
31	S	62.1	Low	58.3	Low	74 Å²	74	83.1 Å²	83.1	52%	0.517	42%	0.424	S	S	.	.	H	α-helix	trans	-65.6	-23.9	174.2	-61.3	0	0	0	0	113.7	T27 Q28	T27-S31 PolarHBondContact O-N 3.05Å; T27-S31 PolarHBondContact O-OG 2.91Å; T27-S31 VanDerWaalsContact O-OG 3.11Å; Q28-S31 PolarHBondContact O-N 3.02Å
32	I	62.9	Low	58.3	Low	49 Å²	49	83.6 Å²	83.6	25%	0.251	42%	0.42	S	S	.	.	H	α-helix	trans	-77.1	-31.7	172.1	-67.7	161.4	0	0	0	111	Q28 I29 L30 T144	Q28-I32 HydrophobicContact CG-CD1 4.39Å; Q28-I32 WeakPolarHBondContact O-CD1 3.4Å; Q28-I32 VanDerWaalsContact O-CG1 3.24Å; Q28-I32 WeakPolarHBondContact O-CG1 3.47Å; Q28-I32 PolarHBondContact O-N 2.97Å; I29-I32 WeakPolarHBondContact O-CB 3.25Å; I29-I32 PolarHBondContact O-N 3.46Å; I29-I32 VanDerWaalsContact O-N 3.16Å; L30-I32 PolarHBondContact O-N 2.93Å; I32-T144 HydrophobicContact CD1-CG2 4.11Å
33	L	58.2	Low	58.2	Low	64 Å²	64	86.7 Å²	86.7	34%	0.335	43%	0.433	S	S	.	.	H	α-helix	trans	-80.1	-24.8	175.7	-65.5	173.8	0	0	0	112.7	I29 L30 D35 L109	I29-L33 HydrophobicContact CG2-CD1 4.19Å; I29-L33 WeakPolarHBondContact O-CG 3.43Å; I29-L33 PolarHBondContact O-N 3.5Å; L30-L33 HydrophobicContact CD2-CD1 4.35Å; L30-L33 CarbonylContact O-C 3.53Å; L30-L33 PolarHBondContact O-N 3.24Å; L30-L33 VanDerWaalsContact O-N 3.07Å; L33-D35 PolarHBondContact O-N 2.78Å; L33-D35 VanDerWaalsContact O-N 3.12Å; L33-L109 HydrophobicContact CD2-CD2 4.27Å
34	D	55.8	Low	58.1	Low	70 Å²	70	87.9 Å²	87.9	37%	0.374	44%	0.438	S	S	.	.			trans	-69	96.3	169.8	-167.9	12.3	0	0	0	108.7	L30 K39	L30-D34 WeakPolarHBondContact O-CB 3.26Å; L30-D34 PolarHBondContact O-N 2.9Å; D34-K39 VanDerWaalsContact OD1-CA 3.23Å; D34-K39 WeakPolarHBondContact OD1-CA 3.34Å; D34-K39 WeakPolarHBondContact OD1-CG 3.46Å
35	D	51.8	Low	57.6	Low	51 Å²	51	89.5 Å²	89.5	27%	0.273	44%	0.443	S	S	.	.	B	Isolated β-bridge	trans	-97.2	163.9	169.9	70.3	31.8	0	0	0	110.5	L33 H37 N38	L33-D35 PolarHBondContact O-N 2.78Å; L33-D35 VanDerWaalsContact O-N 3.12Å; D35-H37 PolarHBondContact O-N 2.87Å; D35-H37 WeakPolarHBondContact OD1-CA 3.44Å; D35-H37 PolarHBondContact OD1-N 2.82Å; D35-N38 PolarHBondContact O-N 2.95Å; D35-N38 VanDerWaalsContact OD1-CB 3.3Å; D35-N38 WeakPolarHBondContact OD1-CB 3.43Å; D35-N38 PolarHBondContact OD1-N 3.18Å
36	E	59.6	Low	56.6	Low	172 Å²	172	95.9 Å²	95.9	80%	0.804	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-17.3	-178.1	-70.4	-178.9	176.3	0	0	113.7
37	H	52.1	Low	55.5	Low	132 Å²	132	93.6 Å²	93.6	61%	0.611	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	-16.9	-177.2	-59.8	-64.5	0	0	0	113.9	D35 M93	D35-H37 PolarHBondContact O-N 2.87Å; D35-H37 WeakPolarHBondContact OD1-CA 3.44Å; D35-H37 PolarHBondContact OD1-N 2.82Å; H37-M93 VanDerWaalsContact CD2-CE 3.48Å; H37-M93 WeakPolarHBondContact CD2-CE 3.39Å; H37-M93 VanDerWaalsContact NE2-CE 3.34Å; H37-M93 WeakPolarHBondContact NE2-CE 3.48Å
38	N	50.8	Low	54.6	Low	86 Å²	86	99.6 Å²	99.6	46%	0.46	49%	0.485	S	S	.	.	B	Isolated β-bridge	trans	-137.5	71.1	-170.1	-138.3	9.3	0	0	0	111.2	D35 F40	D35-N38 PolarHBondContact O-N 2.95Å; D35-N38 VanDerWaalsContact OD1-CB 3.3Å; D35-N38 WeakPolarHBondContact OD1-CB 3.43Å; D35-N38 PolarHBondContact OD1-N 3.18Å; N38-F40 HydrophobicContact CB-CE2 4.2Å; N38-F40 WeakPolarHBondContact ND2-CZ 3.46Å; N38-F40 VanDerWaalsContact O-CD2 3.28Å; N38-F40 WeakPolarHBondContact O-CD2 3.19Å; N38-F40 PolarHBondContact O-N 2.68Å
39	K	57.3	Low	53.4	Low	104 Å²	104	101.1 Å²	101.1	45%	0.452	50%	0.495	S	S	.	.			trans	-66.8	95.6	171.5	-68.2	-172.6	178.7	-126.7	0	110.9	D34 Y41 G67	D34-K39 VanDerWaalsContact OD1-CA 3.23Å; D34-K39 WeakPolarHBondContact OD1-CA 3.34Å; D34-K39 WeakPolarHBondContact OD1-CG 3.46Å; K39-Y41 HydrophobicContact CB-CE2 4.11Å; K39-Y41 PolarHBondContact O-N 2.82Å; K39-G67 PolarHBondContact NZ-O 3.42Å
40	F	55.3	Low	51.8	Low	93 Å²	93	104.4 Å²	104.4	41%	0.408	51%	0.513	S	S	.	.			trans	-75.1	104.6	169.8	-66.5	-80.1	0	0	0	109.4	N38 Y42	N38-F40 HydrophobicContact CB-CE2 4.2Å; N38-F40 WeakPolarHBondContact ND2-CZ 3.46Å; N38-F40 VanDerWaalsContact O-CD2 3.28Å; N38-F40 WeakPolarHBondContact O-CD2 3.19Å; N38-F40 PolarHBondContact O-N 2.68Å; F40-Y42 HydrophobicContact CB-CD2 3.89Å; F40-Y42 HydrophobicContact CB-CE2 3.19Å; F40-Y42 HydrophobicContact CG-CE2 4.09Å; F40-Y42 VanDerWaalsContact O-CD2 3.32Å; F40-Y42 WeakPolarHBondContact O-CD2 3.31Å; F40-Y42 PolarHBondContact O-N 2.88Å
41	Y	55.5	Low	50.5	Low	197 Å²	197	110.9 Å²	110.9	77%	0.773	54%	0.541	S	S	*	.			trans	-76.7	106.1	169	-72.5	-88.6	0	0	0	109.1	K39	K39-Y41 HydrophobicContact CB-CE2 4.11Å; K39-Y41 PolarHBondContact O-N 2.82Å
42	Y	53.2	Low	49	Very low	103 Å²	103	113.1 Å²	113.1	40%	0.404	56%	0.556	S	S	.	*			trans	-96.9	121.6	171.1	-63.7	-85	0	0	0	109.5	L30 F40 I44	L30-Y42 HydrophobicContact CB-CD2 4.24Å; L30-Y42 HydrophobicContact CB-CE2 4.1Å; L30-Y42 HydrophobicContact CD1-CD1 4.22Å; L30-Y42 HydrophobicContact CD1-CD2 3.38Å; L30-Y42 HydrophobicContact CD1-CE2 3.77Å; L30-Y42 HydrophobicContact CD1-CG 3.61Å; L30-Y42 HydrophobicContact CD2-CD1 4.48Å; L30-Y42 HydrophobicContact CD2-CD2 3.87Å; L30-Y42 HydrophobicContact CD2-CE1 4.01Å; L30-Y42 HydrophobicContact CD2-CE2 3.28Å; L30-Y42 HydrophobicContact CD2-CG 4.41Å; L30-Y42 HydrophobicContact CG-CD2 3.99Å; L30-Y42 HydrophobicContact CG-CE2 3.86Å; F40-Y42 HydrophobicContact CB-CD2 3.89Å; F40-Y42 HydrophobicContact CB-CE2 3.19Å; F40-Y42 HydrophobicContact CG-CE2 4.09Å; F40-Y42 VanDerWaalsContact O-CD2 3.32Å; F40-Y42 WeakPolarHBondContact O-CD2 3.31Å; F40-Y42 PolarHBondContact O-N 2.88Å; Y42-I44 PolarHBondContact O-N 3.42Å; Y42-I44 VanDerWaalsContact O-N 3.14Å
43	D	49.9	Very low	47.5	Very low	121 Å²	121	118.6 Å²	118.6	65%	0.647	58%	0.581	S	S	*	*			trans	-72.3	102.1	167.3	-173.3	1.8	0	0	0	109	S45	D43-S45 WeakPolarHBondContact OD1-CB 3.27Å; D43-S45 PolarHBondContact OD1-N 3.3Å; D43-S45 PolarHBondContact OD1-OG 3.02Å
44	I	53.4	Low	46.1	Very low	89 Å²	89	124.1 Å²	124.1	46%	0.456	61%	0.605	S	S	.	*			trans	-95.2	10.1	172.8	57	168.8	0	0	0	112.2	Y42 E46 S47	Y42-I44 PolarHBondContact O-N 3.42Å; Y42-I44 VanDerWaalsContact O-N 3.14Å; I44-E46 PolarHBondContact O-N 3.08Å; I44-S47 PolarHBondContact O-N 3.36Å; I44-S47 VanDerWaalsContact O-N 3.1Å; I44-S47 PolarHBondContact O-OG 3.21Å
45	S	51.7	Low	45.1	Very low	76 Å²	76	128.2 Å²	128.2	53%	0.531	63%	0.626	S	S	.	*	G	3₁₀ helix	trans	-61.1	-26.8	177.7	-45.6	0	0	0	0	112.5	D43 Y48	D43-S45 WeakPolarHBondContact OD1-CB 3.27Å; D43-S45 PolarHBondContact OD1-N 3.3Å; D43-S45 PolarHBondContact OD1-OG 3.02Å; S45-Y48 WeakPolarHBondContact O-CD2 3.47Å
46	E	41.8	Very low	44.1	Very low	188 Å²	188	131.1 Å²	131.1	88%	0.879	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-82.9	-11	178.5	-67.9	-162.2	167	0	0	113.9	I44	I44-E46 PolarHBondContact O-N 3.08Å
47	S	42.7	Very low	42.7	Very low	56 Å²	56	128.9 Å²	128.9	39%	0.392	65%	0.646	S	S	.	*	G	3₁₀ helix	trans	-98.2	20.6	178.7	68.7	0	0	0	0	114.3	I44 L49	I44-S47 PolarHBondContact O-N 3.36Å; I44-S47 VanDerWaalsContact O-N 3.1Å; I44-S47 PolarHBondContact O-OG 3.21Å; S47-L49 PolarHBondContact O-N 3.25Å
48	Y	41.7	Very low	41.6	Very low	191 Å²	191	129.7 Å²	129.7	75%	0.749	66%	0.655	S	S	*	*			trans	-64.2	78.5	168.6	-90.1	-93.1	0	0	0	111	S45 D50	S45-Y48 WeakPolarHBondContact O-CD2 3.47Å; Y48-D50 PolarHBondContact O-N 3.17Å
49	L	37.2	Very low	40.7	Very low	112 Å²	112	133.2 Å²	133.2	59%	0.586	67%	0.674	S	S	*	*			trans	-68.3	109.1	145.1	-81.9	164.2	0	0	0	106.4	S47 F51	S47-L49 PolarHBondContact O-N 3.25Å; L49-F51 PolarHBondContact O-N 3.03Å
50	D	32.2	Very low	39.3	Very low	143 Å²	143	130.8 Å²	130.8	77%	0.765	68%	0.678	S	S	*	*	S	Bend	trans	-38.3	88.5	-180	-161.1	13.7	0	0	0	113.1	Y48	Y48-D50 PolarHBondContact O-N 3.17Å
51	F	35.2	Very low	38	Very low	157 Å²	157	134.7 Å²	134.7	69%	0.689	70%	0.703	S	S	*	*			trans	-131.5	102.9	166.2	-82.1	-78.1	0	0	0	108.4	L49 H53	L49-F51 PolarHBondContact O-N 3.03Å; F51-H53 PolarHBondContact O-N 3.48Å
52	S	30.1	Very low	36.8	Very low	121 Å²	121	128.9 Å²	128.9	85%	0.846	70%	0.703	S	S	*	*			trans	-58	97	170.3	-48.8	0	0	0	0	109.5
53	H	32.6	Very low	35.8	Very low	164 Å²	164	128.7 Å²	128.7	76%	0.759	72%	0.717	S	S	*	*			trans	-106.6	102.9	165.5	-145	-62.1	0	0	0	107.6	F51 L55	F51-H53 PolarHBondContact O-N 3.48Å; H53-L55 PolarHBondContact O-N 3.32Å
54	E	28	Very low	34.8	Very low	180 Å²	180	128.5 Å²	128.5	84%	0.841	72%	0.716	S	S	*	*			trans	-50.7	112.6	162	-74.2	-179.9	148.1	0	0	107.4	P56	E54-P56 WeakPolarHBondContact O-CD 3.22Å
55	L	34.9	Very low	33.8	Very low	156 Å²	156	128.5 Å²	128.5	82%	0.817	72%	0.72	S	S	*	*			trans	-66.1	121.4	164.9	-112	89.6	0	0	0	106.7	H53 T57	H53-L55 PolarHBondContact O-N 3.32Å; L55-T57 PolarHBondContact O-N 2.96Å
56	P	31.9	Very low	33	Very low	113 Å²	113	131.9 Å²	131.9	73%	0.734	73%	0.732	S	S	*	*			trans	-66.8	111.9	171.1	25.1	-29.2	0	0	0	108.6	E54 N58	E54-P56 WeakPolarHBondContact O-CD 3.22Å; P56-N58 VanDerWaalsContact C-N 3.31Å; P56-N58 PolarHBondContact O-N 2.8Å
57	T	29.1	Very low	32.6	Very low	124 Å²	124	125 Å²	125	76%	0.761	71%	0.712	S	S	*	*			trans	-62.5	91.2	168	31.2	0	0	0	0	108.7	L55 N59	L55-T57 PolarHBondContact O-N 2.96Å; T57-N59 VanDerWaalsContact C-N 3.27Å; T57-N59 PolarHBondContact O-N 3.36Å
58	N	30.1	Very low	32	Very low	149 Å²	149	128 Å²	128	80%	0.797	72%	0.723	S	S	*	*			trans	-77.6	84.3	172.6	-159.3	7.9	0	0	0	108.6	P56 G60	P56-N58 VanDerWaalsContact C-N 3.31Å; P56-N58 PolarHBondContact O-N 2.8Å; N58-G60 PolarHBondContact O-N 2.97Å
59	N	31.9	Very low	31.7	Very low	161 Å²	161	127.5 Å²	127.5	86%	0.861	73%	0.725	S	S	*	*			trans	-70.1	78.2	162.9	-72.5	-17.3	0	0	0	107.9	T57	T57-N59 VanDerWaalsContact C-N 3.27Å; T57-N59 PolarHBondContact O-N 3.36Å
60	G	27.3	Very low	31.4	Very low	53 Å²	53	129.7 Å²	129.7	55%	0.546	73%	0.732	S	S	.	*			trans	-129.8	99.6	-177.7	0	0	0	0	0	110.3	N58 G62	N58-G60 PolarHBondContact O-N 2.97Å; G60-G62 PolarHBondContact O-N 3.25Å
61	D	27.5	Very low	31.7	Very low	174 Å²	174	128.2 Å²	128.2	93%	0.93	73%	0.728	S	S	*	*			trans	-32.2	120.5	171.5	-149.8	1.4	0	0	0	114.5
62	G	31.7	Very low	31.4	Very low	75 Å²	75	127.7 Å²	127.7	77%	0.773	73%	0.727	S	S	*	*			trans	60	87.3	155.1	0	0	0	0	0	119.2	G60	G60-G62 PolarHBondContact O-N 3.25Å
63	S	30.2	Very low	31.6	Very low	99 Å²	99	130 Å²	130	69%	0.692	73%	0.725	S	S	*	*			trans	-155.2	120.8	144.7	-159.4	0	0	0	0	110.8	T65	S63-T65 PolarHBondContact O-N 2.98Å; S63-T65 VanDerWaalsContact O-N 3.17Å
64	N	29.4	Very low	31.5	Very low	117 Å²	117	126.2 Å²	126.2	63%	0.626	71%	0.714	S	S	*	*			trans	-7.4	99.2	163.8	63	-15.3	0	0	0	116.5	N66	N64-N66 VanDerWaalsContact C-N 3.26Å; N64-N66 PolarHBondContact O-N 3.47Å
65	T	32.6	Very low	31.6	Very low	90 Å²	90	123.3 Å²	123.3	55%	0.552	71%	0.712	S	S	*	*			trans	-69.4	90.4	159.4	53.4	0	0	0	0	108.2	S63 G67 I68	S63-T65 PolarHBondContact O-N 2.98Å; S63-T65 VanDerWaalsContact O-N 3.17Å; T65-G67 VanDerWaalsContact C-N 3.27Å; T65-G67 PolarHBondContact O-N 3.48Å; T65-I68 HydrophobicContact CG2-CB 4.19Å; T65-I68 HydrophobicContact CG2-CD1 3.86Å; T65-I68 HydrophobicContact CG2-CG1 4.29Å
66	N	34.8	Very low	31.4	Very low	146 Å²	146	124 Å²	124	78%	0.781	71%	0.708	S	S	*	*	S	Bend	trans	-58.6	95.8	165.8	-78.8	-7.3	0	0	0	107.7	N64	N64-N66 VanDerWaalsContact C-N 3.26Å; N64-N66 PolarHBondContact O-N 3.47Å
67	G	34.6	Very low	32	Very low	45 Å²	45	126.4 Å²	126.4	46%	0.464	72%	0.715	S	S	.	*	S	Bend	trans	83.5	9.5	167.8	0	0	0	0	0	117.9	K39 T65 F69	K39-G67 PolarHBondContact NZ-O 3.42Å; T65-G67 VanDerWaalsContact C-N 3.27Å; T65-G67 PolarHBondContact O-N 3.48Å; G67-F69 PolarHBondContact O-N 2.95Å
68	I	29.8	Very low	32.4	Very low	118 Å²	118	127 Å²	127	61%	0.605	71%	0.713	S	S	*	*			trans	-78.3	100.8	159.8	-52.4	178.3	0	0	0	105.4	T65 E70	T65-I68 HydrophobicContact CG2-CB 4.19Å; T65-I68 HydrophobicContact CG2-CD1 3.86Å; T65-I68 HydrophobicContact CG2-CG1 4.29Å; I68-E70 PolarHBondContact O-N 3.5Å; I68-E70 VanDerWaalsContact O-N 3.07Å
69	F	33.9	Very low	33	Very low	181 Å²	181	123.8 Å²	123.8	79%	0.794	72%	0.716	S	S	*	*			trans	-61.6	112	157.2	-107.9	-92.4	0	0	0	105.1	G67 V71	G67-F69 PolarHBondContact O-N 2.95Å; F69-V71 PolarHBondContact O-N 2.93Å
70	E	32.7	Very low	33.3	Very low	158 Å²	158	122 Å²	122	74%	0.738	71%	0.711	S	S	*	*			trans	-54.2	99.3	165	-166.6	178.8	-146.8	0	0	105.4	I68 Q72	I68-E70 PolarHBondContact O-N 3.5Å; I68-E70 VanDerWaalsContact O-N 3.07Å; E70-Q72 PolarHBondContact O-N 3.42Å
71	V	37.9	Very low	34	Very low	111 Å²	111	124.2 Å²	124.2	67%	0.673	72%	0.724	S	S	*	*			trans	-66	93.8	169.1	179.1	0	0	0	0	103.6	F69 E73	F69-V71 PolarHBondContact O-N 2.93Å; V71-E73 HydrophobicContact CG1-CG 3.83Å; V71-E73 PolarHBondContact O-N 3.39Å
72	Q	28.9	Very low	34.2	Very low	146 Å²	146	124 Å²	124	68%	0.682	72%	0.717	S	S	*	*			trans	-63.4	88.6	158.3	-112.1	171.1	51.8	0	0	104.7	E70 T74	E70-Q72 PolarHBondContact O-N 3.42Å; Q72-T74 PolarHBondContact O-N 3.32Å
73	E	34.6	Very low	34.6	Very low	169 Å²	169	127.6 Å²	127.6	79%	0.79	72%	0.717	S	S	*	*			trans	-62.1	80.2	157.5	-73.4	-171.3	162.1	0	0	105.9	V71 C75	V71-E73 HydrophobicContact CG1-CG 3.83Å; V71-E73 PolarHBondContact O-N 3.39Å; E73-C75 PolarHBondContact O-N 2.97Å
74	T	29.7	Very low	34.6	Very low	86 Å²	86	130.3 Å²	130.3	53%	0.528	72%	0.719	S	S	.	*			trans	-66.5	92.7	154.5	47.1	0	0	0	0	104.9	Q72 F76	Q72-T74 PolarHBondContact O-N 3.32Å; T74-F76 HydrophobicContact CG2-CE2 4.34Å; T74-F76 WeakPolarHBondContact O-CD2 3.5Å; T74-F76 PolarHBondContact O-N 3.43Å; T74-F76 WeakPolarHBondContact OG1-CE2 3.18Å
75	C	29.5	Very low	35.1	Very low	119 Å²	119	129.8 Å²	129.8	80%	0.804	72%	0.72	S	S	*	*			trans	-57.9	87.7	167.4	-167.9	0	0	0	0	107	E73	E73-C75 PolarHBondContact O-N 2.97Å
76	F	31.7	Very low	35.4	Very low	170 Å²	170	132.2 Å²	132.2	75%	0.746	73%	0.73	S	S	*	*			trans	-82.9	112.8	162.1	-72.9	-73.7	0	0	0	105.6	T74 D78	T74-F76 HydrophobicContact CG2-CE2 4.34Å; T74-F76 WeakPolarHBondContact O-CD2 3.5Å; T74-F76 PolarHBondContact O-N 3.43Å; T74-F76 WeakPolarHBondContact OG1-CE2 3.18Å; F76-D78 PolarHBondContact O-N 2.64Å
77	D	44.7	Very low	35.7	Very low	163 Å²	163	131.5 Å²	131.5	87%	0.872	73%	0.726	S	S	*	*	S	Bend	trans	-66.7	39.5	-179.4	-168.2	26.3	0	0	0	113
78	D	37.3	Very low	36	Very low	136 Å²	136	132 Å²	132	73%	0.727	73%	0.731	S	S	*	*	S	Bend	trans	-150.7	71.3	170.3	-158.8	17.8	0	0	0	111.3	F76 T80	F76-D78 PolarHBondContact O-N 2.64Å; D78-T80 VanDerWaalsContact C-N 3.26Å; D78-T80 PolarHBondContact O-N 2.84Å; D78-T80 PolarHBondContact O-OG1 3.26Å
79	G	42.6	Very low	36.7	Very low	82 Å²	82	134 Å²	134	85%	0.845	74%	0.742	S	S	*	*	S	Bend	trans	54.8	-0.5	141.8	0	0	0	0	0	122.4
80	T	38.1	Very low	37.4	Very low	124 Å²	124	130.8 Å²	130.8	76%	0.761	74%	0.738	S	S	*	*			trans	-144.8	79.9	-173.9	15.5	0	0	0	0	111	D78 E82	D78-T80 VanDerWaalsContact C-N 3.26Å; D78-T80 PolarHBondContact O-N 2.84Å; D78-T80 PolarHBondContact O-OG1 3.26Å; T80-E82 PolarHBondContact O-N 3.07Å; T80-E82 VanDerWaalsContact O-N 3.16Å
81	A	41.2	Very low	38.4	Very low	99 Å²	99	130.9 Å²	130.9	82%	0.818	74%	0.738	S	S	*	*			trans	-75.8	96.4	169	0	0	0	0	0	109.2	I83	A81-I83 PolarHBondContact O-N 3.1Å
82	E	32	Very low	39.5	Very low	170 Å²	170	134.4 Å²	134.4	79%	0.794	75%	0.748	S	S	*	*			trans	-69.8	107.7	163	-76.7	-173.7	173.8	0	0	108.3	T80 Q84	T80-E82 PolarHBondContact O-N 3.07Å; T80-E82 VanDerWaalsContact O-N 3.16Å; E82-Q84 PolarHBondContact O-N 3.38Å
83	I	40.1	Very low	41.4	Very low	150 Å²	150	130 Å²	130	77%	0.769	73%	0.728	S	S	*	*			trans	-65.5	98.7	174.2	-58.5	172.9	0	0	0	107.6	A81 V85	A81-I83 PolarHBondContact O-N 3.1Å; I83-V85 HydrophobicContact CG2-CG2 3.99Å; I83-V85 PolarHBondContact O-N 2.74Å; I83-V85 VanDerWaalsContact O-N 3.12Å
84	Q	30.1	Very low	43.1	Very low	157 Å²	157	125.5 Å²	125.5	73%	0.734	71%	0.712	S	S	*	*			trans	-76.9	95.8	167.3	-72.5	-169.1	34.9	0	0	108.5	E82 N86	E82-Q84 PolarHBondContact O-N 3.38Å; Q84-N86 VanDerWaalsContact C-N 3.34Å; Q84-N86 PolarHBondContact O-N 2.89Å
85	V	41.3	Very low	45.3	Very low	106 Å²	106	127.6 Å²	127.6	64%	0.642	72%	0.718	S	S	*	*			trans	-68.7	98.3	165.2	-172.1	0	0	0	0	106.5	I83 N87	I83-V85 HydrophobicContact CG2-CG2 3.99Å; I83-V85 PolarHBondContact O-N 2.74Å; I83-V85 VanDerWaalsContact O-N 3.12Å; V85-N87 VanDerWaalsContact C-N 3.31Å; V85-N87 PolarHBondContact O-N 2.84Å
86	N	37.6	Very low	47.3	Very low	141 Å²	141	125 Å²	125	75%	0.754	71%	0.705	S	S	*	*			trans	-61.8	100.2	166.1	-81.8	-29.7	0	0	0	106.8	Q84 G88	Q84-N86 VanDerWaalsContact C-N 3.34Å; Q84-N86 PolarHBondContact O-N 2.89Å; N86-G88 PolarHBondContact O-N 3.3Å
87	N	40.6	Very low	49.2	Very low	131 Å²	131	121.4 Å²	121.4	70%	0.701	69%	0.691	S	S	*	*			trans	-68.3	65.8	169.7	-73.9	-4.8	0	0	0	108.8	V85 N89	V85-N87 VanDerWaalsContact C-N 3.31Å; V85-N87 PolarHBondContact O-N 2.84Å; N87-N89 PolarHBondContact O-N 2.83Å; N87-N89 VanDerWaalsContact O-N 3.12Å
88	G	41.8	Very low	50.6	Low	55 Å²	55	118.3 Å²	118.3	57%	0.567	67%	0.674	S	S	*	*			trans	-65.7	108.9	168.8	0	0	0	0	0	107.4	N86 T90	N86-G88 PolarHBondContact O-N 3.3Å; G88-T90 VanDerWaalsContact C-N 3.32Å; G88-T90 PolarHBondContact O-N 3.17Å
89	N	44.1	Very low	52.5	Low	159 Å²	159	117.2 Å²	117.2	85%	0.85	66%	0.664	S	S	*	*			trans	31.7	61.1	157.8	-47.8	12.5	0	0	0	113.2	N87 E91	N87-N89 PolarHBondContact O-N 2.83Å; N87-N89 VanDerWaalsContact O-N 3.12Å; N89-E91 VanDerWaalsContact C-N 3.31Å; N89-E91 PolarHBondContact O-N 2.75Å
90	T	48.2	Very low	54.2	Low	114 Å²	114	120.5 Å²	120.5	70%	0.699	65%	0.651	S	S	*	*			trans	-62.7	101.5	171	-24.3	0	0	0	0	105.8	G88 E92	G88-T90 VanDerWaalsContact C-N 3.32Å; G88-T90 PolarHBondContact O-N 3.17Å; T90-E92 PolarHBondContact O-N 3.31Å
91	E	55.1	Low	56	Low	161 Å²	161	116.4 Å²	116.4	75%	0.752	63%	0.628	S	S	*	*			trans	-55	113.3	171.6	-150.9	171.8	-164.2	0	0	105.5	N89 M93	N89-E91 VanDerWaalsContact C-N 3.31Å; N89-E91 PolarHBondContact O-N 2.75Å; E91-M93 PolarHBondContact O-N 2.96Å
92	E	60.6	Low	57.7	Low	185 Å²	185	117.2 Å²	117.2	86%	0.864	62%	0.617	S	S	*	*			trans	-61.9	107.7	-173.6	-73.4	-174.8	177.8	0	0	107.8	T90 T94	T90-E92 PolarHBondContact O-N 3.31Å; E92-T94 PolarHBondContact O-N 2.81Å
93	M	68.7	Low	59.8	Low	54 Å²	54	115.1 Å²	115.1	27%	0.266	61%	0.608	S	S	.	*			trans	-59	126.4	177.7	-172.4	178.3	-74.8	0	0	108.6	H37 E91 E97 L98	H37-M93 VanDerWaalsContact CD2-CE 3.48Å; H37-M93 WeakPolarHBondContact CD2-CE 3.39Å; H37-M93 VanDerWaalsContact NE2-CE 3.34Å; H37-M93 WeakPolarHBondContact NE2-CE 3.48Å; E91-M93 PolarHBondContact O-N 2.96Å; M93-E97 HydrophobicContact CG-CB 3.31Å; M93-E97 HydrophobicContact CG-CG 4.42Å; M93-E97 HydrophobicContact SD-CB 3.88Å; M93-L98 HydrophobicContact CB-CD2 4.37Å; M93-L98 HydrophobicContact CB-CG 4.14Å; M93-L98 HydrophobicContact CG-CD2 4.18Å; M93-L98 HydrophobicContact CG-CG 3.83Å; M93-L98 HydrophobicContact SD-CB 4.29Å; M93-L98 HydrophobicContact SD-CD2 3.46Å; M93-L98 WeakPolarHBondContact SD-CD2 3.42Å; M93-L98 HydrophobicContact SD-CG 3.64Å
94	T	70.8	Confident	61.8	Low	73 Å²	73	111.9 Å²	111.9	45%	0.448	59%	0.591	S	S	.	*			trans	-65.4	154.2	179.2	64.3	0	0	0	0	110.1	E92 A96 E97 L98	E92-T94 PolarHBondContact O-N 2.81Å; T94-A96 PolarHBondContact O-N 3.44Å; T94-A96 VanDerWaalsContact O-N 3.13Å; T94-E97 WeakPolarHBondContact CB-OE2 3.42Å; T94-E97 WeakPolarHBondContact CG2-OE2 3.4Å; T94-E97 PolarHBondContact N-OE2 2.81Å; T94-E97 PolarHBondContact O-N 3.3Å; T94-E97 VanDerWaalsContact OG1-CD 3.23Å; T94-E97 VanDerWaalsContact OG1-CG 3.29Å; T94-E97 WeakPolarHBondContact OG1-CG 3.24Å; T94-E97 PolarHBondContact OG1-N 2.8Å; T94-E97 PolarHBondContact OG1-OE2 2.72Å; T94-L98 PolarHBondContact O-N 3.45Å
95	I	74.8	Confident	64.2	Low	130 Å²	130	106.4 Å²	106.4	67%	0.667	57%	0.57	S	S	*	*	H	α-helix	trans	-52.5	-38.7	176.1	-64.4	172.1	0	0	0	110.9	L98 E99	I95-L98 PolarHBondContact O-N 2.86Å; I95-E99 HydrophobicContact CG2-CG 4.33Å; I95-E99 WeakPolarHBondContact O-CB 3.43Å; I95-E99 VanDerWaalsContact O-CG 3.3Å; I95-E99 WeakPolarHBondContact O-CG 3.45Å; I95-E99 PolarHBondContact O-N 3.34Å
96	A	72.1	Confident	66.1	Low	65 Å²	65	105.2 Å²	105.2	54%	0.537	56%	0.558	S	S	.	*	H	α-helix	trans	-66.4	-36.6	178.7	0	0	0	0	0	113.1	T94 R100	T94-A96 PolarHBondContact O-N 3.44Å; T94-A96 VanDerWaalsContact O-N 3.13Å; A96-R100 VanDerWaalsContact O-CB 3.28Å; A96-R100 WeakPolarHBondContact O-CB 3.47Å; A96-R100 PolarHBondContact O-N 2.95Å
97	E	72	Confident	68.2	Low	95 Å²	95	101.8 Å²	101.8	44%	0.444	55%	0.545	S	S	.	.	H	α-helix	trans	-71.7	-40.2	175.7	-73.7	161.6	149.8	0	0	111.5	M93 T94 R100 S101	M93-E97 HydrophobicContact CG-CB 3.31Å; M93-E97 HydrophobicContact CG-CG 4.42Å; M93-E97 HydrophobicContact SD-CB 3.88Å; T94-E97 WeakPolarHBondContact CB-OE2 3.42Å; T94-E97 WeakPolarHBondContact CG2-OE2 3.4Å; T94-E97 PolarHBondContact N-OE2 2.81Å; T94-E97 PolarHBondContact O-N 3.3Å; T94-E97 VanDerWaalsContact OG1-CD 3.23Å; T94-E97 VanDerWaalsContact OG1-CG 3.29Å; T94-E97 WeakPolarHBondContact OG1-CG 3.24Å; T94-E97 PolarHBondContact OG1-N 2.8Å; T94-E97 PolarHBondContact OG1-OE2 2.72Å; E97-R100 PolarHBondContact O-N 2.68Å; E97-S101 WeakPolarHBondContact O-CB 3.34Å; E97-S101 PolarHBondContact O-N 3.42Å
98	L	74.6	Confident	70.2	Confident	97 Å²	97	100.6 Å²	100.6	51%	0.508	53%	0.531	S	S	.	.	H	α-helix	trans	-61.7	-47	173.4	-76.2	169.4	0	0	0	111.4	M93 T94 I95 R100 S101 L102	M93-L98 HydrophobicContact CB-CD2 4.37Å; M93-L98 HydrophobicContact CB-CG 4.14Å; M93-L98 HydrophobicContact CG-CD2 4.18Å; M93-L98 HydrophobicContact CG-CG 3.83Å; M93-L98 HydrophobicContact SD-CB 4.29Å; M93-L98 HydrophobicContact SD-CD2 3.46Å; M93-L98 WeakPolarHBondContact SD-CD2 3.42Å; M93-L98 HydrophobicContact SD-CG 3.64Å; T94-L98 PolarHBondContact O-N 3.45Å; I95-L98 PolarHBondContact O-N 2.86Å; L98-R100 VanDerWaalsContact C-N 3.29Å; L98-R100 PolarHBondContact O-N 2.84Å; L98-S101 PolarHBondContact O-N 2.81Å; L98-L102 VanDerWaalsContact O-CB 3.31Å; L98-L102 WeakPolarHBondContact O-CB 3.43Å; L98-L102 PolarHBondContact O-N 2.87Å
99	E	75.2	Confident	72.2	Confident	113 Å²	113	102.6 Å²	102.6	53%	0.528	53%	0.527	S	S	.	.	H	α-helix	trans	-60.3	-41	176.2	-76.9	178.4	166.2	0	0	111.6	I95 L102 Q103	I95-E99 HydrophobicContact CG2-CG 4.33Å; I95-E99 WeakPolarHBondContact O-CB 3.43Å; I95-E99 VanDerWaalsContact O-CG 3.3Å; I95-E99 WeakPolarHBondContact O-CG 3.45Å; I95-E99 PolarHBondContact O-N 3.34Å; E99-L102 PolarHBondContact O-N 2.87Å; E99-Q103 WeakPolarHBondContact O-CB 3.47Å; E99-Q103 VanDerWaalsContact O-CG 3.23Å; E99-Q103 WeakPolarHBondContact O-CG 3.44Å; E99-Q103 PolarHBondContact O-N 2.82Å
100	R	79.9	Confident	74.1	Confident	152 Å²	152	102.3 Å²	102.3	57%	0.574	51%	0.514	S	S	*	.	H	α-helix	trans	-65.9	-45.3	176.4	-169.7	-174.4	-143.8	168.1	6.2	111.8	A96 E97 L98 L102 Q103 I104	A96-R100 VanDerWaalsContact O-CB 3.28Å; A96-R100 WeakPolarHBondContact O-CB 3.47Å; A96-R100 PolarHBondContact O-N 2.95Å; E97-R100 PolarHBondContact O-N 2.68Å; L98-R100 VanDerWaalsContact C-N 3.29Å; L98-R100 PolarHBondContact O-N 2.84Å; R100-L102 VanDerWaalsContact C-N 3.31Å; R100-L102 PolarHBondContact O-N 3.18Å; R100-Q103 PolarHBondContact O-N 3.35Å; R100-I104 HydrophobicContact CG-CD1 4.05Å; R100-I104 VanDerWaalsContact O-CG1 3.25Å; R100-I104 WeakPolarHBondContact O-CG1 3.4Å; R100-I104 PolarHBondContact O-N 2.87Å
101	S	74.4	Confident	75.8	Confident	38 Å²	38	100.3 Å²	100.3	27%	0.266	50%	0.502	S	S	.	.	H	α-helix	trans	-60.4	-44.3	177.1	-175.3	0	0	0	0	110.7	E97 L98 Q103 I104 S105	E97-S101 WeakPolarHBondContact O-CB 3.34Å; E97-S101 PolarHBondContact O-N 3.42Å; L98-S101 PolarHBondContact O-N 2.81Å; S101-Q103 PolarHBondContact O-N 3.06Å; S101-I104 PolarHBondContact O-N 3.11Å; S101-S105 PolarHBondContact O-N 2.83Å; S101-S105 PolarHBondContact O-OG 3.34Å
102	L	78.3	Confident	77.2	Confident	115 Å²	115	93.9 Å²	93.9	60%	0.602	47%	0.473	S	S	*	.	H	α-helix	trans	-62	-43.2	175.5	-177	62.5	0	0	0	112.5	L98 E99 R100 I104 S105 E106	L98-L102 VanDerWaalsContact O-CB 3.31Å; L98-L102 WeakPolarHBondContact O-CB 3.43Å; L98-L102 PolarHBondContact O-N 2.87Å; E99-L102 PolarHBondContact O-N 2.87Å; R100-L102 VanDerWaalsContact C-N 3.31Å; R100-L102 PolarHBondContact O-N 3.18Å; L102-I104 VanDerWaalsContact C-N 3.32Å; L102-I104 PolarHBondContact O-N 3.47Å; L102-S105 WeakPolarHBondContact CA-OG 3.48Å; L102-S105 PolarHBondContact O-N 3.37Å; L102-S105 PolarHBondContact O-OG 3.04Å; L102-E106 VanDerWaalsContact O-CB 3.28Å; L102-E106 WeakPolarHBondContact O-CB 3.28Å; L102-E106 PolarHBondContact O-N 3.46Å
103	Q	76.6	Confident	78.4	Confident	127 Å²	127	90 Å²	90	59%	0.593	46%	0.458	S	S	*	.	H	α-helix	trans	-62.8	-39.6	175.8	-76.2	171.6	2.5	0	0	112	E99 R100 S101 S107	E99-Q103 WeakPolarHBondContact O-CB 3.47Å; E99-Q103 VanDerWaalsContact O-CG 3.23Å; E99-Q103 WeakPolarHBondContact O-CG 3.44Å; E99-Q103 PolarHBondContact O-N 2.82Å; R100-Q103 PolarHBondContact O-N 3.35Å; S101-Q103 PolarHBondContact O-N 3.06Å; Q103-S107 WeakPolarHBondContact O-CB 3.49Å; Q103-S107 PolarHBondContact O-N 3.49Å
104	I	81.1	Confident	79.1	Confident	82 Å²	82	91.5 Å²	91.5	42%	0.421	47%	0.467	S	S	.	.	H	α-helix	trans	-66.7	-48	177.4	-68.6	164.6	0	0	0	110.2	R100 S101 L102 S107 R108	R100-I104 HydrophobicContact CG-CD1 4.05Å; R100-I104 VanDerWaalsContact O-CG1 3.25Å; R100-I104 WeakPolarHBondContact O-CG1 3.4Å; R100-I104 PolarHBondContact O-N 2.87Å; S101-I104 PolarHBondContact O-N 3.11Å; L102-I104 VanDerWaalsContact C-N 3.32Å; L102-I104 PolarHBondContact O-N 3.47Å; I104-S107 PolarHBondContact O-N 2.97Å; I104-R108 WeakPolarHBondContact O-CG 3.36Å; I104-R108 PolarHBondContact O-N 3.11Å
105	S	80.4	Confident	79.7	Confident	42 Å²	42	89.3 Å²	89.3	29%	0.294	45%	0.452	S	S	.	.	H	α-helix	trans	-64.8	-41.1	179.9	65.7	0	0	0	0	111.6	S101 L102 S107 R108 L109	S101-S105 PolarHBondContact O-N 2.83Å; S101-S105 PolarHBondContact O-OG 3.34Å; L102-S105 WeakPolarHBondContact CA-OG 3.48Å; L102-S105 PolarHBondContact O-N 3.37Å; L102-S105 PolarHBondContact O-OG 3.04Å; S105-S107 PolarHBondContact O-N 2.67Å; S105-R108 PolarHBondContact O-N 3.04Å; S105-L109 WeakPolarHBondContact O-CB 3.03Å; S105-L109 WeakPolarHBondContact O-CG 3.45Å; S105-L109 PolarHBondContact O-N 3.34Å
106	E	80.4	Confident	80	Confident	81 Å²	81	87.3 Å²	87.3	38%	0.379	44%	0.442	S	S	.	.	H	α-helix	trans	-61.7	-44.2	173.8	-172.8	-175	-165.2	0	0	111.8	L102 R108 L109 R110	L102-E106 VanDerWaalsContact O-CB 3.28Å; L102-E106 WeakPolarHBondContact O-CB 3.28Å; L102-E106 PolarHBondContact O-N 3.46Å; E106-R108 VanDerWaalsContact C-N 3.34Å; E106-R108 PolarHBondContact O-N 3.37Å; E106-L109 PolarHBondContact O-N 3.29Å; E106-R110 VanDerWaalsContact CD-CZ 3.5Å; E106-R110 WeakPolarHBondContact O-CB 3.38Å; E106-R110 WeakPolarHBondContact O-CG 3.34Å; E106-R110 PolarHBondContact O-N 2.99Å; E106-R110 IonicContact OE1-CZ 3.65Å; E106-R110 IonicContact OE1-NE 2.98Å; E106-R110 IonicContact OE1-NH1 2.64Å; E106-R110 PolarHBondContact OE1-NH1 3.11Å; E106-R110 IonicContact OE1-NH2 3.39Å; E106-R110 PolarHBondContact OE1-NH2 3.2Å; E106-R110 IonicContact OE2-NH1 2.97Å
107	S	81.8	Confident	80.3	Confident	69 Å²	69	88.2 Å²	88.2	48%	0.483	44%	0.438	S	S	.	.	H	α-helix	trans	-62.5	-41.8	176.7	-171	0	0	0	0	111.7	Q103 I104 S105 R110 T111	Q103-S107 WeakPolarHBondContact O-CB 3.49Å; Q103-S107 PolarHBondContact O-N 3.49Å; I104-S107 PolarHBondContact O-N 2.97Å; S105-S107 PolarHBondContact O-N 2.67Å; S107-R110 PolarHBondContact O-N 3.34Å; S107-T111 PolarHBondContact O-N 3.16Å; S107-T111 PolarHBondContact O-OG1 3.11Å; S107-T111 VanDerWaalsContact O-OG1 3.11Å
108	R	82.8	Confident	80.7	Confident	106 Å²	106	88 Å²	88	40%	0.4	44%	0.435	S	S	.	.	H	α-helix	trans	-62.4	-47.1	176.2	-74.7	176	174.7	-177.4	-1.8	110.8	I104 S105 E106 R110 T111 N112	I104-R108 WeakPolarHBondContact O-CG 3.36Å; I104-R108 PolarHBondContact O-N 3.11Å; S105-R108 PolarHBondContact O-N 3.04Å; E106-R108 VanDerWaalsContact C-N 3.34Å; E106-R108 PolarHBondContact O-N 3.37Å; R108-R110 PolarHBondContact O-N 2.9Å; R108-T111 PolarHBondContact O-N 3.1Å; R108-N112 WeakPolarHBondContact O-CB 3.34Å; R108-N112 PolarHBondContact O-N 2.85Å; R108-N112 PolarHBondContact O-OD1 3.26Å
109	L	84	Confident	80.8	Confident	96 Å²	96	84.4 Å²	84.4	50%	0.503	42%	0.416	S	S	.	.	H	α-helix	trans	-60.8	-42.1	177.4	-74.7	171.5	0	0	0	112.5	L33 S105 E106 N112 L113	L33-L109 HydrophobicContact CD2-CD2 4.27Å; S105-L109 WeakPolarHBondContact O-CB 3.03Å; S105-L109 WeakPolarHBondContact O-CG 3.45Å; S105-L109 PolarHBondContact O-N 3.34Å; E106-L109 PolarHBondContact O-N 3.29Å; L109-N112 PolarHBondContact O-N 3.39Å; L109-L113 WeakPolarHBondContact O-CB 3.17Å; L109-L113 PolarHBondContact O-N 2.88Å
110	R	83.5	Confident	80.8	Confident	153 Å²	153	83.2 Å²	83.2	58%	0.577	42%	0.417	S	S	*	.	H	α-helix	trans	-62.4	-43.7	175.8	-77.9	178.7	172.8	150	-0.3	112.3	E106 S107 R108 L113 N114	E106-R110 VanDerWaalsContact CD-CZ 3.5Å; E106-R110 WeakPolarHBondContact O-CB 3.38Å; E106-R110 WeakPolarHBondContact O-CG 3.34Å; E106-R110 PolarHBondContact O-N 2.99Å; E106-R110 IonicContact OE1-CZ 3.65Å; E106-R110 IonicContact OE1-NE 2.98Å; E106-R110 IonicContact OE1-NH1 2.64Å; E106-R110 PolarHBondContact OE1-NH1 3.11Å; E106-R110 IonicContact OE1-NH2 3.39Å; E106-R110 PolarHBondContact OE1-NH2 3.2Å; E106-R110 IonicContact OE2-NH1 2.97Å; S107-R110 PolarHBondContact O-N 3.34Å; R108-R110 PolarHBondContact O-N 2.9Å; R110-L113 PolarHBondContact O-N 3.22Å; R110-N114 WeakPolarHBondContact O-CB 3.32Å; R110-N114 PolarHBondContact O-N 3.13Å
111	T	85.3	Confident	80.6	Confident	72 Å²	72	79.1 Å²	79.1	44%	0.442	41%	0.412	S	S	.	.	H	α-helix	trans	-60.8	-49.9	175	-61.7	0	0	0	0	110.3	S107 R108 L113 N114 E115	S107-T111 PolarHBondContact O-N 3.16Å; S107-T111 PolarHBondContact O-OG1 3.11Å; S107-T111 VanDerWaalsContact O-OG1 3.11Å; R108-T111 PolarHBondContact O-N 3.1Å; T111-L113 VanDerWaalsContact C-N 3.31Å; T111-L113 PolarHBondContact O-N 2.8Å; T111-N114 WeakPolarHBondContact O-CB 3.28Å; T111-N114 PolarHBondContact O-N 3.1Å; T111-N114 VanDerWaalsContact O-N 3.11Å; T111-E115 WeakPolarHBondContact O-CG 3.45Å; T111-E115 PolarHBondContact O-N 3.07Å
112	N	83.7	Confident	80.3	Confident	27 Å²	27	78.6 Å²	78.6	14%	0.144	41%	0.41	C	S	.	.	H	α-helix	trans	-58.8	-43.3	-180	-65.9	-0.8	0	0	0	111.7	R108 L109 N114 E115 L116 W140	R108-N112 WeakPolarHBondContact O-CB 3.34Å; R108-N112 PolarHBondContact O-N 2.85Å; R108-N112 PolarHBondContact O-OD1 3.26Å; L109-N112 PolarHBondContact O-N 3.39Å; N112-N114 VanDerWaalsContact C-N 3.35Å; N112-N114 PolarHBondContact O-N 3.21Å; N112-E115 PolarHBondContact O-N 3.07Å; N112-L116 WeakPolarHBondContact O-CG 3.48Å; N112-L116 PolarHBondContact O-N 2.73Å; N112-W140 HydrophobicContact CB-CH2 4.48Å; N112-W140 HydrophobicContact CB-CZ2 3.82Å; N112-W140 WeakPolarHBondContact OD1-CZ2 3.4Å
113	L	85.5	Confident	79.9	Confident	104 Å²	104	79.1 Å²	79.1	55%	0.545	41%	0.412	S	S	.	.	H	α-helix	trans	-63.7	-39.4	177.2	-174.6	65.7	0	0	0	112.3	L109 R110 T111 L116 N117	L109-L113 WeakPolarHBondContact O-CB 3.17Å; L109-L113 PolarHBondContact O-N 2.88Å; R110-L113 PolarHBondContact O-N 3.22Å; T111-L113 VanDerWaalsContact C-N 3.31Å; T111-L113 PolarHBondContact O-N 2.8Å; L113-L116 PolarHBondContact O-N 2.67Å; L113-N117 PolarHBondContact O-N 3.36Å; L113-N117 PolarHBondContact O-ND2 2.94Å
114	N	83.8	Confident	79.5	Confident	84 Å²	84	77.6 Å²	77.6	45%	0.449	42%	0.415	S	S	.	.	H	α-helix	trans	-64.6	-41.9	176.8	-173.3	42.4	0	0	0	111.9	R110 T111 N112 N117 K118	R110-N114 WeakPolarHBondContact O-CB 3.32Å; R110-N114 PolarHBondContact O-N 3.13Å; T111-N114 WeakPolarHBondContact O-CB 3.28Å; T111-N114 PolarHBondContact O-N 3.1Å; T111-N114 VanDerWaalsContact O-N 3.11Å; N112-N114 VanDerWaalsContact C-N 3.35Å; N112-N114 PolarHBondContact O-N 3.21Å; N114-N117 WeakPolarHBondContact O-CB 3.25Å; N114-N117 PolarHBondContact O-N 2.89Å; N114-K118 WeakPolarHBondContact O-CG 3.47Å; N114-K118 PolarHBondContact O-N 3.43Å; N114-K118 VanDerWaalsContact O-N 3.07Å
115	E	82.8	Confident	78.6	Confident	28 Å²	28	76.2 Å²	76.2	13%	0.131	41%	0.413	C	S	.	.	H	α-helix	trans	-68.3	-39.7	177.8	-59.5	-57.4	139.8	0	0	111.5	T111 N112 N117 K118 I119 H136 W140	T111-E115 WeakPolarHBondContact O-CG 3.45Å; T111-E115 PolarHBondContact O-N 3.07Å; N112-E115 PolarHBondContact O-N 3.07Å; E115-N117 VanDerWaalsContact C-N 3.31Å; E115-N117 PolarHBondContact O-N 3.33Å; E115-K118 WeakPolarHBondContact O-CB 3.44Å; E115-K118 PolarHBondContact O-N 3.48Å; E115-K118 VanDerWaalsContact O-N 3.1Å; E115-K118 IonicContact OE1-NZ 3.61Å; E115-K118 PolarHBondContact OE1-NZ 3.16Å; E115-K118 WeakPolarHBondContact OE2-CD 3.46Å; E115-K118 IonicContact OE2-NZ 2.62Å; E115-K118 PolarHBondContact OE2-NZ 2.82Å; E115-I119 WeakPolarHBondContact O-CG1 3.23Å; E115-I119 PolarHBondContact O-N 3.47Å; E115-H136 IonicContact OE2-CE1 3.49Å; E115-H136 PolarHBondContact OE2-CE1 2.76Å; E115-H136 IonicContact OE2-NE2 3.43Å; E115-H136 PolarHBondContact OE2-NE2 2.81Å; E115-W140 HydrophobicContact CB-CD2 4.27Å; E115-W140 HydrophobicContact CB-CG 4.06Å; E115-W140 VanDerWaalsContact CG-CD1 3.43Å; E115-W140 HydrophobicContact CG-CG 4.24Å
116	L	81.2	Confident	77.5	Confident	87 Å²	87	79.6 Å²	79.6	46%	0.455	44%	0.444	S	S	.	.	H	α-helix	trans	-59.3	-40	170.9	-74.2	173.6	0	0	0	112.6	N112 L113 K118 I119 T120	N112-L116 WeakPolarHBondContact O-CG 3.48Å; N112-L116 PolarHBondContact O-N 2.73Å; L113-L116 PolarHBondContact O-N 2.67Å; L116-K118 VanDerWaalsContact C-N 3.33Å; L116-K118 PolarHBondContact O-N 3.26Å; L116-I119 HydrophobicContact CD2-CD1 4.44Å; L116-I119 PolarHBondContact O-N 2.89Å; L116-T120 WeakPolarHBondContact O-CB 3.39Å; L116-T120 PolarHBondContact O-N 3.44Å; L116-T120 PolarHBondContact O-OG1 3.05Å
117	N	79.9	Confident	76.3	Confident	85 Å²	85	81 Å²	81	46%	0.455	46%	0.462	S	S	.	.	H	α-helix	trans	-64	-36.5	174.8	-77.5	-27.9	0	0	0	112.3	L113 N114 E115 T120 S121	L113-N117 PolarHBondContact O-N 3.36Å; L113-N117 PolarHBondContact O-ND2 2.94Å; N114-N117 WeakPolarHBondContact O-CB 3.25Å; N114-N117 PolarHBondContact O-N 2.89Å; E115-N117 VanDerWaalsContact C-N 3.31Å; E115-N117 PolarHBondContact O-N 3.33Å; N117-T120 PolarHBondContact O-N 3.02Å; N117-S121 WeakPolarHBondContact O-CB 3.43Å; N117-S121 PolarHBondContact O-N 3.14Å; N117-S121 PolarHBondContact O-OG 3.24Å
118	K	80.1	Confident	74.8	Confident	89 Å²	89	83.7 Å²	83.7	39%	0.387	47%	0.467	S	S	.	.	H	α-helix	trans	-66.4	-44.9	174.3	-67.6	176.3	-167.6	167.1	0	111.8	N114 E115 L116 T120 S121 A122	N114-K118 WeakPolarHBondContact O-CG 3.47Å; N114-K118 PolarHBondContact O-N 3.43Å; N114-K118 VanDerWaalsContact O-N 3.07Å; E115-K118 WeakPolarHBondContact O-CB 3.44Å; E115-K118 PolarHBondContact O-N 3.48Å; E115-K118 VanDerWaalsContact O-N 3.1Å; E115-K118 IonicContact OE1-NZ 3.61Å; E115-K118 PolarHBondContact OE1-NZ 3.16Å; E115-K118 WeakPolarHBondContact OE2-CD 3.46Å; E115-K118 IonicContact OE2-NZ 2.62Å; E115-K118 PolarHBondContact OE2-NZ 2.82Å; L116-K118 VanDerWaalsContact C-N 3.33Å; L116-K118 PolarHBondContact O-N 3.26Å; K118-T120 VanDerWaalsContact C-N 3.29Å; K118-T120 PolarHBondContact O-N 2.8Å; K118-S121 PolarHBondContact O-N 3.28Å; K118-A122 VanDerWaalsContact O-CB 3.32Å; K118-A122 WeakPolarHBondContact O-CB 3.44Å; K118-A122 PolarHBondContact O-N 2.93Å
119	I	75.8	Confident	73.4	Confident	23 Å²	23	82 Å²	82	12%	0.118	47%	0.471	C	S	.	.	H	α-helix	trans	-58.1	-46.2	176.1	-66.8	159.4	0	0	0	109.9	E115 L116 A122 L123 I137	E115-I119 WeakPolarHBondContact O-CG1 3.23Å; E115-I119 PolarHBondContact O-N 3.47Å; L116-I119 HydrophobicContact CD2-CD1 4.44Å; L116-I119 PolarHBondContact O-N 2.89Å; I119-A122 PolarHBondContact O-N 2.91Å; I119-L123 WeakPolarHBondContact O-CB 3.34Å; I119-L123 PolarHBondContact O-N 2.97Å; I119-I137 HydrophobicContact CD1-CD1 4.43Å; I119-I137 HydrophobicContact CD1-CG1 3.51Å; I119-I137 HydrophobicContact CG1-CG1 3.94Å; I119-I137 HydrophobicContact CG2-CD1 4.06Å; I119-I137 HydrophobicContact CG2-CG1 4.22Å
120	T	76.4	Confident	72.1	Confident	88 Å²	88	81.7 Å²	81.7	54%	0.54	48%	0.478	S	S	.	.	H	α-helix	trans	-62.6	-45.5	178	-55.4	0	0	0	0	111.6	L116 N117 K118 A122 L123 S124	L116-T120 WeakPolarHBondContact O-CB 3.39Å; L116-T120 PolarHBondContact O-N 3.44Å; L116-T120 PolarHBondContact O-OG1 3.05Å; N117-T120 PolarHBondContact O-N 3.02Å; K118-T120 VanDerWaalsContact C-N 3.29Å; K118-T120 PolarHBondContact O-N 2.8Å; T120-A122 PolarHBondContact O-N 2.82Å; T120-L123 PolarHBondContact O-N 3.06Å; T120-S124 PolarHBondContact O-N 2.51Å; T120-S124 PolarHBondContact O-OG 2.88Å
121	S	74.6	Confident	70.9	Confident	66 Å²	66	78.7 Å²	78.7	46%	0.462	48%	0.476	S	S	.	.	H	α-helix	trans	-63.4	-41.9	178.2	-58.4	0	0	0	0	112	N117 K118 L123 S124 S125	N117-S121 WeakPolarHBondContact O-CB 3.43Å; N117-S121 PolarHBondContact O-N 3.14Å; N117-S121 PolarHBondContact O-OG 3.24Å; K118-S121 PolarHBondContact O-N 3.28Å; S121-L123 VanDerWaalsContact C-N 3.31Å; S121-L123 PolarHBondContact O-N 2.86Å; S121-S124 WeakPolarHBondContact CA-OG 3.3Å; S121-S124 PolarHBondContact O-N 3.12Å; S121-S124 PolarHBondContact O-OG 3.07Å; S121-S125 PolarHBondContact O-N 3.3Å; S121-S125 VanDerWaalsContact O-N 3.14Å; S121-S125 PolarHBondContact O-OG 3.07Å
122	A	69.1	Low	70.1	Confident	27 Å²	27	78.6 Å²	78.6	22%	0.223	48%	0.479	C	S	.	.	H	α-helix	trans	-62.7	-39.7	176.1	0	0	0	0	0	111.4	K118 I119 T120 S125	K118-A122 VanDerWaalsContact O-CB 3.32Å; K118-A122 WeakPolarHBondContact O-CB 3.44Å; K118-A122 PolarHBondContact O-N 2.93Å; I119-A122 PolarHBondContact O-N 2.91Å; T120-A122 PolarHBondContact O-N 2.82Å; A122-S125 PolarHBondContact O-N 3.28Å
123	L	69.5	Low	69.2	Low	126 Å²	126	77.9 Å²	77.9	66%	0.66	48%	0.476	S	S	*	.	H	α-helix	trans	-69.8	-35.7	177.2	-163.1	67.8	0	0	0	112.7	I119 T120 S121 S125	I119-L123 WeakPolarHBondContact O-CB 3.34Å; I119-L123 PolarHBondContact O-N 2.97Å; T120-L123 PolarHBondContact O-N 3.06Å; S121-L123 VanDerWaalsContact C-N 3.31Å; S121-L123 PolarHBondContact O-N 2.86Å; L123-S125 VanDerWaalsContact C-N 3.3Å; L123-S125 PolarHBondContact O-N 3.23Å
124	S	69	Low	68.6	Low	94 Å²	94	76.2 Å²	76.2	66%	0.657	47%	0.47	S	S	*	.	H	α-helix	trans	-74.8	-16	176.8	67.6	0	0	0	0	114.4	T120 S121 A126	T120-S124 PolarHBondContact O-N 2.51Å; T120-S124 PolarHBondContact O-OG 2.88Å; S121-S124 WeakPolarHBondContact CA-OG 3.3Å; S121-S124 PolarHBondContact O-N 3.12Å; S121-S124 PolarHBondContact O-OG 3.07Å; S124-A126 PolarHBondContact O-N 3.26Å
125	S	60.7	Low	68.2	Low	53 Å²	53	77.5 Å²	77.5	37%	0.371	47%	0.473	S	S	.	.	S	Bend	trans	-77.4	108.3	179.1	-63.7	0	0	0	0	109.3	S121 A122 L123 S127 H128	S121-S125 PolarHBondContact O-N 3.3Å; S121-S125 VanDerWaalsContact O-N 3.14Å; S121-S125 PolarHBondContact O-OG 3.07Å; A122-S125 PolarHBondContact O-N 3.28Å; L123-S125 VanDerWaalsContact C-N 3.3Å; L123-S125 PolarHBondContact O-N 3.23Å; S125-S127 PolarHBondContact O-N 3.01Å; S125-H128 PolarHBondContact O-N 2.86Å
126	A	57.6	Low	67.7	Low	114 Å²	114	78.6 Å²	78.6	94%	0.942	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	3.1	-170.7	0	0	0	0	0	117.2	S124	S124-A126 PolarHBondContact O-N 3.26Å
127	S	55.3	Low	67.5	Low	110 Å²	110	76.6 Å²	76.6	77%	0.769	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.9	17.4	-174.4	-131.9	0	0	0	0	114.4	S125	S125-S127 PolarHBondContact O-N 3.01Å
128	H	49.7	Very low	67.3	Low	125 Å²	125	78 Å²	78	58%	0.579	47%	0.469	S	S	*	.			trans	-114.3	124.2	-178.1	-66.9	-22.6	0	0	0	112.7	S125 S130	S125-H128 PolarHBondContact O-N 2.86Å; H128-S130 PolarHBondContact O-N 3.43Å
129	S	53.5	Low	67.2	Low	70 Å²	70	80.3 Å²	80.3	49%	0.49	48%	0.482	S	S	.	.			trans	-48.6	129.3	173.4	176.8	0	0	0	0	110.6	T131 S132	S129-T131 WeakPolarHBondContact CB-OG1 3.46Å; S129-T131 PolarHBondContact O-N 3.23Å; S129-T131 WeakPolarHBondContact OG-CB 3.48Å; S129-T131 PolarHBondContact OG-N 2.87Å; S129-T131 PolarHBondContact OG-OG1 3.48Å; S129-S132 PolarHBondContact O-N 3.29Å
130	S	56.9	Low	67.3	Low	91 Å²	91	80.5 Å²	80.5	64%	0.636	48%	0.481	S	S	*	.	H	α-helix	trans	-51.8	-19.1	172.1	-50.1	0	0	0	0	113.2	H128 S132 T134	H128-S130 PolarHBondContact O-N 3.43Å; S130-S132 VanDerWaalsContact C-N 3.33Å; S130-S132 PolarHBondContact O-N 3.29Å; S130-T134 PolarHBondContact O-N 3.48Å; S130-T134 PolarHBondContact O-OG1 2.99Å
131	T	58.5	Low	67.3	Low	90 Å²	90	77.2 Å²	77.2	55%	0.552	46%	0.46	S	S	*	.	H	α-helix	trans	-66.3	-29.4	173.1	64.2	0	0	0	0	113.5	S129 T134 E135	S129-T131 WeakPolarHBondContact CB-OG1 3.46Å; S129-T131 PolarHBondContact O-N 3.23Å; S129-T131 WeakPolarHBondContact OG-CB 3.48Å; S129-T131 PolarHBondContact OG-N 2.87Å; S129-T131 PolarHBondContact OG-OG1 3.48Å; T131-T134 WeakPolarHBondContact CA-OG1 3.38Å; T131-T134 PolarHBondContact O-OG1 3.39Å; T131-E135 WeakPolarHBondContact O-CG 3.31Å; T131-E135 PolarHBondContact O-N 2.62Å
132	S	67.9	Low	67.4	Low	70 Å²	70	79.2 Å²	79.2	49%	0.49	47%	0.465	S	S	.	.	H	α-helix	trans	-72.1	-40	-178.2	-168.9	0	0	0	0	112.2	S129 S130 H136	S129-S132 PolarHBondContact O-N 3.29Å; S130-S132 VanDerWaalsContact C-N 3.33Å; S130-S132 PolarHBondContact O-N 3.29Å; S132-H136 WeakPolarHBondContact O-CB 3.28Å; S132-H136 PolarHBondContact O-N 2.87Å; S132-H136 VanDerWaalsContact O-N 3.09Å
133	S	66.4	Low	67.5	Low	11 Å²	11	81.4 Å²	81.4	8%	0.077	48%	0.479	C	S	.	.	H	α-helix	trans	-72.6	-37.8	-179.6	-54.4	0	0	0	0	111.8	H136 I137	S133-H136 PolarHBondContact O-N 2.78Å; S133-I137 WeakPolarHBondContact O-CD1 3.23Å; S133-I137 VanDerWaalsContact O-CG1 3.25Å; S133-I137 WeakPolarHBondContact O-CG1 3.28Å; S133-I137 PolarHBondContact O-N 3.21Å
134	T	72.2	Confident	67.4	Low	70 Å²	70	77.1 Å²	77.1	43%	0.429	46%	0.459	S	S	.	.	H	α-helix	trans	-65.8	-42.2	177.4	46.1	0	0	0	0	112.1	S130 T131 I137 K138	S130-T134 PolarHBondContact O-N 3.48Å; S130-T134 PolarHBondContact O-OG1 2.99Å; T131-T134 WeakPolarHBondContact CA-OG1 3.38Å; T131-T134 PolarHBondContact O-OG1 3.39Å; T134-I137 PolarHBondContact O-N 2.96Å; T134-K138 PolarHBondContact O-N 2.77Å; T134-K138 VanDerWaalsContact O-N 3.14Å
135	E	75.1	Confident	66.8	Low	110 Å²	110	74.7 Å²	74.7	51%	0.514	45%	0.448	S	S	.	.	H	α-helix	trans	-66.5	-38.5	173.9	-70.5	-58.9	125.3	0	0	112	T131 I137 K138 E139	T131-E135 WeakPolarHBondContact O-CG 3.31Å; T131-E135 PolarHBondContact O-N 2.62Å; E135-I137 PolarHBondContact O-N 2.95Å; E135-K138 PolarHBondContact O-N 3Å; E135-K138 IonicContact OE1-NZ 2.83Å; E135-K138 PolarHBondContact OE1-NZ 3.3Å; E135-E139 PolarHBondContact O-N 2.81Å
136	H	72.7	Confident	66.4	Low	51 Å²	51	78.2 Å²	78.2	24%	0.236	46%	0.463	C	S	.	.	H	α-helix	trans	-62.9	-40.3	174.8	-172	50.4	0	0	0	112.6	E115 S132 S133 E139 W140	E115-H136 IonicContact OE2-CE1 3.49Å; E115-H136 PolarHBondContact OE2-CE1 2.76Å; E115-H136 IonicContact OE2-NE2 3.43Å; E115-H136 PolarHBondContact OE2-NE2 2.81Å; S132-H136 WeakPolarHBondContact O-CB 3.28Å; S132-H136 PolarHBondContact O-N 2.87Å; S132-H136 VanDerWaalsContact O-N 3.09Å; S133-H136 PolarHBondContact O-N 2.78Å; H136-E139 PolarHBondContact O-N 3.42Å; H136-W140 VanDerWaalsContact O-CB 3.31Å; H136-W140 WeakPolarHBondContact O-CB 3.29Å; H136-W140 PolarHBondContact O-N 3.47Å
137	I	76.4	Confident	65.7	Low	46 Å²	46	79.9 Å²	79.9	24%	0.236	45%	0.451	C	S	.	.	H	α-helix	trans	-60.6	-46.6	174.5	-69.8	160.8	0	0	0	110.7	L25 I119 S133 T134 E135 W140 L141	L25-I137 HydrophobicContact CD2-CG2 4.4Å; I119-I137 HydrophobicContact CD1-CD1 4.43Å; I119-I137 HydrophobicContact CD1-CG1 3.51Å; I119-I137 HydrophobicContact CG1-CG1 3.94Å; I119-I137 HydrophobicContact CG2-CD1 4.06Å; I119-I137 HydrophobicContact CG2-CG1 4.22Å; S133-I137 WeakPolarHBondContact O-CD1 3.23Å; S133-I137 VanDerWaalsContact O-CG1 3.25Å; S133-I137 WeakPolarHBondContact O-CG1 3.28Å; S133-I137 PolarHBondContact O-N 3.21Å; T134-I137 PolarHBondContact O-N 2.96Å; E135-I137 PolarHBondContact O-N 2.95Å; I137-W140 PolarHBondContact O-N 3.48Å; I137-L141 HydrophobicContact CG2-CD1 3.86Å; I137-L141 HydrophobicContact CG2-CG 4.41Å; I137-L141 VanDerWaalsContact O-CG 3.29Å; I137-L141 WeakPolarHBondContact O-CG 3.47Å; I137-L141 PolarHBondContact O-N 3Å
138	K	77.3	Confident	65.2	Low	113 Å²	113	82 Å²	82	49%	0.491	45%	0.448	S	S	.	.	H	α-helix	trans	-62.1	-46.3	178.4	-71.4	177.4	-170.6	164.2	0	112.1	T134 E135 W140 L141 N142	T134-K138 PolarHBondContact O-N 2.77Å; T134-K138 VanDerWaalsContact O-N 3.14Å; E135-K138 PolarHBondContact O-N 3Å; E135-K138 IonicContact OE1-NZ 2.83Å; E135-K138 PolarHBondContact OE1-NZ 3.3Å; K138-W140 VanDerWaalsContact C-N 3.31Å; K138-W140 PolarHBondContact O-N 3.49Å; K138-L141 PolarHBondContact O-N 3.47Å; K138-N142 WeakPolarHBondContact O-CB 3.3Å; K138-N142 PolarHBondContact O-N 2.82Å; K138-N142 PolarHBondContact O-ND2 2.91Å
139	E	77.7	Confident	64.8	Low	138 Å²	138	81.2 Å²	81.2	65%	0.645	45%	0.448	S	S	*	.	H	α-helix	trans	-60.8	-42.5	178.2	-172.5	178.5	-165.8	0	0	111.2	E135 H136 N142 S143	E135-E139 PolarHBondContact O-N 2.81Å; H136-E139 PolarHBondContact O-N 3.42Å; E139-N142 PolarHBondContact O-N 2.86Å; E139-S143 WeakPolarHBondContact O-CB 3.34Å; E139-S143 PolarHBondContact O-N 3.3Å
140	W	77.6	Confident	64	Low	28 Å²	28	83.4 Å²	83.4	11%	0.106	46%	0.463	C	S	.	.	H	α-helix	trans	-63	-45.5	176.7	174.6	61.7	0	0	0	112.9	N112 E115 H136 I137 K138 S143 T144	N112-W140 HydrophobicContact CB-CH2 4.48Å; N112-W140 HydrophobicContact CB-CZ2 3.82Å; N112-W140 WeakPolarHBondContact OD1-CZ2 3.4Å; E115-W140 HydrophobicContact CB-CD2 4.27Å; E115-W140 HydrophobicContact CB-CG 4.06Å; E115-W140 VanDerWaalsContact CG-CD1 3.43Å; E115-W140 HydrophobicContact CG-CG 4.24Å; H136-W140 VanDerWaalsContact O-CB 3.31Å; H136-W140 WeakPolarHBondContact O-CB 3.29Å; H136-W140 PolarHBondContact O-N 3.47Å; I137-W140 PolarHBondContact O-N 3.48Å; K138-W140 VanDerWaalsContact C-N 3.31Å; K138-W140 PolarHBondContact O-N 3.49Å; W140-S143 PolarHBondContact O-N 2.78Å; W140-T144 PolarHBondContact O-N 3.01Å; W140-T144 PolarHBondContact O-OG1 3.33Å
141	L	75.9	Confident	63.2	Low	19 Å²	19	83 Å²	83	10%	0.099	46%	0.461	C	S	.	.	H	α-helix	trans	-62.5	-44.5	177.3	-71	169.9	0	0	0	111.7	L25 Q28 I137 K138 S143 T144 G145	L25-L141 HydrophobicContact CD2-CD1 3.58Å; Q28-L141 HydrophobicContact CG-CD2 4.48Å; Q28-L141 VanDerWaalsContact OE1-CD2 3.3Å; I137-L141 HydrophobicContact CG2-CD1 3.86Å; I137-L141 HydrophobicContact CG2-CG 4.41Å; I137-L141 VanDerWaalsContact O-CG 3.29Å; I137-L141 WeakPolarHBondContact O-CG 3.47Å; I137-L141 PolarHBondContact O-N 3Å; K138-L141 PolarHBondContact O-N 3.47Å; L141-S143 PolarHBondContact O-N 3.19Å; L141-T144 PolarHBondContact O-N 3.12Å; L141-G145 PolarHBondContact O-N 2.73Å
142	N	75.7	Confident	62	Low	107 Å²	107	83.5 Å²	83.5	57%	0.572	47%	0.468	S	S	*	.	H	α-helix	trans	-61	-44.8	176.1	-68.6	-19.7	0	0	0	111.2	K138 E139 T144 G145 D146	K138-N142 WeakPolarHBondContact O-CB 3.3Å; K138-N142 PolarHBondContact O-N 2.82Å; K138-N142 PolarHBondContact O-ND2 2.91Å; E139-N142 PolarHBondContact O-N 2.86Å; N142-T144 PolarHBondContact O-N 3Å; N142-G145 PolarHBondContact O-N 2.95Å; N142-D146 PolarHBondContact O-N 2.89Å; N142-D146 VanDerWaalsContact O-N 3.08Å
143	S	72.5	Confident	60.7	Low	73 Å²	73	86 Å²	86	51%	0.51	48%	0.475	S	S	.	.	H	α-helix	trans	-64.6	-25.1	177.7	-176.4	0	0	0	0	113.5	E139 W140 L141	E139-S143 WeakPolarHBondContact O-CB 3.34Å; E139-S143 PolarHBondContact O-N 3.3Å; W140-S143 PolarHBondContact O-N 2.78Å; L141-S143 PolarHBondContact O-N 3.19Å
144	T	66.6	Low	59	Low	37 Å²	37	92.3 Å²	92.3	23%	0.227	51%	0.508	C	S	.	.	H	α-helix	trans	-85.3	-33.1	179.4	-49	0	0	0	0	111.4	I32 W140 L141 N142	I32-T144 HydrophobicContact CD1-CG2 4.11Å; W140-T144 PolarHBondContact O-N 3.01Å; W140-T144 PolarHBondContact O-OG1 3.33Å; L141-T144 PolarHBondContact O-N 3.12Å; N142-T144 PolarHBondContact O-N 3Å
145	G	57.3	Low	57	Low	42 Å²	42	94 Å²	94	43%	0.433	52%	0.523	S	S	.	.	H	α-helix	trans	-72	-34.4	174.9	0	0	0	0	0	113.9	L141 N142 H147 H148	L141-G145 PolarHBondContact O-N 2.73Å; N142-G145 PolarHBondContact O-N 2.95Å; G145-H147 PolarHBondContact O-N 2.84Å; G145-H148 PolarHBondContact O-CD2 2.81Å; G145-H148 PolarHBondContact O-N 2.96Å
146	D	52.1	Low	55.1	Low	128 Å²	128	93.3 Å²	93.3	68%	0.684	53%	0.528	S	S	*	.	S	Bend	trans	-71.7	-10.3	-178.5	-74.5	-24.4	0	0	0	114	N142 H148	N142-D146 PolarHBondContact O-N 2.89Å; N142-D146 VanDerWaalsContact O-N 3.08Å; D146-H148 PolarHBondContact O-N 3.22Å
147	H	43.6	Very low	53	Low	149 Å²	149	94.2 Å²	94.2	69%	0.69	55%	0.55	S	S	*	*			trans	-74.3	48.3	161.7	-87.5	-56.9	0	0	0	110.9	G145 N149	G145-H147 PolarHBondContact O-N 2.84Å; H147-N149 PolarHBondContact O-N 2.75Å; H147-N149 VanDerWaalsContact O-N 3.11Å
148	H	44.2	Very low	50.9	Low	155 Å²	155	98.7 Å²	98.7	72%	0.718	58%	0.58	S	S	*	*			trans	-52.4	120.5	154.4	-80.8	-73.5	0	0	0	107	G145 D146 S150	G145-H148 PolarHBondContact O-CD2 2.81Å; G145-H148 PolarHBondContact O-N 2.96Å; D146-H148 PolarHBondContact O-N 3.22Å; H148-S150 PolarHBondContact O-N 3.13Å
149	N	41.9	Very low	48.5	Very low	107 Å²	107	102.4 Å²	102.4	57%	0.572	60%	0.599	S	S	*	*			trans	-55.9	80.7	-179.9	-59.9	-41.5	0	0	0	110.4	H147 S151	H147-N149 PolarHBondContact O-N 2.75Å; H147-N149 VanDerWaalsContact O-N 3.11Å; N149-S151 PolarHBondContact O-N 2.98Å
150	S	35.8	Very low	46.3	Very low	116 Å²	116	104 Å²	104	81%	0.811	61%	0.611	S	S	*	*			trans	-77.8	5.6	160.8	71.4	0	0	0	0	110.9	H148 S152	H148-S150 PolarHBondContact O-N 3.13Å; S150-S152 PolarHBondContact O-N 2.98Å
151	S	40.2	Very low	43.8	Very low	83 Å²	83	105.4 Å²	105.4	58%	0.58	63%	0.634	S	S	*	*			trans	-62.7	86.8	154	-59.2	0	0	0	0	106.7	N149 L153	N149-S151 PolarHBondContact O-N 2.98Å; S151-L153 PolarHBondContact O-N 2.89Å
152	S	33.2	Very low	41.7	Very low	101 Å²	101	111.4 Å²	111.4	71%	0.706	67%	0.666	S	S	*	*			trans	-52.9	74.1	148.1	172.3	0	0	0	0	106.8	S150 N154	S150-S152 PolarHBondContact O-N 2.98Å; S152-N154 VanDerWaalsContact C-N 3.32Å; S152-N154 PolarHBondContact O-N 3.4Å
153	L	39.4	Very low	39.6	Very low	123 Å²	123	112.7 Å²	112.7	64%	0.644	67%	0.673	S	S	*	*			trans	-56.8	111.5	156.7	-73.2	174.6	0	0	0	102.4	S151 S155	S151-L153 PolarHBondContact O-N 2.89Å; L153-S155 VanDerWaalsContact C-N 3.27Å; L153-S155 PolarHBondContact O-N 3.22Å
154	N	31.2	Very low	37.6	Very low	143 Å²	143	118.4 Å²	118.4	77%	0.765	69%	0.692	S	S	*	*			trans	-47.8	101	175.6	-57.6	-57.9	0	0	0	106.3	S152 P156	S152-N154 VanDerWaalsContact C-N 3.32Å; S152-N154 PolarHBondContact O-N 3.4Å; N154-P156 WeakPolarHBondContact O-CD 3.41Å
155	S	31.2	Very low	36	Very low	106 Å²	106	122.1 Å²	122.1	74%	0.741	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-53	116.3	159.5	-57	0	0	0	0	103.5	L153 G157	L153-S155 VanDerWaalsContact C-N 3.27Å; L153-S155 PolarHBondContact O-N 3.22Å; S155-G157 PolarHBondContact O-N 2.72Å
156	P	34.3	Very low	34.7	Very low	95 Å²	95	131.5 Å²	131.5	62%	0.617	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-51.9	126.3	168.9	-18	30.4	0	0	0	105.3	N154 V158	N154-P156 WeakPolarHBondContact O-CD 3.41Å; P156-V158 PolarHBondContact O-N 3.16Å
157	G	29.6	Very low	33.8	Very low	69 Å²	69	132.2 Å²	132.2	71%	0.711	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-47.8	131.6	-170.8	0	0	0	0	0	110.5	S155 E159	S155-G157 PolarHBondContact O-N 2.72Å; G157-E159 VanDerWaalsContact C-N 3.31Å; G157-E159 PolarHBondContact O-N 3.45Å
158	V	31.8	Very low	33.3	Very low	141 Å²	141	133 Å²	133	86%	0.855	75%	0.75	S	S	*	*			trans	-37.6	97.9	156.1	173.4	0	0	0	0	108.6	P156	P156-V158 PolarHBondContact O-N 3.16Å
159	E	27.4	Very low	32.7	Very low	191 Å²	191	130.4 Å²	130.4	89%	0.893	75%	0.749	S	S	*	*			trans	-105.1	111.3	161	-129	-177.6	-177.6	0	0	106.8	G157 G161	G157-E159 VanDerWaalsContact C-N 3.31Å; G157-E159 PolarHBondContact O-N 3.45Å; E159-G161 PolarHBondContact O-N 2.94Å
160	L	31.6	Very low	32.4	Very low	170 Å²	170	132 Å²	132	89%	0.89	76%	0.763	S	S	*	*			trans	-53.4	127	176.7	-74.9	140.5	0	0	0	111.9
161	G	25.5	Very low	32.6	Very low	58 Å²	58	133.4 Å²	133.4	60%	0.598	76%	0.761	S	S	*	*			trans	176.1	106.6	161	0	0	0	0	0	105.9	E159	E159-G161 PolarHBondContact O-N 2.94Å
162	D	30	Very low	32.3	Very low	145 Å²	145	136 Å²	136	78%	0.775	77%	0.769	S	S	*	*				-158.1	131.1	55.9	-80.6	-47.4	0	0	0	111.3
163	N	32.7	Very low	32.5	Very low	135 Å²	135	139.3 Å²	139.3	72%	0.722	77%	0.77	S	S	*	*			trans	36.9	92.1	132.7	-60.7	-41.2	0	0	0	116.3	T165	N163-T165 PolarHBondContact O-N 3.21Å
164	E	30.6	Very low	32.3	Very low	193 Å²	193	141.4 Å²	141.4	90%	0.902	78%	0.777	S	S	*	*			trans	-45.9	105.7	132.7	-74.2	-173.9	126.9	0	0	109.6
165	T	32.4	Very low	32.8	Very low	114 Å²	114	142.3 Å²	142.3	70%	0.699	78%	0.779	S	S	*	*			trans	-148.8	72.4	139.2	-15.6	0	0	0	0	110.4	N163 N167	N163-T165 PolarHBondContact O-N 3.21Å; T165-N167 PolarHBondContact O-N 2.9Å
166	R	30.3	Very low	33	Very low	239 Å²	239	144.5 Å²	144.5	90%	0.902	78%	0.782	S	S	*	*			trans	-42.6	114.4	141.8	-163.9	-177	-164.2	177.3	4.3	108.2
167	N	33.6	Very low	33	Very low	143 Å²	143	143.3 Å²	143.3	77%	0.765	79%	0.787	S	S	*	*			trans	-161.1	92.5	150.6	-87.2	-27.9	0	0	0	109.7	T165 S169	T165-N167 PolarHBondContact O-N 2.9Å; N167-S169 PolarHBondContact O-N 3.12Å
168	N	32.6	Very low	33.5	Very low	167 Å²	167	151.9 Å²	151.9	89%	0.893	81%	0.814	S	S	*	*			trans	-46.4	128.6	148.5	-79.9	-15.5	0	0	0	109.7
169	S	32.9	Very low	33.6	Very low	99 Å²	99	152.5 Å²	152.5	69%	0.692	81%	0.812	S	S	*	*			trans	-163.4	99.5	133.2	51.4	0	0	0	0	109.7	N167 N171	N167-S169 PolarHBondContact O-N 3.12Å; S169-N171 PolarHBondContact O-N 3.49Å
170	V	34.8	Very low	33.9	Very low	141 Å²	141	150.4 Å²	150.4	86%	0.855	81%	0.808	S	S	*	*			trans	-67	104.9	149.9	174.3	0	0	0	0	105.2
171	N	39.2	Very low	34.1	Very low	146 Å²	146	149.3 Å²	149.3	78%	0.781	80%	0.803	S	S	*	*			trans	-123.9	96	162.9	-95.4	0.5	0	0	0	108.6	S169 F173	S169-N171 PolarHBondContact O-N 3.49Å; N171-F173 PolarHBondContact O-N 3.28Å
172	D	35.2	Very low	34.6	Very low	138 Å²	138	154.7 Å²	154.7	74%	0.738	82%	0.815	S	S	*	*			trans	-50.5	117.6	152	-158.3	8.8	0	0	0	109.3
173	F	36.3	Very low	34.9	Very low	169 Å²	169	155.3 Å²	155.3	74%	0.741	82%	0.818	S	S	*	*			trans	-154.8	85	159.7	-119.9	-78.8	0	0	0	109.9	N171 M175	N171-F173 PolarHBondContact O-N 3.28Å; F173-M175 HydrophobicContact CD1-CB 4.34Å; F173-M175 HydrophobicContact CD1-CG 3.8Å; F173-M175 HydrophobicContact CE1-CE 4.11Å; F173-M175 HydrophobicContact CE1-CG 3.77Å
174	E	34.7	Very low	35	Very low	168 Å²	168	156.7 Å²	156.7	79%	0.785	82%	0.824	S	S	*	*			trans	-57.5	125.2	145	-176.4	175.7	-155	0	0	108.8
175	M	42.7	Very low	35.3	Very low	162 Å²	162	154.1 Å²	154.1	80%	0.798	82%	0.819	S	S	*	*			trans	-156.4	107.6	159.1	-98	-98	-157.1	0	0	108.6	F173	F173-M175 HydrophobicContact CD1-CB 4.34Å; F173-M175 HydrophobicContact CD1-CG 3.8Å; F173-M175 HydrophobicContact CE1-CE 4.11Å; F173-M175 HydrophobicContact CE1-CG 3.77Å
176	D	35.8	Very low	35.5	Very low	151 Å²	151	157.2 Å²	157.2	81%	0.807	83%	0.828	S	S	*	*			trans	-54.3	151.9	165.4	-81.6	-45.9	0	0	0	113.5
177	G	33.9	Very low	36	Very low	70 Å²	70	150.3 Å²	150.3	72%	0.722	82%	0.822	S	S	*	*			trans	97.9	97.9	140.5	0	0	0	0	0	117.5
178	I	40.3	Very low	36.2	Very low	250 Å²	250	151 Å²	151	100%	1.282	83%	0.827	S	S	*	*				-163.1	0	105.1	30.8	176	0	0	0	110.7

Retrieved 178 of 178 residues in 26.6 ms (Link to these results)

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