A0A077ZE05_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZE05, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 317 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	30.8	Very low	30	Very low	234 Å²	234	158.5 Å²	158.5	100%	1.153	84%	0.842	S	S	*	*				0	82.2	0	-74.3	172.7	156.2	0	0	107.2
2	M	32.9	Very low	29.9	Very low	191 Å²	191	155.3 Å²	155.3	94%	0.941	83%	0.832	S	S	*	*				52.8	90.5	99.6	-87.8	179.7	160.7	0	0	113.6
3	V	36.7	Very low	30.5	Very low	149 Å²	149	153.1 Å²	153.1	90%	0.903	82%	0.819	S	S	*	*			trans	-94.3	110.7	174	-167.6	0	0	0	0	106.8
4	M	33.6	Very low	30.5	Very low	175 Å²	175	151.9 Å²	151.9	86%	0.862	82%	0.82	S	S	*	*			trans	-116.1	138.2	176.1	-80	-147.1	101.7	0	0	111.8
5	S	27.7	Very low	30.9	Very low	96 Å²	96	148.8 Å²	148.8	67%	0.671	80%	0.802	S	S	*	*			trans	97.7	107.9	141.4	-146.3	0	0	0	0	119.9
6	T	29.4	Very low	31.1	Very low	123 Å²	123	144.8 Å²	144.8	76%	0.755	79%	0.786	S	S	*	*			trans	63.4	118.2	130.7	51.1	0	0	0	0	121.9
7	L	26.4	Very low	31.8	Very low	155 Å²	155	144.4 Å²	144.4	81%	0.812	80%	0.797	S	S	*	*			trans	-160.5	150.9	131.4	-141.1	91.8	0	0	0	111.4
8	M	30.3	Very low	32.5	Very low	174 Å²	174	142.1 Å²	142.1	86%	0.857	79%	0.792	S	S	*	*			trans	112	71.8	-178.5	-64.5	-86.2	153.1	0	0	112.4
9	M	22.6	Very low	32.9	Very low	162 Å²	162	138.3 Å²	138.3	80%	0.798	77%	0.77	S	S	*	*			cis	3.9	113.9	19.2	-81.6	-160.5	138.5	0	0	116.2
10	V	29	Very low	33.3	Very low	99 Å²	99	132.5 Å²	132.5	60%	0.6	74%	0.738	S	S	*	*			cis	-174.4	141.9	31.1	143.4	0	0	0	0	105.9
11	M	30.3	Very low	34.1	Very low	185 Å²	185	130.1 Å²	130.1	91%	0.911	73%	0.727	S	S	*	*				-159.5	114.8	124.6	-130.4	179.4	165.1	0	0	111.1
12	V	28.7	Very low	34.6	Very low	120 Å²	120	121.3 Å²	121.3	73%	0.727	70%	0.696	S	S	*	*			trans	-77.9	137.9	-179.9	169.7	0	0	0	0	109.6
13	I	37.6	Very low	35.3	Very low	127 Å²	127	117.3 Å²	117.3	65%	0.651	68%	0.675	S	S	*	*			trans	-99.2	107.1	176.1	-54.9	173.7	0	0	0	108.7	L15	I13-L15 HydrophobicContact CB-CD1 4.23Å; I13-L15 HydrophobicContact CG2-CD1 3.6Å; I13-L15 HydrophobicContact CG2-CG 4.24Å; I13-L15 PolarHBondContact O-N 2.99Å
14	T	30.4	Very low	35.8	Very low	136 Å²	136	110.7 Å²	110.7	83%	0.834	64%	0.636	S	S	*	*			trans	-77.4	97.9	167	18.7	0	0	0	0	109.2
15	L	37	Very low	36.4	Very low	106 Å²	106	106.9 Å²	106.9	56%	0.555	62%	0.619	S	S	*	*			trans	-78.9	130.9	174.6	-82.3	93	0	0	0	111.1	I13 A24	I13-L15 HydrophobicContact CB-CD1 4.23Å; I13-L15 HydrophobicContact CG2-CD1 3.6Å; I13-L15 HydrophobicContact CG2-CG 4.24Å; I13-L15 PolarHBondContact O-N 2.99Å; L15-A24 HydrophobicContact CD2-CB 4.46Å
16	P	34.6	Very low	37.3	Very low	85 Å²	85	107.2 Å²	107.2	55%	0.552	61%	0.609	S	S	*	*			trans	-72.3	133.4	166.8	27.5	-29.8	0	0	0	110.6	S18 L19	P16-S18 PolarHBondContact O-N 2.96Å; P16-L19 HydrophobicContact CG-CD1 3.87Å
17	S	43.1	Very low	38.3	Very low	137 Å²	137	107.3 Å²	107.3	96%	0.958	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	9.1	-165.7	-24.5	0	0	0	0	117
18	S	44.2	Very low	39.4	Very low	103 Å²	103	102.8 Å²	102.8	72%	0.72	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	-1.4	-174.3	58.3	0	0	0	0	115.1	P16	P16-S18 PolarHBondContact O-N 2.96Å
19	L	39.1	Very low	40.3	Very low	71 Å²	71	98.8 Å²	98.8	37%	0.372	56%	0.561	S	S	.	*	S	Bend	trans	-90.2	118.8	173.3	-74.2	90.7	0	0	0	111.2	P16 T21 A24	P16-L19 HydrophobicContact CG-CD1 3.87Å; L19-T21 PolarHBondContact O-N 3.14Å; L19-A24 HydrophobicContact CB-CB 3.42Å; L19-A24 VanDerWaalsContact CB-CB 3.42Å; L19-A24 HydrophobicContact CD2-CB 3.52Å; L19-A24 HydrophobicContact CG-CB 4.07Å
20	T	41.7	Very low	41.3	Very low	22 Å²	22	98 Å²	98	14%	0.135	55%	0.549	C	S	.	.			trans	-56.1	129.3	169.3	48.7	0	0	0	0	109.7	G22 Q23 S294 P295	T20-G22 PolarHBondContact O-N 3.4Å; T20-Q23 PolarHBondContact O-N 3.42Å; T20-Q23 VanDerWaalsContact O-N 3.07Å; T20-S294 WeakPolarHBondContact CG2-OG 3.38Å; T20-S294 PolarHBondContact OG1-OG 3.24Å; T20-P295 WeakPolarHBondContact CB-O 3.41Å; T20-P295 VanDerWaalsContact CG2-C 3.43Å; T20-P295 WeakPolarHBondContact CG2-O 3.23Å; T20-P295 WeakPolarHBondContact OG1-CD 3.09Å
21	T	49.9	Very low	42.3	Very low	82 Å²	82	96.8 Å²	96.8	50%	0.503	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-17.9	-156.9	40.8	0	0	0	0	116	L19 N297	L19-T21 PolarHBondContact O-N 3.14Å; T21-N297 PolarHBondContact OG1-OD1 3.09Å
22	G	42.3	Very low	43.2	Very low	49 Å²	49	93.8 Å²	93.8	51%	0.505	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-42	176.8	0	0	0	0	0	114.4	T20	T20-G22 PolarHBondContact O-N 3.4Å
23	Q	46.3	Very low	43.9	Very low	107 Å²	107	97.8 Å²	97.8	50%	0.5	53%	0.528	S	S	.	.	H	α-helix	trans	-82.4	-34.6	-170	-72.7	-179.3	-43.1	0	0	112.6	T20 I25 E26 E27	T20-Q23 PolarHBondContact O-N 3.42Å; T20-Q23 VanDerWaalsContact O-N 3.07Å; Q23-I25 PolarHBondContact O-N 3.39Å; Q23-E26 PolarHBondContact O-N 3.26Å; Q23-E27 PolarHBondContact O-N 3.25Å; Q23-E27 VanDerWaalsContact O-N 3.1Å
24	A	47.6	Very low	44.3	Very low	10 Å²	10	98.2 Å²	98.2	8%	0.083	53%	0.531	C	S	.	.	H	α-helix	trans	-60	-45.4	179.8	0	0	0	0	0	113	L15 L19 E26 V28	L15-A24 HydrophobicContact CD2-CB 4.46Å; L19-A24 HydrophobicContact CB-CB 3.42Å; L19-A24 VanDerWaalsContact CB-CB 3.42Å; L19-A24 HydrophobicContact CD2-CB 3.52Å; L19-A24 HydrophobicContact CG-CB 4.07Å; A24-E26 VanDerWaalsContact C-N 3.34Å; A24-V28 VanDerWaalsContact O-CG2 3.3Å; A24-V28 WeakPolarHBondContact O-CG2 3.21Å; A24-V28 PolarHBondContact O-N 3.15Å
25	I	46.6	Very low	44.9	Very low	96 Å²	96	97.2 Å²	97.2	49%	0.492	52%	0.52	S	S	.	.	H	α-helix	trans	-71.4	-37	-176.3	-61.3	175.5	0	0	0	109.7	Q23 I29	Q23-I25 PolarHBondContact O-N 3.39Å; I25-I29 HydrophobicContact CG2-CD1 3.58Å; I25-I29 HydrophobicContact CG2-CG1 4.35Å; I25-I29 WeakPolarHBondContact O-CB 3.48Å; I25-I29 VanDerWaalsContact O-CG1 3.22Å; I25-I29 WeakPolarHBondContact O-CG1 3.47Å; I25-I29 PolarHBondContact O-N 3.29Å
26	E	46.5	Very low	45.2	Very low	102 Å²	102	95.4 Å²	95.4	48%	0.477	51%	0.514	S	S	.	.	H	α-helix	trans	-67	-41.2	-179.6	-160.2	177.2	-175.7	0	0	112	Q23 A24 R30	Q23-E26 PolarHBondContact O-N 3.26Å; A24-E26 VanDerWaalsContact C-N 3.34Å; E26-R30 WeakPolarHBondContact O-CB 3.22Å; E26-R30 VanDerWaalsContact O-CG 3.25Å; E26-R30 WeakPolarHBondContact O-CG 3.44Å; E26-R30 PolarHBondContact O-N 2.83Å; E26-R30 IonicContact OE1-CZ 3.9Å; E26-R30 IonicContact OE1-NE 3.5Å; E26-R30 PolarHBondContact OE1-NE 3.35Å; E26-R30 IonicContact OE1-NH2 2.89Å; E26-R30 PolarHBondContact OE1-NH2 3.36Å
27	E	49	Very low	45.5	Very low	126 Å²	126	95.3 Å²	95.3	59%	0.589	51%	0.513	S	S	*	.	H	α-helix	trans	-71.1	-40.9	179.6	-158.4	169.5	-151.4	0	0	112.3	Q23 R30 T31	Q23-E27 PolarHBondContact O-N 3.25Å; Q23-E27 VanDerWaalsContact O-N 3.1Å; E27-R30 PolarHBondContact O-N 3.02Å; E27-T31 WeakPolarHBondContact O-CB 3.32Å; E27-T31 VanDerWaalsContact O-CG2 3.31Å; E27-T31 WeakPolarHBondContact O-CG2 3.24Å; E27-T31 PolarHBondContact O-N 3.3Å; E27-T31 PolarHBondContact O-OG1 2.91Å
28	V	51.1	Low	45.5	Very low	59 Å²	59	95.1 Å²	95.1	36%	0.358	50%	0.496	S	S	.	.	H	α-helix	trans	-64.1	-43	175.4	173.4	0	0	0	0	111.5	A24 T31 Q32	A24-V28 VanDerWaalsContact O-CG2 3.3Å; A24-V28 WeakPolarHBondContact O-CG2 3.21Å; A24-V28 PolarHBondContact O-N 3.15Å; V28-T31 PolarHBondContact O-N 3.49Å; V28-T31 PolarHBondContact O-OG1 3.49Å; V28-Q32 WeakPolarHBondContact O-CB 3.41Å; V28-Q32 PolarHBondContact O-N 3.17Å
29	I	48	Very low	45.4	Very low	90 Å²	90	93.5 Å²	93.5	46%	0.462	48%	0.484	S	S	.	.	H	α-helix	trans	-70.7	-41.3	179.7	-65.7	171.9	0	0	0	110.7	I25 T31 W33	I25-I29 HydrophobicContact CG2-CD1 3.58Å; I25-I29 HydrophobicContact CG2-CG1 4.35Å; I25-I29 WeakPolarHBondContact O-CB 3.48Å; I25-I29 VanDerWaalsContact O-CG1 3.22Å; I25-I29 WeakPolarHBondContact O-CG1 3.47Å; I25-I29 PolarHBondContact O-N 3.29Å; I29-T31 PolarHBondContact O-N 3.41Å; I29-W33 HydrophobicContact CG2-CB 4.38Å; I29-W33 VanDerWaalsContact O-CB 3.31Å; I29-W33 WeakPolarHBondContact O-CB 3.02Å; I29-W33 PolarHBondContact O-N 3.11Å
30	R	44.5	Very low	45.4	Very low	146 Å²	146	94.6 Å²	94.6	55%	0.551	49%	0.49	S	S	*	.	I	π-helix	trans	-62.7	-43.7	175.5	-74.8	179.4	-174	-157.8	6.7	111.5	E26 E27 L34	E26-R30 WeakPolarHBondContact O-CB 3.22Å; E26-R30 VanDerWaalsContact O-CG 3.25Å; E26-R30 WeakPolarHBondContact O-CG 3.44Å; E26-R30 PolarHBondContact O-N 2.83Å; E26-R30 IonicContact OE1-CZ 3.9Å; E26-R30 IonicContact OE1-NE 3.5Å; E26-R30 PolarHBondContact OE1-NE 3.35Å; E26-R30 IonicContact OE1-NH2 2.89Å; E26-R30 PolarHBondContact OE1-NH2 3.36Å; E27-R30 PolarHBondContact O-N 3.02Å; R30-L34 HydrophobicContact CB-CD1 4.4Å; R30-L34 HydrophobicContact CG-CD1 4.2Å; R30-L34 VanDerWaalsContact O-CB 3.3Å; R30-L34 WeakPolarHBondContact O-CB 3.32Å; R30-L34 PolarHBondContact O-N 3.43Å
31	T	49.4	Very low	45.6	Very low	73 Å²	73	96.3 Å²	96.3	45%	0.448	50%	0.5	S	S	.	.	I	π-helix	trans	-78.1	-32.8	-176.1	54.4	0	0	0	0	113.5	E27 V28 I29 N35	E27-T31 WeakPolarHBondContact O-CB 3.32Å; E27-T31 VanDerWaalsContact O-CG2 3.31Å; E27-T31 WeakPolarHBondContact O-CG2 3.24Å; E27-T31 PolarHBondContact O-N 3.3Å; E27-T31 PolarHBondContact O-OG1 2.91Å; V28-T31 PolarHBondContact O-N 3.49Å; V28-T31 PolarHBondContact O-OG1 3.49Å; I29-T31 PolarHBondContact O-N 3.41Å; T31-N35 VanDerWaalsContact O-CB 3.3Å; T31-N35 WeakPolarHBondContact O-CB 3.41Å
32	Q	48.7	Very low	45.1	Very low	122 Å²	122	97 Å²	97	57%	0.57	50%	0.501	S	S	*	.	I	π-helix	trans	-91.4	-39	-179.3	-70.8	-174	-8.2	0	0	113.8	V28 T36	V28-Q32 WeakPolarHBondContact O-CB 3.41Å; V28-Q32 PolarHBondContact O-N 3.17Å; Q32-T36 WeakPolarHBondContact O-CG2 3.42Å; Q32-T36 PolarHBondContact O-N 3.24Å; Q32-T36 PolarHBondContact O-OG1 3.31Å
33	W	44.9	Very low	44.8	Very low	205 Å²	205	103.6 Å²	103.6	78%	0.777	51%	0.511	S	S	*	.	I	π-helix	trans	-90.9	-30	-175.5	-79	62.7	0	0	0	113.9	I29	I29-W33 HydrophobicContact CG2-CB 4.38Å; I29-W33 VanDerWaalsContact O-CB 3.31Å; I29-W33 WeakPolarHBondContact O-CB 3.02Å; I29-W33 PolarHBondContact O-N 3.11Å
34	L	45.9	Very low	44.7	Very low	135 Å²	135	105.5 Å²	105.5	71%	0.707	52%	0.524	S	S	*	.	I	π-helix	trans	-90.7	-26.9	177.2	-65.7	162.8	0	0	0	112.7	R30	R30-L34 HydrophobicContact CB-CD1 4.4Å; R30-L34 HydrophobicContact CG-CD1 4.2Å; R30-L34 VanDerWaalsContact O-CB 3.3Å; R30-L34 WeakPolarHBondContact O-CB 3.32Å; R30-L34 PolarHBondContact O-N 3.43Å
35	N	41.8	Very low	44.5	Very low	115 Å²	115	109.8 Å²	109.8	62%	0.615	54%	0.544	S	S	*	.	S	Bend	trans	-99.2	6	178	-55.8	-26.4	0	0	0	114.2	T31 P37	T31-N35 VanDerWaalsContact O-CB 3.3Å; T31-N35 WeakPolarHBondContact O-CB 3.41Å; N35-P37 WeakPolarHBondContact O-CD 2.95Å
36	T	44.4	Very low	44	Very low	68 Å²	68	107.4 Å²	107.4	42%	0.417	54%	0.543	S	S	.	.	S	Bend	trans	-74.7	108.6	161.9	21.7	0	0	0	0	107.7	Q32 F38	Q32-T36 WeakPolarHBondContact O-CG2 3.42Å; Q32-T36 PolarHBondContact O-N 3.24Å; Q32-T36 PolarHBondContact O-OG1 3.31Å; T36-F38 PolarHBondContact O-N 2.95Å
37	P	41.3	Very low	43.6	Very low	83 Å²	83	108.3 Å²	108.3	54%	0.539	55%	0.551	S	S	.	*			trans	-58.7	135.2	168.6	25.1	-32.4	0	0	0	108.3	N35 S39 N40	N35-P37 WeakPolarHBondContact O-CD 2.95Å; P37-S39 PolarHBondContact O-N 3.31Å; P37-N40 PolarHBondContact O-N 3.28Å; P37-N40 VanDerWaalsContact O-N 3.12Å
38	F	43.1	Very low	43.3	Very low	134 Å²	134	111 Å²	111	59%	0.588	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	-14.1	179.9	-79.9	-86	0	0	0	113.1	T36 N40 V41 D42	T36-F38 PolarHBondContact O-N 2.95Å; F38-N40 PolarHBondContact O-N 3.18Å; F38-V41 HydrophobicContact CD1-CB 4.08Å; F38-V41 HydrophobicContact CD1-CG1 4.41Å; F38-V41 HydrophobicContact CD1-CG2 4.1Å; F38-V41 CarbonylContact O-C 3.56Å; F38-V41 WeakPolarHBondContact O-CA 3.47Å; F38-V41 WeakPolarHBondContact O-CB 3.45Å; F38-V41 PolarHBondContact O-N 3.13Å; F38-D42 WeakPolarHBondContact O-CB 3.47Å; F38-D42 PolarHBondContact O-N 3.26Å
39	S	41.5	Very low	42.7	Very low	69 Å²	69	113.7 Å²	113.7	48%	0.483	58%	0.575	S	S	.	*	H	α-helix	trans	-52.1	-28.9	171.8	64.9	0	0	0	0	113.9	P37 R43	P37-S39 PolarHBondContact O-N 3.31Å; S39-R43 PolarHBondContact O-N 3.06Å
40	N	39.5	Very low	42.4	Very low	93 Å²	93	114 Å²	114	50%	0.497	59%	0.585	S	S	.	*	H	α-helix	trans	-86.9	-23.6	175.2	-77.1	-10.6	0	0	0	113.5	P37 F38	P37-N40 PolarHBondContact O-N 3.28Å; P37-N40 VanDerWaalsContact O-N 3.12Å; F38-N40 PolarHBondContact O-N 3.18Å
41	V	45.9	Very low	42.3	Very low	58 Å²	58	113.7 Å²	113.7	35%	0.352	59%	0.592	S	S	.	*	H	α-helix	trans	-76.2	-38.5	170.9	-174.7	0	0	0	0	109.8	F38 R43 L44 I45	F38-V41 HydrophobicContact CD1-CB 4.08Å; F38-V41 HydrophobicContact CD1-CG1 4.41Å; F38-V41 HydrophobicContact CD1-CG2 4.1Å; F38-V41 CarbonylContact O-C 3.56Å; F38-V41 WeakPolarHBondContact O-CA 3.47Å; F38-V41 WeakPolarHBondContact O-CB 3.45Å; F38-V41 PolarHBondContact O-N 3.13Å; V41-R43 VanDerWaalsContact C-N 3.34Å; V41-R43 PolarHBondContact O-N 3.01Å; V41-L44 WeakPolarHBondContact O-CB 3.46Å; V41-L44 PolarHBondContact O-N 3.23Å; V41-L44 VanDerWaalsContact O-N 3.16Å; V41-I45 HydrophobicContact CG1-CD1 4.41Å; V41-I45 PolarHBondContact O-N 3.27Å
42	D	39	Very low	41.6	Very low	98 Å²	98	115 Å²	115	52%	0.524	60%	0.604	S	S	.	*	H	α-helix	trans	-66.5	-34	178.9	-65.8	-23.8	0	0	0	111.7	F38 L44 I45 G46	F38-D42 WeakPolarHBondContact O-CB 3.47Å; F38-D42 PolarHBondContact O-N 3.26Å; D42-L44 VanDerWaalsContact C-N 3.34Å; D42-L44 PolarHBondContact O-N 3.49Å; D42-I45 PolarHBondContact O-N 3.29Å; D42-G46 WeakPolarHBondContact O-CA 3.32Å; D42-G46 PolarHBondContact O-N 3.09Å
43	R	35.9	Very low	41.4	Very low	187 Å²	187	117.9 Å²	117.9	71%	0.706	62%	0.617	S	S	*	*	H	α-helix	trans	-66.3	-33.2	172.1	-100.2	-176	158.2	-169.3	-5.8	113.8	S39 V41 I45	S39-R43 PolarHBondContact O-N 3.06Å; V41-R43 VanDerWaalsContact C-N 3.34Å; V41-R43 PolarHBondContact O-N 3.01Å; R43-I45 VanDerWaalsContact C-N 3.3Å
44	L	44.2	Very low	41.3	Very low	147 Å²	147	115.7 Å²	115.7	77%	0.77	62%	0.621	S	S	*	*	H	α-helix	trans	-72.3	-28.3	178.8	-94.3	151.5	0	0	0	111.8	V41 D42	V41-L44 WeakPolarHBondContact O-CB 3.46Å; V41-L44 PolarHBondContact O-N 3.23Å; V41-L44 VanDerWaalsContact O-N 3.16Å; D42-L44 VanDerWaalsContact C-N 3.34Å; D42-L44 PolarHBondContact O-N 3.49Å
45	I	42.4	Very low	41.4	Very low	100 Å²	100	115.1 Å²	115.1	51%	0.513	63%	0.628	S	S	.	*	H	α-helix	trans	-88.3	-40.7	176.2	-63.9	169.8	0	0	0	110.5	V41 D42 R43 N47 I49	V41-I45 HydrophobicContact CG1-CD1 4.41Å; V41-I45 PolarHBondContact O-N 3.27Å; D42-I45 PolarHBondContact O-N 3.29Å; R43-I45 VanDerWaalsContact C-N 3.3Å; I45-N47 VanDerWaalsContact C-N 3.32Å; I45-N47 PolarHBondContact O-N 3.36Å; I45-I49 HydrophobicContact CG2-CD1 3.73Å; I45-I49 WeakPolarHBondContact O-CG1 3.48Å
46	G	38.1	Very low	41.2	Very low	45 Å²	45	117.6 Å²	117.6	46%	0.464	64%	0.641	S	S	.	*	H	α-helix	trans	-73.5	-7.8	-171.9	0	0	0	0	0	117	D42	D42-G46 WeakPolarHBondContact O-CA 3.32Å; D42-G46 PolarHBondContact O-N 3.09Å
47	N	38.1	Very low	41.1	Very low	121 Å²	121	117.7 Å²	117.7	65%	0.647	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	-13.8	179.9	-88.8	20	0	0	0	115.1	I45 S50	I45-N47 VanDerWaalsContact C-N 3.32Å; I45-N47 PolarHBondContact O-N 3.36Å; N47-S50 PolarHBondContact O-OG 3.41Å
48	E	41.5	Very low	41.1	Very low	183 Å²	183	119.7 Å²	119.7	86%	0.855	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-8.1	168.3	-91	-169.9	174.1	0	0	113.6	S50	E48-S50 PolarHBondContact O-N 3.2Å
49	I	39.7	Very low	40.8	Very low	115 Å²	115	117.4 Å²	117.4	59%	0.59	68%	0.678	S	S	*	*			trans	-73.2	37.5	152.6	-48	165.1	0	0	0	109.2	I45 M51	I45-I49 HydrophobicContact CG2-CD1 3.73Å; I45-I49 WeakPolarHBondContact O-CG1 3.48Å; I49-M51 PolarHBondContact O-N 3.45Å
50	S	41.4	Very low	40.6	Very low	96 Å²	96	120.3 Å²	120.3	67%	0.671	70%	0.695	S	S	*	*			trans	-73.3	66.9	161	-70.7	0	0	0	0	107.6	N47 E48	N47-S50 PolarHBondContact O-OG 3.41Å; E48-S50 PolarHBondContact O-N 3.2Å
51	M	41.2	Very low	40.8	Very low	141 Å²	141	125.3 Å²	125.3	70%	0.695	71%	0.712	S	S	*	*			trans	-154.9	97.1	175.5	-68.1	-66.2	-117.4	0	0	103.5	I49	I49-M51 PolarHBondContact O-N 3.45Å
52	S	36.3	Very low	40	Very low	101 Å²	101	130.7 Å²	130.7	71%	0.706	73%	0.734	S	S	*	*				54	107.9	86.5	72.3	0	0	0	0	110.1
53	E	44.4	Very low	39.9	Very low	182 Å²	182	133.3 Å²	133.3	85%	0.85	74%	0.744	S	S	*	*	S	Bend	trans	-51.5	141.7	-171.3	-65.3	158.9	155.1	0	0	112.4
54	D	41	Very low	39.9	Very low	158 Å²	158	129.4 Å²	129.4	85%	0.845	73%	0.734	S	S	*	*			trans	62.8	101.7	163	-50.2	-30.4	0	0	0	118.3
55	S	49.1	Very low	39.7	Very low	123 Å²	123	127 Å²	127	86%	0.86	72%	0.719	S	S	*	*			trans	-154.4	107.2	156.8	-165.9	0	0	0	0	111.2	G57	S55-G57 PolarHBondContact O-N 2.88Å
56	D	36.4	Very low	39.6	Very low	168 Å²	168	124.9 Å²	124.9	90%	0.898	71%	0.709	S	S	*	*			trans	-59.6	113.9	171.9	-94.4	-42.8	0	0	0	111.5	S58	D56-S58 PolarHBondContact O-N 3.09Å
57	G	43.2	Very low	39.8	Very low	69 Å²	69	124.8 Å²	124.8	71%	0.711	70%	0.696	S	S	*	*			trans	-77	105.4	164.4	0	0	0	0	0	111.4	S55	S55-G57 PolarHBondContact O-N 2.88Å
58	S	42.1	Very low	39.6	Very low	125 Å²	125	127.5 Å²	127.5	87%	0.874	71%	0.71	S	S	*	*				30.4	134.7	128.1	-85.3	0	0	0	0	121.9	D56	D56-S58 PolarHBondContact O-N 3.09Å
59	A	34.9	Very low	39.4	Very low	87 Å²	87	127 Å²	127	72%	0.719	71%	0.707	S	S	*	*			trans	-62.2	162.3	-179.5	0	0	0	0	0	118.1
60	P	38.6	Very low	39.5	Very low	129 Å²	129	128.6 Å²	128.6	84%	0.838	72%	0.717	S	S	*	*			trans	-96.2	155.7	178.9	37.4	-33.8	0	0	0	115.3
61	F	42.7	Very low	39.1	Very low	199 Å²	199	133 Å²	133	87%	0.873	73%	0.727	S	S	*	*			trans	-148.6	159.5	172.2	60.5	-92.7	0	0	0	110
62	E	29.5	Very low	38.7	Very low	170 Å²	170	134.7 Å²	134.7	79%	0.794	73%	0.731	S	S	*	*			cis	-165	165.7	-31	-161.5	-176	-169.2	0	0	107.8
63	M	36.4	Very low	38.8	Very low	153 Å²	153	136 Å²	136	75%	0.754	74%	0.735	S	S	*	*			trans	87.5	144.5	158.7	-66.8	-159.6	-78.1	0	0	120.7
64	E	36.2	Very low	38.2	Very low	105 Å²	105	136.8 Å²	136.8	49%	0.491	73%	0.731	S	S	.	*			cis	-169.5	119	-17.7	-114.1	-158.5	160.1	0	0	109.1	R97 Y99	E64-R97 IonicContact OE1-NH2 3.19Å; E64-R97 IonicContact OE2-CZ 2.63Å; E64-R97 VanDerWaalsContact OE2-CZ 3.22Å; E64-R97 IonicContact OE2-NH1 3.58Å; E64-R97 PolarHBondContact OE2-NH1 3.09Å; E64-R97 IonicContact OE2-NH2 2.98Å; E64-R97 PolarHBondContact OE2-NH2 3Å; E64-Y99 WeakPolarHBondContact OE1-CE1 3.29Å
65	E	39.6	Very low	37.8	Very low	97 Å²	97	133 Å²	133	45%	0.453	72%	0.722	S	S	.	*			trans	-95.5	142.7	174.8	-90.9	-178.3	126	0	0	111.5	R97 R113 K117	E65-R97 PolarHBondContact O-NE 3.04Å; E65-R97 PolarHBondContact O-NH2 3.47Å; E65-R113 IonicContact OE1-CZ 2.88Å; E65-R113 IonicContact OE1-NE 3.52Å; E65-R113 IonicContact OE1-NH2 3.2Å; E65-R113 PolarHBondContact OE1-NH2 2.82Å; E65-R113 VanDerWaalsContact OE1-NH2 3.08Å; E65-R113 IonicContact OE2-CZ 2.63Å; E65-R113 IonicContact OE2-NE 3.2Å; E65-R113 PolarHBondContact OE2-NE 3.06Å; E65-R113 IonicContact OE2-NH1 3.01Å; E65-R113 PolarHBondContact OE2-NH1 2.88Å; E65-R113 IonicContact OE2-NH2 2.71Å; E65-R113 PolarHBondContact OE2-NH2 2.87Å; E65-K117 IonicContact OE1-NZ 3.22Å; E65-K117 PolarHBondContact OE1-NZ 3.08Å; E65-K117 IonicContact OE2-NZ 3.26Å; E65-K117 PolarHBondContact OE2-NZ 3.37Å
66	D	41.2	Very low	37.1	Very low	55 Å²	55	134 Å²	134	29%	0.294	72%	0.718	S	S	.	*			trans	151.3	135	142.3	-72.5	-8.6	0	0	0	109.3	R97 R113	D66-R97 HydrophobicContact CB-CB 3.87Å; D66-R97 HydrophobicContact CB-CG 3.56Å; D66-R97 VanDerWaalsContact O-CD 3.3Å; D66-R97 WeakPolarHBondContact O-CD 3.3Å; D66-R97 WeakPolarHBondContact O-CG 3.34Å; D66-R113 IonicContact OD1-CZ 3.43Å; D66-R113 IonicContact OD1-NH1 3.84Å; D66-R113 PolarHBondContact OD1-NH1 3.41Å; D66-R113 IonicContact OD1-NH2 2.7Å; D66-R113 PolarHBondContact OD1-NH2 2.63Å
67	Q	41.7	Very low	37	Very low	43 Å²	43	134.4 Å²	134.4	20%	0.201	71%	0.714	C	S	.	*			cis	-144.7	150	13.6	-22.7	72.9	49	0	0	113.9	R93 R94 N96	Q67-R93 PolarHBondContact OE1-O 3.28Å; Q67-R94 PolarHBondContact NE2-O 3.39Å; Q67-N96 HydrophobicContact CG-CB 3.6Å; Q67-N96 WeakPolarHBondContact CG-O 3.16Å
68	L	35.4	Very low	36.7	Very low	179 Å²	179	137.9 Å²	137.9	94%	0.937	72%	0.716	S	S	*	*			trans	-120.9	103.9	143.8	-78.6	163.5	0	0	0	106.1
69	E	37.1	Very low	36.3	Very low	171 Å²	171	141.1 Å²	141.1	80%	0.799	72%	0.717	S	S	*	*			trans	-161.5	100.3	152.1	-116.2	173.3	-152.8	0	0	106.7
70	N	41.3	Very low	36.5	Very low	149 Å²	149	143.6 Å²	143.6	80%	0.797	72%	0.723	S	S	*	*			trans	-167.2	73.8	149.9	-95	-1.9	0	0	0	108
71	E	32.4	Very low	36.4	Very low	188 Å²	188	146.2 Å²	146.2	88%	0.879	73%	0.725	S	S	*	*			trans	-82.2	106.6	150.1	178.9	-177.8	-164.9	0	0	106.2
72	K	33.5	Very low	36.1	Very low	177 Å²	177	145 Å²	145	77%	0.77	73%	0.727	S	S	*	*			trans	169.1	96.2	151.8	-100.8	174.7	176.4	-176.5	0	111.9
73	T	37.8	Very low	36.8	Very low	130 Å²	130	140.5 Å²	140.5	80%	0.798	72%	0.719	S	S	*	*			trans	-157.6	96.7	147	-5.7	0	0	0	0	105.8
74	Y	33.1	Very low	36.9	Very low	198 Å²	198	140.2 Å²	140.2	78%	0.776	72%	0.72	S	S	*	*				58	103.3	106.8	-64.8	-68.8	0	0	0	110.9
75	A	32.3	Very low	37	Very low	77 Å²	77	143.8 Å²	143.8	64%	0.636	74%	0.742	S	S	*	*				86.7	134.3	85.5	0	0	0	0	0	110.9
76	D	32.9	Very low	37.1	Very low	146 Å²	146	147.9 Å²	147.9	78%	0.781	76%	0.758	S	S	*	*			trans	74	103.6	167.2	-47	-22.6	0	0	0	115.6
77	E	35.2	Very low	37.2	Very low	176 Å²	176	153.3 Å²	153.3	82%	0.822	78%	0.782	S	S	*	*				81.4	135	97.9	-60.6	-138.2	157.5	0	0	112.1
78	D	36.5	Very low	37	Very low	141 Å²	141	154.6 Å²	154.6	75%	0.754	80%	0.8	S	S	*	*			trans	82.3	108.7	171.4	-55.9	-21.2	0	0	0	120.8
79	E	34.1	Very low	37.4	Very low	193 Å²	193	153.2 Å²	153.2	90%	0.902	79%	0.792	S	S	*	*			trans	10.5	106.8	143.3	-74.2	178.9	154.3	0	0	117.9
80	V	38.4	Very low	37.4	Very low	139 Å²	139	151.5 Å²	151.5	84%	0.842	79%	0.786	S	S	*	*			trans	-136.6	131.7	148.9	-163.1	0	0	0	0	109.5
81	Q	36.5	Very low	37.3	Very low	185 Å²	185	152.1 Å²	152.1	86%	0.864	78%	0.784	S	S	*	*			trans	-65.5	138.4	-166	-68.7	158.8	-12.7	0	0	113.6	A83	Q81-A83 PolarHBondContact O-N 2.98Å; Q81-A83 VanDerWaalsContact O-N 3.14Å
82	D	37	Very low	38	Very low	173 Å²	173	148.6 Å²	148.6	93%	0.925	78%	0.777	S	S	*	*			trans	-77.5	81.5	172.4	-70.2	-40.3	0	0	0	111.2
83	A	44.4	Very low	38.6	Very low	76 Å²	76	148.3 Å²	148.3	63%	0.628	77%	0.771	S	S	*	*			trans	-156	128.6	158.4	0	0	0	0	0	109.4	Q81	Q81-A83 PolarHBondContact O-N 2.98Å; Q81-A83 VanDerWaalsContact O-N 3.14Å
84	D	37.9	Very low	39.2	Very low	146 Å²	146	150.9 Å²	150.9	78%	0.781	77%	0.766	S	S	*	*			trans	103	17.6	165.2	-51.2	-23.7	0	0	0	120	K86	D84-K86 PolarHBondContact O-N 3.33Å
85	L	39.8	Very low	40	Very low	180 Å²	180	148.8 Å²	148.8	94%	0.942	76%	0.761	S	S	*	*			trans	-83.3	59.1	156.2	-85.6	129	0	0	0	111.5	E87	L85-E87 PolarHBondContact O-N 3.18Å
86	K	40.5	Very low	41.1	Very low	183 Å²	183	149.4 Å²	149.4	80%	0.796	75%	0.754	S	S	*	*			trans	-71.3	119.7	159.3	-83.7	-179.2	176.8	174.1	0	108.7	D84 A88	D84-K86 PolarHBondContact O-N 3.33Å; K86-A88 PolarHBondContact O-N 2.84Å
87	E	42.9	Very low	42.3	Very low	169 Å²	169	144.4 Å²	144.4	79%	0.79	72%	0.724	S	S	*	*			trans	67.6	36.2	141.1	-143.6	166	-151	0	0	118.2	L85 I89	L85-E87 PolarHBondContact O-N 3.18Å; E87-I89 PolarHBondContact O-N 3.49Å
88	A	37.4	Very low	43.6	Very low	71 Å²	71	143 Å²	143	59%	0.587	72%	0.721	S	S	*	*			trans	-71.6	98.4	153	0	0	0	0	0	108.4	K86 M90	K86-A88 PolarHBondContact O-N 2.84Å; A88-M90 HydrophobicContact CB-CG 3.88Å; A88-M90 PolarHBondContact O-N 3.18Å
89	I	45.3	Very low	45.2	Very low	150 Å²	150	143.2 Å²	143.2	77%	0.769	71%	0.713	S	S	*	*			trans	-58.9	76.7	164.2	-60.5	167.2	0	0	0	107.5	E87 Q91	E87-I89 PolarHBondContact O-N 3.49Å; I89-Q91 PolarHBondContact O-N 3.1Å
90	M	37.1	Very low	47	Very low	134 Å²	134	137 Å²	137	66%	0.66	69%	0.685	S	S	*	*			trans	-84.7	94.4	-178.3	-75.6	-162.4	67.6	0	0	109.5	A88	A88-M90 HydrophobicContact CB-CG 3.88Å; A88-M90 PolarHBondContact O-N 3.18Å
91	Q	38.4	Very low	48.7	Very low	163 Å²	163	142.4 Å²	142.4	76%	0.762	69%	0.69	S	S	*	*			trans	-46.8	126.9	160.3	-72.4	-89.6	-7	0	0	109.6	I89 R93	I89-Q91 PolarHBondContact O-N 3.1Å; Q91-R93 PolarHBondContact O-N 3.45Å
92	P	47.8	Very low	51	Low	113 Å²	113	138.1 Å²	138.1	73%	0.734	67%	0.673	S	S	*	*			trans	-57.9	123.2	-178.3	-22.4	31.3	0	0	0	111.1	R94	P92-R94 PolarHBondContact O-N 3.26Å
93	R	45.9	Very low	53	Low	171 Å²	171	133.7 Å²	133.7	65%	0.645	66%	0.66	S	S	*	*			trans	-62.1	95.6	-176.2	-66.1	170.8	76.4	147.1	0.3	111.1	Q67 Q91 K95	Q67-R93 PolarHBondContact OE1-O 3.28Å; Q91-R93 PolarHBondContact O-N 3.45Å; R93-K95 HydrophobicContact CB-CG 4.36Å; R93-K95 PolarHBondContact O-N 3.02Å
94	R	48.8	Very low	54.8	Low	184 Å²	184	133.2 Å²	133.2	69%	0.694	66%	0.657	S	S	*	*			trans	-66.6	32.6	173	-68.2	177.5	131.7	-170.7	-3.3	115.3	Q67 P92 N96	Q67-R94 PolarHBondContact NE2-O 3.39Å; P92-R94 PolarHBondContact O-N 3.26Å; R94-N96 PolarHBondContact O-N 3.39Å
95	K	51.7	Low	56.9	Low	154 Å²	154	130 Å²	130	67%	0.67	64%	0.639	S	S	*	*			trans	-81.1	-6.7	-160.9	-67	-163.5	176	-167.6	0	122	R93	R93-K95 HydrophobicContact CB-CG 4.36Å; R93-K95 PolarHBondContact O-N 3.02Å
96	N	54.5	Low	58.8	Low	90 Å²	90	123.1 Å²	123.1	48%	0.481	61%	0.608	S	S	.	*			trans	-141.4	43	-171.2	-70.6	-8.5	0	0	0	116.4	Q67 R94 L98	Q67-N96 HydrophobicContact CG-CB 3.6Å; Q67-N96 WeakPolarHBondContact CG-O 3.16Å; R94-N96 PolarHBondContact O-N 3.39Å; N96-L98 PolarHBondContact O-N 3.46Å
97	R	59	Low	60.7	Low	41 Å²	41	119.5 Å²	119.5	16%	0.155	59%	0.594	C	S	.	*			trans	-73.3	115.6	-178.2	-60.4	-165.3	62	-177.5	-14.6	106.8	E64 E65 D66 Y99	E64-R97 IonicContact OE1-NH2 3.19Å; E64-R97 IonicContact OE2-CZ 2.63Å; E64-R97 VanDerWaalsContact OE2-CZ 3.22Å; E64-R97 IonicContact OE2-NH1 3.58Å; E64-R97 PolarHBondContact OE2-NH1 3.09Å; E64-R97 IonicContact OE2-NH2 2.98Å; E64-R97 PolarHBondContact OE2-NH2 3Å; E65-R97 PolarHBondContact O-NE 3.04Å; E65-R97 PolarHBondContact O-NH2 3.47Å; D66-R97 HydrophobicContact CB-CB 3.87Å; D66-R97 HydrophobicContact CB-CG 3.56Å; D66-R97 VanDerWaalsContact O-CD 3.3Å; D66-R97 WeakPolarHBondContact O-CD 3.3Å; D66-R97 WeakPolarHBondContact O-CG 3.34Å; R97-Y99 HydrophobicContact CB-CD2 4.08Å; R97-Y99 HydrophobicContact CB-CE2 3.59Å; R97-Y99 HydrophobicContact CG-CE2 4.47Å; R97-Y99 WeakPolarHBondContact O-CD2 3.42Å; R97-Y99 PolarHBondContact O-N 3.44Å; R97-Y99 VanDerWaalsContact O-N 3.1Å
98	L	61.4	Low	62.8	Low	147 Å²	147	119.2 Å²	119.2	77%	0.77	59%	0.59	S	S	*	*			trans	-81.6	92.4	176.2	-70.8	172.7	0	0	0	108	N96 I100	N96-L98 PolarHBondContact O-N 3.46Å; L98-I100 PolarHBondContact O-N 3.27Å
99	Y	69.4	Low	65	Low	146 Å²	146	122 Å²	122	57%	0.573	59%	0.587	S	S	*	*			trans	-70.7	109.7	172.5	-69.8	-81.7	0	0	0	109.5	E64 R97 R101	E64-Y99 WeakPolarHBondContact OE1-CE1 3.29Å; R97-Y99 HydrophobicContact CB-CD2 4.08Å; R97-Y99 HydrophobicContact CB-CE2 3.59Å; R97-Y99 HydrophobicContact CG-CE2 4.47Å; R97-Y99 WeakPolarHBondContact O-CD2 3.42Å; R97-Y99 PolarHBondContact O-N 3.44Å; R97-Y99 VanDerWaalsContact O-N 3.1Å; Y99-R101 PolarHBondContact O-N 2.79Å
100	I	73	Confident	66.9	Low	61 Å²	61	117.6 Å²	117.6	31%	0.313	57%	0.573	S	S	.	*			trans	-78.5	105.3	170.7	-62.9	168.4	0	0	0	107.1	L98 N102 L105 A106 Y109	L98-I100 PolarHBondContact O-N 3.27Å; I100-N102 WeakPolarHBondContact CG2-O 3.42Å; I100-N102 PolarHBondContact O-N 3.22Å; I100-L105 HydrophobicContact CB-CD2 4.42Å; I100-L105 HydrophobicContact CD1-CD2 4.16Å; I100-L105 HydrophobicContact CG1-CD2 4.2Å; I100-L105 HydrophobicContact CG2-CB 3.71Å; I100-L105 HydrophobicContact CG2-CD2 3.37Å; I100-L105 HydrophobicContact CG2-CG 4.1Å; I100-A106 HydrophobicContact CB-CB 4.09Å; I100-A106 HydrophobicContact CG2-CB 4Å; I100-Y109 HydrophobicContact CD1-CD1 4.42Å; I100-Y109 HydrophobicContact CD1-CD2 3.71Å; I100-Y109 HydrophobicContact CD1-CE2 4.41Å; I100-Y109 HydrophobicContact CD1-CG 3.71Å
101	R	74.1	Confident	69.3	Low	253 Å²	253	117.5 Å²	117.5	96%	0.955	57%	0.568	S	S	*	*	S	Bend	trans	-63.4	-27.1	179.6	-74.6	-174.9	177.4	159.7	-0.9	113.7	Y99	Y99-R101 PolarHBondContact O-N 2.79Å
102	N	84.2	Confident	71.7	Confident	96 Å²	96	116.7 Å²	116.7	51%	0.513	56%	0.562	S	S	.	*			trans	-89.8	114.6	-179.5	-175.9	-25.4	0	0	0	110.7	I100 A104 L105 A106	I100-N102 WeakPolarHBondContact CG2-O 3.42Å; I100-N102 PolarHBondContact O-N 3.22Å; N102-A104 VanDerWaalsContact C-N 3.32Å; N102-A104 PolarHBondContact O-N 2.99Å; N102-A104 WeakPolarHBondContact OD1-CB 3.37Å; N102-A104 PolarHBondContact OD1-N 2.83Å; N102-L105 HydrophobicContact CB-CB 4.04Å; N102-L105 PolarHBondContact O-N 3.32Å; N102-L105 VanDerWaalsContact O-N 3.11Å; N102-A106 PolarHBondContact O-N 2.9Å
103	A	79.3	Confident	73.6	Confident	79 Å²	79	116.1 Å²	116.1	65%	0.653	55%	0.546	S	S	*	.	H	α-helix	trans	-55.7	-41.6	-179	0	0	0	0	0	113.3	L105 A106 E107	A103-L105 VanDerWaalsContact C-N 3.33Å; A103-L105 PolarHBondContact O-N 2.93Å; A103-A106 WeakPolarHBondContact O-CB 3.34Å; A103-A106 PolarHBondContact O-N 2.98Å; A103-A106 VanDerWaalsContact O-N 3.17Å; A103-E107 PolarHBondContact O-N 3.45Å
104	A	82.7	Confident	75.6	Confident	67 Å²	67	113.2 Å²	113.2	55%	0.554	54%	0.542	S	S	*	.	H	α-helix	trans	-65.1	-38.6	179	0	0	0	0	0	111.9	N102 K108	N102-A104 VanDerWaalsContact C-N 3.32Å; N102-A104 PolarHBondContact O-N 2.99Å; N102-A104 WeakPolarHBondContact OD1-CB 3.37Å; N102-A104 PolarHBondContact OD1-N 2.83Å; A104-K108 PolarHBondContact O-N 3.45Å
105	L	81.1	Confident	77.6	Confident	79 Å²	79	107.1 Å²	107.1	41%	0.414	53%	0.531	S	S	.	.	H	α-helix	trans	-69	-39.6	174.7	-161	114.1	0	0	0	110.4	I100 N102 A103 E107 K108 Y109	I100-L105 HydrophobicContact CB-CD2 4.42Å; I100-L105 HydrophobicContact CD1-CD2 4.16Å; I100-L105 HydrophobicContact CG1-CD2 4.2Å; I100-L105 HydrophobicContact CG2-CB 3.71Å; I100-L105 HydrophobicContact CG2-CD2 3.37Å; I100-L105 HydrophobicContact CG2-CG 4.1Å; N102-L105 HydrophobicContact CB-CB 4.04Å; N102-L105 PolarHBondContact O-N 3.32Å; N102-L105 VanDerWaalsContact O-N 3.11Å; A103-L105 VanDerWaalsContact C-N 3.33Å; A103-L105 PolarHBondContact O-N 2.93Å; L105-E107 PolarHBondContact O-N 3.35Å; L105-K108 PolarHBondContact O-N 3.48Å; L105-Y109 HydrophobicContact CD2-CD2 3.81Å; L105-Y109 HydrophobicContact CD2-CE2 3.61Å; L105-Y109 HydrophobicContact CG-CD2 3.97Å; L105-Y109 HydrophobicContact CG-CE2 3.94Å; L105-Y109 VanDerWaalsContact O-CD2 3.32Å; L105-Y109 WeakPolarHBondContact O-CD2 3.49Å; L105-Y109 PolarHBondContact O-N 2.95Å
106	A	79.3	Confident	79.4	Confident	35 Å²	35	102.1 Å²	102.1	29%	0.289	52%	0.516	S	S	.	.	H	α-helix	trans	-61.5	-44.8	179.1	0	0	0	0	0	111.9	I100 N102 A103 Y109 A110	I100-A106 HydrophobicContact CB-CB 4.09Å; I100-A106 HydrophobicContact CG2-CB 4Å; N102-A106 PolarHBondContact O-N 2.9Å; A103-A106 WeakPolarHBondContact O-CB 3.34Å; A103-A106 PolarHBondContact O-N 2.98Å; A103-A106 VanDerWaalsContact O-N 3.17Å; A106-Y109 PolarHBondContact O-N 2.83Å; A106-A110 WeakPolarHBondContact O-CB 3.39Å; A106-A110 PolarHBondContact O-N 3.19Å
107	E	80.8	Confident	81.1	Confident	107 Å²	107	101.9 Å²	101.9	50%	0.5	51%	0.51	S	S	.	.	H	α-helix	trans	-62.4	-44.6	176.9	-166.5	-167.2	164	0	0	111.7	A103 L105 Y109 A110 K111	A103-E107 PolarHBondContact O-N 3.45Å; L105-E107 PolarHBondContact O-N 3.35Å; E107-Y109 VanDerWaalsContact C-N 3.31Å; E107-Y109 PolarHBondContact O-N 3.2Å; E107-A110 PolarHBondContact O-N 3.26Å; E107-K111 WeakPolarHBondContact O-CG 3.47Å; E107-K111 PolarHBondContact O-N 3.03Å; E107-K111 WeakPolarHBondContact OE1-CE 3.47Å; E107-K111 IonicContact OE1-NZ 3.75Å; E107-K111 PolarHBondContact OE1-NZ 2.88Å
108	K	86.8	Confident	82.6	Confident	163 Å²	163	104 Å²	104	71%	0.709	52%	0.524	S	S	*	.	H	α-helix	trans	-59	-43	176.2	-172.2	175.6	-177.9	174.4	0	111.6	A104 L105 K112	A104-K108 PolarHBondContact O-N 3.45Å; L105-K108 PolarHBondContact O-N 3.48Å; K108-K112 WeakPolarHBondContact O-CB 3.36Å; K108-K112 PolarHBondContact O-N 3.48Å; K108-K112 VanDerWaalsContact O-N 3.09Å
109	Y	85.3	Confident	84	Confident	130 Å²	130	103.6 Å²	103.6	51%	0.51	52%	0.516	S	S	.	.	H	α-helix	trans	-67.4	-39.9	175.5	-91.9	-89.5	0	0	0	112.4	I100 L105 A106 E107 K112 R113	I100-Y109 HydrophobicContact CD1-CD1 4.42Å; I100-Y109 HydrophobicContact CD1-CD2 3.71Å; I100-Y109 HydrophobicContact CD1-CE2 4.41Å; I100-Y109 HydrophobicContact CD1-CG 3.71Å; L105-Y109 HydrophobicContact CD2-CD2 3.81Å; L105-Y109 HydrophobicContact CD2-CE2 3.61Å; L105-Y109 HydrophobicContact CG-CD2 3.97Å; L105-Y109 HydrophobicContact CG-CE2 3.94Å; L105-Y109 VanDerWaalsContact O-CD2 3.32Å; L105-Y109 WeakPolarHBondContact O-CD2 3.49Å; L105-Y109 PolarHBondContact O-N 2.95Å; A106-Y109 PolarHBondContact O-N 2.83Å; E107-Y109 VanDerWaalsContact C-N 3.31Å; E107-Y109 PolarHBondContact O-N 3.2Å; Y109-K112 PolarHBondContact O-N 2.87Å; Y109-R113 WeakPolarHBondContact O-CB 3.34Å; Y109-R113 PolarHBondContact O-N 3.01Å
110	A	83.7	Confident	84.8	Confident	57 Å²	57	105.6 Å²	105.6	47%	0.471	52%	0.523	S	S	.	.	H	α-helix	trans	-62.3	-46.8	177	0	0	0	0	0	111.8	A106 E107 K112 R113 L114	A106-A110 WeakPolarHBondContact O-CB 3.39Å; A106-A110 PolarHBondContact O-N 3.19Å; E107-A110 PolarHBondContact O-N 3.26Å; A110-K112 PolarHBondContact O-N 3.47Å; A110-R113 PolarHBondContact O-N 3.05Å; A110-L114 WeakPolarHBondContact O-CB 3.45Å; A110-L114 PolarHBondContact O-N 3.11Å
111	K	87.5	Confident	85.2	Confident	132 Å²	132	111.4 Å²	111.4	57%	0.574	54%	0.541	S	S	*	.	H	α-helix	trans	-58.5	-46.2	174.1	-72.4	179	-178	170.1	0	111.3	E107 R113 L114 A115	E107-K111 WeakPolarHBondContact O-CG 3.47Å; E107-K111 PolarHBondContact O-N 3.03Å; E107-K111 WeakPolarHBondContact OE1-CE 3.47Å; E107-K111 IonicContact OE1-NZ 3.75Å; E107-K111 PolarHBondContact OE1-NZ 2.88Å; K111-R113 PolarHBondContact O-N 3.27Å; K111-L114 PolarHBondContact O-N 2.95Å; K111-A115 WeakPolarHBondContact O-CB 3.45Å; K111-A115 PolarHBondContact O-N 2.63Å
112	K	90.6	Very high	85.8	Confident	145 Å²	145	105 Å²	105	63%	0.63	52%	0.521	S	S	*	.	H	α-helix	trans	-62.5	-40.1	176.7	-171.2	177	-179.8	179.7	0	112.5	K108 Y109 A110 S116	K108-K112 WeakPolarHBondContact O-CB 3.36Å; K108-K112 PolarHBondContact O-N 3.48Å; K108-K112 VanDerWaalsContact O-N 3.09Å; Y109-K112 PolarHBondContact O-N 2.87Å; A110-K112 PolarHBondContact O-N 3.47Å; K112-S116 VanDerWaalsContact O-CB 3.32Å; K112-S116 WeakPolarHBondContact O-CB 3.44Å; K112-S116 PolarHBondContact O-N 3.24Å; K112-S116 PolarHBondContact O-OG 2.71Å
113	R	87.1	Confident	85.6	Confident	102 Å²	102	105.2 Å²	105.2	39%	0.385	52%	0.522	S	S	.	.	H	α-helix	trans	-65.5	-44.2	177	-171.9	-179.4	-175.5	168.2	5.2	111	E65 D66 Y109 A110 K111 S116 K117	E65-R113 IonicContact OE1-CZ 2.88Å; E65-R113 IonicContact OE1-NE 3.52Å; E65-R113 IonicContact OE1-NH2 3.2Å; E65-R113 PolarHBondContact OE1-NH2 2.82Å; E65-R113 VanDerWaalsContact OE1-NH2 3.08Å; E65-R113 IonicContact OE2-CZ 2.63Å; E65-R113 IonicContact OE2-NE 3.2Å; E65-R113 PolarHBondContact OE2-NE 3.06Å; E65-R113 IonicContact OE2-NH1 3.01Å; E65-R113 PolarHBondContact OE2-NH1 2.88Å; E65-R113 IonicContact OE2-NH2 2.71Å; E65-R113 PolarHBondContact OE2-NH2 2.87Å; D66-R113 IonicContact OD1-CZ 3.43Å; D66-R113 IonicContact OD1-NH1 3.84Å; D66-R113 PolarHBondContact OD1-NH1 3.41Å; D66-R113 IonicContact OD1-NH2 2.7Å; D66-R113 PolarHBondContact OD1-NH2 2.63Å; Y109-R113 WeakPolarHBondContact O-CB 3.34Å; Y109-R113 PolarHBondContact O-N 3.01Å; A110-R113 PolarHBondContact O-N 3.05Å; K111-R113 PolarHBondContact O-N 3.27Å; R113-S116 WeakPolarHBondContact O-CB 3.42Å; R113-S116 PolarHBondContact O-N 2.88Å; R113-K117 WeakPolarHBondContact O-CG 3.22Å; R113-K117 PolarHBondContact O-N 3.2Å
114	L	88.5	Confident	85.7	Confident	110 Å²	110	108 Å²	108	58%	0.576	52%	0.519	S	S	*	.	H	α-helix	trans	-65.7	-47.7	178.4	-174.4	135.8	0	0	0	111.7	A110 K111 S116 K117 L118	A110-L114 WeakPolarHBondContact O-CB 3.45Å; A110-L114 PolarHBondContact O-N 3.11Å; K111-L114 PolarHBondContact O-N 2.95Å; L114-S116 VanDerWaalsContact C-N 3.26Å; L114-S116 PolarHBondContact O-N 2.88Å; L114-K117 PolarHBondContact O-N 3.18Å; L114-K117 VanDerWaalsContact O-N 3.11Å; L114-L118 HydrophobicContact CD2-CD1 3.68Å; L114-L118 HydrophobicContact CD2-CG 4.33Å; L114-L118 WeakPolarHBondContact O-CG 3.28Å; L114-L118 PolarHBondContact O-N 3.34Å
115	A	89.4	Confident	85.5	Confident	56 Å²	56	107.3 Å²	107.3	46%	0.463	51%	0.513	S	S	.	.	H	α-helix	trans	-56.8	-41.7	174.1	0	0	0	0	0	111.5	K111 L118 K119	K111-A115 WeakPolarHBondContact O-CB 3.45Å; K111-A115 PolarHBondContact O-N 2.63Å; A115-L118 PolarHBondContact O-N 3.31Å; A115-K119 WeakPolarHBondContact O-CB 3.48Å; A115-K119 PolarHBondContact O-N 2.88Å
116	S	89.7	Confident	85.2	Confident	49 Å²	49	109 Å²	109	34%	0.343	52%	0.519	S	S	.	.	H	α-helix	trans	-65.1	-42.4	175.4	-62.5	0	0	0	0	112.7	K112 R113 L114 K119 R120	K112-S116 VanDerWaalsContact O-CB 3.32Å; K112-S116 WeakPolarHBondContact O-CB 3.44Å; K112-S116 PolarHBondContact O-N 3.24Å; K112-S116 PolarHBondContact O-OG 2.71Å; R113-S116 WeakPolarHBondContact O-CB 3.42Å; R113-S116 PolarHBondContact O-N 2.88Å; L114-S116 VanDerWaalsContact C-N 3.26Å; L114-S116 PolarHBondContact O-N 2.88Å; S116-K119 PolarHBondContact O-N 2.91Å; S116-R120 WeakPolarHBondContact O-CG 3.37Å; S116-R120 PolarHBondContact O-N 3.08Å
117	K	91.2	Very high	84.9	Confident	84 Å²	84	110.9 Å²	110.9	37%	0.365	53%	0.53	S	S	.	.	H	α-helix	trans	-61.4	-44.6	174.9	-79.8	177.1	176.5	174.5	0	110.8	E65 R113 L114 R120 R121	E65-K117 IonicContact OE1-NZ 3.22Å; E65-K117 PolarHBondContact OE1-NZ 3.08Å; E65-K117 IonicContact OE2-NZ 3.26Å; E65-K117 PolarHBondContact OE2-NZ 3.37Å; R113-K117 WeakPolarHBondContact O-CG 3.22Å; R113-K117 PolarHBondContact O-N 3.2Å; L114-K117 PolarHBondContact O-N 3.18Å; L114-K117 VanDerWaalsContact O-N 3.11Å; K117-R120 PolarHBondContact O-N 3.13Å; K117-R121 WeakPolarHBondContact O-CG 3.33Å; K117-R121 PolarHBondContact O-N 3.48Å
118	L	90.6	Very high	84.1	Confident	87 Å²	87	112 Å²	112	46%	0.455	53%	0.533	S	S	.	.	H	α-helix	trans	-64.2	-45.9	177	-70.9	177.7	0	0	0	111.9	L114 A115 R120 R121 Q122	L114-L118 HydrophobicContact CD2-CD1 3.68Å; L114-L118 HydrophobicContact CD2-CG 4.33Å; L114-L118 WeakPolarHBondContact O-CG 3.28Å; L114-L118 PolarHBondContact O-N 3.34Å; A115-L118 PolarHBondContact O-N 3.31Å; L118-R120 VanDerWaalsContact C-N 3.33Å; L118-R120 PolarHBondContact O-N 3.06Å; L118-R121 WeakPolarHBondContact O-CB 3.45Å; L118-R121 PolarHBondContact O-N 3.2Å; L118-R121 VanDerWaalsContact O-N 3.07Å; L118-Q122 WeakPolarHBondContact O-CG 3.3Å; L118-Q122 PolarHBondContact O-N 3.2Å
119	K	90	Very high	82.9	Confident	137 Å²	137	112.6 Å²	112.6	60%	0.596	53%	0.531	S	S	*	.	H	α-helix	trans	-58.2	-43.7	175.2	-172.6	172.8	-176	173	0	111.7	A115 S116 R121 Q122 I123	A115-K119 WeakPolarHBondContact O-CB 3.48Å; A115-K119 PolarHBondContact O-N 2.88Å; S116-K119 PolarHBondContact O-N 2.91Å; K119-R121 PolarHBondContact O-N 2.95Å; K119-Q122 PolarHBondContact O-N 3.42Å; K119-I123 HydrophobicContact CG-CD1 3.96Å; K119-I123 WeakPolarHBondContact O-CB 3.29Å; K119-I123 WeakPolarHBondContact O-CG1 3.48Å; K119-I123 PolarHBondContact O-N 3.39Å
120	R	85.4	Confident	81.6	Confident	189 Å²	189	115 Å²	115	71%	0.713	54%	0.539	S	S	*	.	H	α-helix	trans	-62.3	-40.6	174.1	-72.4	-176.3	-149.2	-142.4	8.2	112.1	S116 K117 L118 I123 K124	S116-R120 WeakPolarHBondContact O-CG 3.37Å; S116-R120 PolarHBondContact O-N 3.08Å; K117-R120 PolarHBondContact O-N 3.13Å; L118-R120 VanDerWaalsContact C-N 3.33Å; L118-R120 PolarHBondContact O-N 3.06Å; R120-I123 PolarHBondContact O-N 3.2Å; R120-K124 VanDerWaalsContact O-CB 3.28Å; R120-K124 WeakPolarHBondContact O-CB 3.18Å; R120-K124 PolarHBondContact O-N 2.93Å
121	R	82.7	Confident	80.2	Confident	182 Å²	182	115.4 Å²	115.4	69%	0.687	54%	0.538	S	S	*	.	H	α-helix	trans	-65.2	-43	176.8	-74.7	177.1	178.3	-170.7	0.8	111.9	K117 L118 K119 K124 A125	K117-R121 WeakPolarHBondContact O-CG 3.33Å; K117-R121 PolarHBondContact O-N 3.48Å; L118-R121 WeakPolarHBondContact O-CB 3.45Å; L118-R121 PolarHBondContact O-N 3.2Å; L118-R121 VanDerWaalsContact O-N 3.07Å; K119-R121 PolarHBondContact O-N 2.95Å; R121-K124 PolarHBondContact O-N 2.86Å; R121-A125 VanDerWaalsContact O-CB 3.31Å; R121-A125 WeakPolarHBondContact O-CB 3.5Å; R121-A125 PolarHBondContact O-N 3.39Å
122	Q	86.4	Confident	78.6	Confident	118 Å²	118	114.6 Å²	114.6	55%	0.551	55%	0.545	S	S	*	.	H	α-helix	trans	-61.1	-51.4	173.9	-72.4	173.4	-11.2	0	0	110.6	L118 K119 K124 A125 H126	L118-Q122 WeakPolarHBondContact O-CG 3.3Å; L118-Q122 PolarHBondContact O-N 3.2Å; K119-Q122 PolarHBondContact O-N 3.42Å; Q122-K124 VanDerWaalsContact C-N 3.29Å; Q122-K124 PolarHBondContact O-N 3.39Å; Q122-A125 WeakPolarHBondContact O-CB 3.31Å; Q122-A125 PolarHBondContact O-N 2.96Å; Q122-A125 VanDerWaalsContact O-N 3.12Å; Q122-H126 WeakPolarHBondContact O-CB 3.42Å; Q122-H126 PolarHBondContact O-CD2 3.47Å; Q122-H126 PolarHBondContact O-N 2.88Å
123	I	80.1	Confident	76.7	Confident	102 Å²	102	114.8 Å²	114.8	52%	0.523	55%	0.552	S	S	.	*	H	α-helix	trans	-56.6	-43.6	176.5	-67.9	165.2	0	0	0	110.8	K119 R120 H126 S127	K119-I123 HydrophobicContact CG-CD1 3.96Å; K119-I123 WeakPolarHBondContact O-CB 3.29Å; K119-I123 WeakPolarHBondContact O-CG1 3.48Å; K119-I123 PolarHBondContact O-N 3.39Å; R120-I123 PolarHBondContact O-N 3.2Å; I123-H126 PolarHBondContact O-N 3.38Å; I123-S127 WeakPolarHBondContact O-CB 3.36Å; I123-S127 PolarHBondContact O-N 2.84Å
124	K	81.3	Confident	74.8	Confident	137 Å²	137	114.3 Å²	114.3	60%	0.596	56%	0.556	S	S	*	*	H	α-helix	trans	-66.6	-39.2	178.1	-168.5	172.1	-173	173.2	0	112	R120 R121 Q122 K128	R120-K124 VanDerWaalsContact O-CB 3.28Å; R120-K124 WeakPolarHBondContact O-CB 3.18Å; R120-K124 PolarHBondContact O-N 2.93Å; R121-K124 PolarHBondContact O-N 2.86Å; Q122-K124 VanDerWaalsContact C-N 3.29Å; Q122-K124 PolarHBondContact O-N 3.39Å; K124-K128 WeakPolarHBondContact O-CB 3.48Å; K124-K128 WeakPolarHBondContact O-CG 3.37Å; K124-K128 PolarHBondContact O-N 3.16Å
125	A	78.2	Confident	73.1	Confident	52 Å²	52	119.3 Å²	119.3	43%	0.43	57%	0.567	S	S	.	*	H	α-helix	trans	-64.7	-46.4	174.7	0	0	0	0	0	111.2	R121 Q122 K128 R129	R121-A125 VanDerWaalsContact O-CB 3.31Å; R121-A125 WeakPolarHBondContact O-CB 3.5Å; R121-A125 PolarHBondContact O-N 3.39Å; Q122-A125 WeakPolarHBondContact O-CB 3.31Å; Q122-A125 PolarHBondContact O-N 2.96Å; Q122-A125 VanDerWaalsContact O-N 3.12Å; A125-K128 PolarHBondContact O-N 2.98Å; A125-R129 WeakPolarHBondContact O-CG 3.34Å; A125-R129 PolarHBondContact O-N 3.21Å
126	H	75.1	Confident	71.2	Confident	116 Å²	116	122.3 Å²	122.3	54%	0.537	58%	0.582	S	S	.	*	H	α-helix	trans	-64.5	-41.2	175.1	-73.3	-68.3	0	0	0	112.2	Q122 I123 K128 R129 R130	Q122-H126 WeakPolarHBondContact O-CB 3.42Å; Q122-H126 PolarHBondContact O-CD2 3.47Å; Q122-H126 PolarHBondContact O-N 2.88Å; I123-H126 PolarHBondContact O-N 3.38Å; H126-K128 VanDerWaalsContact C-N 3.34Å; H126-K128 PolarHBondContact O-N 3.47Å; H126-R129 PolarHBondContact O-N 2.9Å; H126-R130 WeakPolarHBondContact O-CB 3.35Å; H126-R130 PolarHBondContact O-N 3.23Å
127	S	72.5	Confident	69.2	Low	74 Å²	74	128.8 Å²	128.8	52%	0.517	60%	0.599	S	S	.	*	H	α-helix	trans	-62.8	-40.3	176.7	-176.9	0	0	0	0	111.5	I123 R130 S131	I123-S127 WeakPolarHBondContact O-CB 3.36Å; I123-S127 PolarHBondContact O-N 2.84Å; S127-R130 PolarHBondContact O-N 3.16Å; S127-S131 WeakPolarHBondContact O-CB 3.42Å; S127-S131 PolarHBondContact O-N 3.2Å; S127-S131 PolarHBondContact O-OG 3.07Å
128	K	63.2	Low	67.3	Low	130 Å²	130	134 Å²	134	57%	0.565	62%	0.622	S	S	*	*	H	α-helix	trans	-67.4	-41.3	174.9	-75.6	-178.5	177.6	-168.5	0	111.9	K124 A125 H126 R130 S131 T132	K124-K128 WeakPolarHBondContact O-CB 3.48Å; K124-K128 WeakPolarHBondContact O-CG 3.37Å; K124-K128 PolarHBondContact O-N 3.16Å; A125-K128 PolarHBondContact O-N 2.98Å; H126-K128 VanDerWaalsContact C-N 3.34Å; H126-K128 PolarHBondContact O-N 3.47Å; K128-R130 VanDerWaalsContact C-N 3.27Å; K128-R130 PolarHBondContact O-N 2.81Å; K128-S131 PolarHBondContact O-N 3.03Å; K128-S131 PolarHBondContact O-OG 2.8Å; K128-S131 VanDerWaalsContact O-OG 3.06Å; K128-T132 WeakPolarHBondContact O-CG2 3.47Å; K128-T132 PolarHBondContact O-N 3.42Å; K128-T132 PolarHBondContact O-OG1 3.3Å
129	R	61.7	Low	65.4	Low	176 Å²	176	132.5 Å²	132.5	66%	0.664	63%	0.627	S	S	*	*	H	α-helix	trans	-62	-34.9	174	-71.5	178	73.5	-171.6	2.8	112.1	A125 H126 T132	A125-R129 WeakPolarHBondContact O-CG 3.34Å; A125-R129 PolarHBondContact O-N 3.21Å; H126-R129 PolarHBondContact O-N 2.9Å; R129-T132 PolarHBondContact O-OG1 3.35Å
130	R	57.9	Low	63.5	Low	181 Å²	181	129.5 Å²	129.5	68%	0.683	62%	0.617	S	S	*	*	H	α-helix	trans	-79.7	-34.5	176.7	-132.8	175.1	82.6	-180	7.1	112.6	H126 S127 K128 T132 L133 I134	H126-R130 WeakPolarHBondContact O-CB 3.35Å; H126-R130 PolarHBondContact O-N 3.23Å; S127-R130 PolarHBondContact O-N 3.16Å; K128-R130 VanDerWaalsContact C-N 3.27Å; K128-R130 PolarHBondContact O-N 2.81Å; R130-T132 VanDerWaalsContact C-N 3.3Å; R130-T132 PolarHBondContact O-N 3.08Å; R130-L133 PolarHBondContact O-N 3.41Å; R130-I134 WeakPolarHBondContact O-CG1 3.06Å; R130-I134 PolarHBondContact O-N 2.82Å
131	S	54.9	Low	62.1	Low	65 Å²	65	125.1 Å²	125.1	46%	0.455	62%	0.615	S	S	.	*	H	α-helix	trans	-69	-28.1	179.4	70.7	0	0	0	0	112.7	S127 K128 L133	S127-S131 WeakPolarHBondContact O-CB 3.42Å; S127-S131 PolarHBondContact O-N 3.2Å; S127-S131 PolarHBondContact O-OG 3.07Å; K128-S131 PolarHBondContact O-N 3.03Å; K128-S131 PolarHBondContact O-OG 2.8Å; K128-S131 VanDerWaalsContact O-OG 3.06Å; S131-L133 VanDerWaalsContact C-N 3.32Å
132	T	53.3	Low	61	Low	115 Å²	115	119.9 Å²	119.9	71%	0.706	61%	0.611	S	S	*	*	H	α-helix	trans	-73.6	-24.8	174	52.4	0	0	0	0	112.8	K128 R129 R130	K128-T132 WeakPolarHBondContact O-CG2 3.47Å; K128-T132 PolarHBondContact O-N 3.42Å; K128-T132 PolarHBondContact O-OG1 3.3Å; R129-T132 PolarHBondContact O-OG1 3.35Å; R130-T132 VanDerWaalsContact C-N 3.3Å; R130-T132 PolarHBondContact O-N 3.08Å
133	L	52.2	Low	59.7	Low	148 Å²	148	117.3 Å²	117.3	78%	0.775	61%	0.61	S	S	*	*	H	α-helix	trans	-86.5	-20	174.6	-74.3	168.4	0	0	0	112.9	R130 S131 R135	R130-L133 PolarHBondContact O-N 3.41Å; S131-L133 VanDerWaalsContact C-N 3.32Å; L133-R135 PolarHBondContact O-N 3.12Å
134	I	46.1	Very low	58.4	Low	92 Å²	92	113.4 Å²	113.4	47%	0.472	60%	0.595	S	S	.	*	S	Bend	trans	-76.1	88	165	-60.1	166.3	0	0	0	105.9	R130 R137	R130-I134 WeakPolarHBondContact O-CG1 3.06Å; R130-I134 PolarHBondContact O-N 2.82Å; I134-R137 HydrophobicContact CG2-CG 4.13Å
135	R	53	Low	57.3	Low	215 Å²	215	114.6 Å²	114.6	81%	0.811	60%	0.595	S	S	*	*			trans	-29.4	132.3	161.2	-176.7	179.3	-171.7	168.5	3.3	108.4	L133 R137	L133-R135 PolarHBondContact O-N 3.12Å; R135-R137 PolarHBondContact O-N 3.06Å
136	P	50.3	Low	56.4	Low	120 Å²	120	121.4 Å²	121.4	78%	0.779	61%	0.61	S	S	*	*			trans	-44.7	114.6	-177.6	18.1	-32.1	0	0	0	107.5	K138	P136-K138 VanDerWaalsContact C-N 3.29Å; P136-K138 PolarHBondContact O-N 2.89Å
137	R	47.5	Very low	55.8	Low	184 Å²	184	123 Å²	123	69%	0.694	62%	0.615	S	S	*	*			trans	-57.6	105.9	177.2	-77.4	175.9	73.1	111.3	-4	104	I134 R135 G139	I134-R137 HydrophobicContact CG2-CG 4.13Å; R135-R137 PolarHBondContact O-N 3.06Å; R137-G139 PolarHBondContact O-N 2.79Å
138	K	51.9	Low	55.1	Low	195 Å²	195	120.4 Å²	120.4	85%	0.848	60%	0.598	S	S	*	*			trans	-41	113.1	166.7	-169.5	172.9	-174.3	179	0	104.2	P136 L140	P136-K138 VanDerWaalsContact C-N 3.29Å; P136-K138 PolarHBondContact O-N 2.89Å; K138-L140 PolarHBondContact O-N 2.84Å
139	G	50.9	Low	55.1	Low	55 Å²	55	118.6 Å²	118.6	57%	0.567	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-48.7	118.9	-172.5	0	0	0	0	0	106.7	R137 S141	R137-G139 PolarHBondContact O-N 2.79Å; G139-S141 PolarHBondContact O-N 2.93Å; G139-S141 VanDerWaalsContact O-N 3.12Å
140	L	49	Very low	55.3	Low	74 Å²	74	114.7 Å²	114.7	39%	0.387	59%	0.59	S	S	.	*	P	Polyproline II helix	trans	-55.5	128.8	176	-71	170.7	0	0	0	105.3	K138 G144 R145 A148	K138-L140 PolarHBondContact O-N 2.84Å; L140-G144 WeakPolarHBondContact CD1-O 3.45Å; L140-R145 HydrophobicContact CB-CG 4.18Å; L140-R145 WeakPolarHBondContact O-CG 3.39Å; L140-R145 PolarHBondContact O-NE 2.89Å; L140-A148 HydrophobicContact CD1-CB 4.02Å
141	S	56.1	Low	55.7	Low	96 Å²	96	112.5 Å²	112.5	67%	0.671	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-46.9	150.8	166.6	166.8	0	0	0	0	108.4	G139 A143 G144 R145	G139-S141 PolarHBondContact O-N 2.93Å; G139-S141 VanDerWaalsContact O-N 3.12Å; S141-A143 CarbonylContact O-C 3.48Å; S141-A143 PolarHBondContact O-N 3.05Å; S141-G144 WeakPolarHBondContact O-CA 3.3Å; S141-G144 PolarHBondContact O-N 3.41Å; S141-R145 PolarHBondContact O-N 3.34Å; S141-R145 VanDerWaalsContact O-N 3.12Å
142	A	58.9	Low	56.3	Low	72 Å²	72	117.9 Å²	117.9	60%	0.595	60%	0.598	S	S	*	*	H	α-helix	trans	-45.9	-36.6	-171.9	0	0	0	0	0	113.4	R145 R146	A142-R145 PolarHBondContact O-N 2.72Å; A142-R146 PolarHBondContact O-N 3.12Å; A142-R146 VanDerWaalsContact O-N 3.08Å
143	A	60.5	Low	57.2	Low	65 Å²	65	115.4 Å²	115.4	54%	0.537	59%	0.585	S	S	.	*	H	α-helix	trans	-61.6	-41.4	173.4	0	0	0	0	0	113.9	S141 R146 K147	S141-A143 CarbonylContact O-C 3.48Å; S141-A143 PolarHBondContact O-N 3.05Å; A143-R146 PolarHBondContact O-N 3.23Å; A143-K147 PolarHBondContact O-N 3.08Å; A143-K147 VanDerWaalsContact O-N 3.12Å
144	G	52.3	Low	58.4	Low	19 Å²	19	112.9 Å²	112.9	20%	0.196	57%	0.569	C	S	.	*	H	α-helix	trans	-70.9	-29.5	173.9	0	0	0	0	0	113.4	L140 S141 A148	L140-G144 WeakPolarHBondContact CD1-O 3.45Å; S141-G144 WeakPolarHBondContact O-CA 3.3Å; S141-G144 PolarHBondContact O-N 3.41Å; G144-A148 WeakPolarHBondContact O-CB 3.33Å; G144-A148 PolarHBondContact O-N 2.99Å
145	R	57.1	Low	59.9	Low	162 Å²	162	113.4 Å²	113.4	61%	0.611	57%	0.57	S	S	*	*	H	α-helix	trans	-64.9	-44.4	170.6	-66.7	-171.8	-169.9	-148.6	5.6	111.3	L140 S141 A142 A148 T149	L140-R145 HydrophobicContact CB-CG 4.18Å; L140-R145 WeakPolarHBondContact O-CG 3.39Å; L140-R145 PolarHBondContact O-NE 2.89Å; S141-R145 PolarHBondContact O-N 3.34Å; S141-R145 VanDerWaalsContact O-N 3.12Å; A142-R145 PolarHBondContact O-N 2.72Å; R145-A148 PolarHBondContact O-N 3.04Å; R145-T149 PolarHBondContact O-N 2.82Å; R145-T149 PolarHBondContact O-OG1 3.24Å; R145-T149 VanDerWaalsContact O-OG1 3.04Å
146	R	59.1	Low	61	Low	196 Å²	196	112.7 Å²	112.7	74%	0.74	57%	0.567	S	S	*	*	H	α-helix	trans	-60.3	-47	176.6	-67.5	178.5	91.4	151.7	4	111.4	A142 A143 A148 T149 I150	A142-R146 PolarHBondContact O-N 3.12Å; A142-R146 VanDerWaalsContact O-N 3.08Å; A143-R146 PolarHBondContact O-N 3.23Å; R146-A148 PolarHBondContact O-N 3.44Å; R146-T149 PolarHBondContact O-N 3.44Å; R146-I150 WeakPolarHBondContact O-CG1 3.36Å; R146-I150 PolarHBondContact O-N 3.34Å; R146-I150 VanDerWaalsContact O-N 3.08Å
147	K	64.3	Low	62.3	Low	148 Å²	148	111.5 Å²	111.5	64%	0.643	56%	0.558	S	S	*	*	H	α-helix	trans	-57.8	-45.1	173.8	-71.2	-174.3	178.4	-173.4	0	112.6	A143 T149 I150 E151	A143-K147 PolarHBondContact O-N 3.08Å; A143-K147 VanDerWaalsContact O-N 3.12Å; K147-T149 VanDerWaalsContact C-N 3.33Å; K147-T149 PolarHBondContact O-N 2.94Å; K147-I150 PolarHBondContact O-N 3.26Å; K147-E151 PolarHBondContact O-N 3.27Å
148	A	56.7	Low	63.7	Low	20 Å²	20	111.3 Å²	111.3	17%	0.165	56%	0.557	C	S	.	*	H	α-helix	trans	-66.8	-30.8	178.7	0	0	0	0	0	113.7	L140 G144 R145 R146 R152	L140-A148 HydrophobicContact CD1-CB 4.02Å; G144-A148 WeakPolarHBondContact O-CB 3.33Å; G144-A148 PolarHBondContact O-N 2.99Å; R145-A148 PolarHBondContact O-N 3.04Å; R146-A148 PolarHBondContact O-N 3.44Å; A148-R152 WeakPolarHBondContact O-CB 3.44Å; A148-R152 VanDerWaalsContact O-CG 3.3Å; A148-R152 WeakPolarHBondContact O-CG 3.45Å; A148-R152 PolarHBondContact O-N 2.98Å
149	T	62.6	Low	64.7	Low	93 Å²	93	109.9 Å²	109.9	57%	0.571	55%	0.546	S	S	*	.	H	α-helix	trans	-69	-41.5	173.6	-58.9	0	0	0	0	111	R145 R146 K147 R152 S153	R145-T149 PolarHBondContact O-N 2.82Å; R145-T149 PolarHBondContact O-OG1 3.24Å; R145-T149 VanDerWaalsContact O-OG1 3.04Å; R146-T149 PolarHBondContact O-N 3.44Å; K147-T149 VanDerWaalsContact C-N 3.33Å; K147-T149 PolarHBondContact O-N 2.94Å; T149-R152 PolarHBondContact O-N 3.44Å; T149-S153 PolarHBondContact O-N 2.74Å
150	I	66	Low	65.9	Low	94 Å²	94	110.7 Å²	110.7	48%	0.482	54%	0.543	S	S	.	.	H	α-helix	trans	-67	-46.4	176.9	-62.3	163.5	0	0	0	111	R146 K147 R152 S153 E154	R146-I150 WeakPolarHBondContact O-CG1 3.36Å; R146-I150 PolarHBondContact O-N 3.34Å; R146-I150 VanDerWaalsContact O-N 3.08Å; K147-I150 PolarHBondContact O-N 3.26Å; I150-R152 PolarHBondContact O-N 3.38Å; I150-S153 PolarHBondContact O-N 2.87Å; I150-S153 VanDerWaalsContact O-N 3.16Å; I150-S153 PolarHBondContact O-OG 3.4Å; I150-E154 PolarHBondContact O-N 3.46Å; I150-E154 VanDerWaalsContact O-N 3.08Å
151	E	66.1	Low	66.9	Low	135 Å²	135	115 Å²	115	63%	0.631	55%	0.554	S	S	*	*	H	α-helix	trans	-59.5	-35.1	176.4	-77.1	179.9	178.2	0	0	112.5	K147 Q155	K147-E151 PolarHBondContact O-N 3.27Å; E151-Q155 WeakPolarHBondContact O-CB 3.44Å; E151-Q155 PolarHBondContact O-N 3.37Å
152	R	68.1	Low	67.8	Low	178 Å²	178	114.9 Å²	114.9	67%	0.672	55%	0.546	S	S	*	.	H	α-helix	trans	-69	-38.3	177	-82.6	177.9	-179.8	169.1	0.6	112.9	A148 T149 I150 R156	A148-R152 WeakPolarHBondContact O-CB 3.44Å; A148-R152 VanDerWaalsContact O-CG 3.3Å; A148-R152 WeakPolarHBondContact O-CG 3.45Å; A148-R152 PolarHBondContact O-N 2.98Å; T149-R152 PolarHBondContact O-N 3.44Å; I150-R152 PolarHBondContact O-N 3.38Å; R152-R156 PolarHBondContact O-N 3.24Å
153	S	72.3	Confident	68.3	Low	63 Å²	63	119.6 Å²	119.6	44%	0.441	55%	0.548	S	S	.	.	H	α-helix	trans	-68.4	-43.1	177	58.2	0	0	0	0	110.4	T149 I150 Q155 R156 V157	T149-S153 PolarHBondContact O-N 2.74Å; I150-S153 PolarHBondContact O-N 2.87Å; I150-S153 VanDerWaalsContact O-N 3.16Å; I150-S153 PolarHBondContact O-OG 3.4Å; S153-Q155 PolarHBondContact O-N 2.92Å; S153-R156 WeakPolarHBondContact O-CB 3.5Å; S153-R156 PolarHBondContact O-N 2.84Å; S153-R156 VanDerWaalsContact O-N 3.13Å; S153-V157 WeakPolarHBondContact O-CG2 3.26Å; S153-V157 PolarHBondContact O-N 3.29Å
154	E	77.6	Confident	68.7	Low	95 Å²	95	123 Å²	123	44%	0.444	55%	0.553	S	S	.	*	H	α-helix	trans	-61.2	-41.8	174.3	-70.4	-176.6	-168.1	0	0	112.6	I150 R156 V157 R158	I150-E154 PolarHBondContact O-N 3.46Å; I150-E154 VanDerWaalsContact O-N 3.08Å; E154-R156 VanDerWaalsContact C-N 3.28Å; E154-R156 PolarHBondContact O-N 2.97Å; E154-V157 PolarHBondContact O-N 2.89Å; E154-R158 WeakPolarHBondContact O-CG 3.49Å; E154-R158 PolarHBondContact O-N 2.8Å
155	Q	78.3	Confident	69.3	Low	102 Å²	102	129.4 Å²	129.4	48%	0.477	57%	0.571	S	S	.	*	H	α-helix	trans	-64.4	-33.9	176.2	-166.7	177	26.3	0	0	112.1	E151 S153 R159	E151-Q155 WeakPolarHBondContact O-CB 3.44Å; E151-Q155 PolarHBondContact O-N 3.37Å; S153-Q155 PolarHBondContact O-N 2.92Å; Q155-R159 VanDerWaalsContact O-CG 3.29Å; Q155-R159 WeakPolarHBondContact O-CG 3.5Å; Q155-R159 PolarHBondContact O-N 3.12Å
156	R	75.7	Confident	69.5	Low	200 Å²	200	126.1 Å²	126.1	76%	0.755	57%	0.566	S	S	*	*	H	α-helix	trans	-65.4	-44.7	174.1	-169.8	-176.3	-68.8	-149.7	0.6	111	R152 S153 E154 R159 S160	R152-R156 PolarHBondContact O-N 3.24Å; S153-R156 WeakPolarHBondContact O-CB 3.5Å; S153-R156 PolarHBondContact O-N 2.84Å; S153-R156 VanDerWaalsContact O-N 3.13Å; E154-R156 VanDerWaalsContact C-N 3.28Å; E154-R156 PolarHBondContact O-N 2.97Å; R156-R159 PolarHBondContact O-N 3.36Å; R156-S160 PolarHBondContact O-N 2.86Å; R156-S160 PolarHBondContact O-OG 2.79Å
157	V	77	Confident	69.6	Low	96 Å²	96	121 Å²	121	58%	0.582	55%	0.55	S	S	*	*	H	α-helix	trans	-64	-40.8	176.6	175.4	0	0	0	0	111.6	S153 E154 R159 S160 R161	S153-V157 WeakPolarHBondContact O-CG2 3.26Å; S153-V157 PolarHBondContact O-N 3.29Å; E154-V157 PolarHBondContact O-N 2.89Å; V157-R159 VanDerWaalsContact C-N 3.35Å; V157-R159 PolarHBondContact O-N 3.02Å; V157-S160 PolarHBondContact O-N 3.25Å; V157-S160 PolarHBondContact O-OG 3.48Å; V157-R161 WeakPolarHBondContact O-CB 3.31Å; V157-R161 PolarHBondContact O-N 3.14Å; V157-R161 VanDerWaalsContact O-N 3.09Å
158	R	76.2	Confident	69.5	Low	179 Å²	179	120.2 Å²	120.2	68%	0.675	55%	0.553	S	S	*	*	H	α-helix	trans	-62.9	-40.4	174.5	-72.4	180	-176.7	160.5	6.8	112.1	E154 N162	E154-R158 WeakPolarHBondContact O-CG 3.49Å; E154-R158 PolarHBondContact O-N 2.8Å; R158-N162 WeakPolarHBondContact O-CB 3.44Å; R158-N162 PolarHBondContact O-N 3.03Å
159	R	73.9	Confident	69.2	Low	165 Å²	165	125.6 Å²	125.6	62%	0.623	58%	0.579	S	S	*	*	H	α-helix	trans	-68.2	-40.5	178.3	-75	177	-174.4	-175.5	5.7	112.9	Q155 R156 V157 N162 R163	Q155-R159 VanDerWaalsContact O-CG 3.29Å; Q155-R159 WeakPolarHBondContact O-CG 3.5Å; Q155-R159 PolarHBondContact O-N 3.12Å; R156-R159 PolarHBondContact O-N 3.36Å; V157-R159 VanDerWaalsContact C-N 3.35Å; V157-R159 PolarHBondContact O-N 3.02Å; R159-N162 PolarHBondContact O-N 3.47Å; R159-R163 WeakPolarHBondContact O-CB 3.35Å; R159-R163 PolarHBondContact O-N 2.7Å
160	S	75.6	Confident	69.1	Low	72 Å²	72	129.7 Å²	129.7	50%	0.503	58%	0.584	S	S	.	*	H	α-helix	trans	-63.6	-45.1	175.7	58.5	0	0	0	0	111	R156 V157 N162 R163 Q164	R156-S160 PolarHBondContact O-N 2.86Å; R156-S160 PolarHBondContact O-OG 2.79Å; V157-S160 PolarHBondContact O-N 3.25Å; V157-S160 PolarHBondContact O-OG 3.48Å; S160-N162 VanDerWaalsContact C-N 3.33Å; S160-N162 PolarHBondContact O-N 2.94Å; S160-R163 PolarHBondContact O-N 2.91Å; S160-Q164 PolarHBondContact O-N 3.24Å; S160-Q164 VanDerWaalsContact O-N 3.09Å
161	R	71.4	Confident	68.3	Low	165 Å²	165	130.3 Å²	130.3	62%	0.623	59%	0.594	S	S	*	*	H	α-helix	trans	-61.5	-38.4	177.2	-164.3	175.8	-173	167.2	1.9	113	V157 R165	V157-R161 WeakPolarHBondContact O-CB 3.31Å; V157-R161 PolarHBondContact O-N 3.14Å; V157-R161 VanDerWaalsContact O-N 3.09Å; R161-R165 PolarHBondContact O-N 3.07Å
162	N	74.3	Confident	67.8	Low	93 Å²	93	131.3 Å²	131.3	50%	0.497	60%	0.603	S	S	.	*	H	α-helix	trans	-73.2	-33.9	178.7	-145.6	17.1	0	0	0	112.5	R158 R159 S160 R165 N166	R158-N162 WeakPolarHBondContact O-CB 3.44Å; R158-N162 PolarHBondContact O-N 3.03Å; R159-N162 PolarHBondContact O-N 3.47Å; S160-N162 VanDerWaalsContact C-N 3.33Å; S160-N162 PolarHBondContact O-N 2.94Å; N162-R165 PolarHBondContact O-N 3.21Å; N162-N166 PolarHBondContact O-N 3.43Å; N162-N166 VanDerWaalsContact O-N 3.13Å; N162-N166 PolarHBondContact O-ND2 3.21Å
163	R	69.6	Low	67	Low	171 Å²	171	130.8 Å²	130.8	65%	0.645	61%	0.608	S	S	*	*	H	α-helix	trans	-64.7	-42.2	174.5	-175.1	176.3	177.3	160.5	-0.6	111.6	R159 S160 N166 E167	R159-R163 WeakPolarHBondContact O-CB 3.35Å; R159-R163 PolarHBondContact O-N 2.7Å; S160-R163 PolarHBondContact O-N 2.91Å; R163-N166 PolarHBondContact O-N 3.01Å; R163-E167 IonicContact CZ-OE1 3.18Å; R163-E167 IonicContact NE-OE1 3.08Å; R163-E167 PolarHBondContact NE-OE1 3.07Å; R163-E167 IonicContact NH2-OE1 3.56Å; R163-E167 PolarHBondContact O-N 3.06Å
164	Q	68.6	Low	65.9	Low	136 Å²	136	134.7 Å²	134.7	64%	0.636	62%	0.624	S	S	*	*	H	α-helix	trans	-60.4	-47.6	176.9	-163.6	167.9	4.3	0	0	111.1	S160 N166 E167 D168	S160-Q164 PolarHBondContact O-N 3.24Å; S160-Q164 VanDerWaalsContact O-N 3.09Å; Q164-N166 VanDerWaalsContact C-N 3.3Å; Q164-N166 PolarHBondContact O-N 3.37Å; Q164-E167 PolarHBondContact O-N 3.12Å; Q164-D168 PolarHBondContact O-N 3.23Å
165	R	64.7	Low	64.5	Low	154 Å²	154	138.2 Å²	138.2	58%	0.581	64%	0.638	S	S	*	*	H	α-helix	trans	-59.7	-33.3	175.1	-74.6	-177.1	173.3	-172.8	-4.1	114.7	R161 N162	R161-R165 PolarHBondContact O-N 3.07Å; N162-R165 PolarHBondContact O-N 3.21Å
166	N	61	Low	62.8	Low	94 Å²	94	139.7 Å²	139.7	50%	0.503	65%	0.654	S	S	.	*	H	α-helix	trans	-83.1	-24.8	-178.3	-72.6	-16.4	0	0	0	113.2	N162 R163 Q164 D168 L169	N162-N166 PolarHBondContact O-N 3.43Å; N162-N166 VanDerWaalsContact O-N 3.13Å; N162-N166 PolarHBondContact O-ND2 3.21Å; R163-N166 PolarHBondContact O-N 3.01Å; Q164-N166 VanDerWaalsContact C-N 3.3Å; Q164-N166 PolarHBondContact O-N 3.37Å; N166-D168 VanDerWaalsContact C-N 3.3Å; N166-L169 PolarHBondContact O-N 3.4Å
167	E	62.3	Low	61.5	Low	88 Å²	88	138 Å²	138	41%	0.411	66%	0.658	S	S	.	*	H	α-helix	trans	-70.1	-32.5	173.2	-74.3	174.6	-172.1	0	0	110.6	R163 Q164 L169 R170	R163-E167 IonicContact CZ-OE1 3.18Å; R163-E167 IonicContact NE-OE1 3.08Å; R163-E167 PolarHBondContact NE-OE1 3.07Å; R163-E167 IonicContact NH2-OE1 3.56Å; R163-E167 PolarHBondContact O-N 3.06Å; Q164-E167 PolarHBondContact O-N 3.12Å; E167-L169 PolarHBondContact O-N 3.44Å; E167-R170 PolarHBondContact O-N 3Å
168	D	60.7	Low	59.8	Low	132 Å²	132	141.8 Å²	141.8	71%	0.706	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-17	173	-58.4	-26.1	0	0	0	113.7	Q164 N166	Q164-D168 PolarHBondContact O-N 3.23Å; N166-D168 VanDerWaalsContact C-N 3.3Å
169	L	51.9	Low	58.1	Low	133 Å²	133	140.7 Å²	140.7	70%	0.696	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105	11	-177.3	-67.1	175.9	0	0	0	113.9	N166 E167 P171	N166-L169 PolarHBondContact O-N 3.4Å; E167-L169 PolarHBondContact O-N 3.44Å; L169-P171 VanDerWaalsContact O-CD 3.22Å; L169-P171 WeakPolarHBondContact O-CD 3.5Å
170	R	60.1	Low	56.6	Low	178 Å²	178	138.7 Å²	138.7	67%	0.672	69%	0.686	S	S	*	*			trans	-70.6	116.5	173.6	-71.4	-170.9	-173.3	161.3	9.5	109.1	E167 L172	E167-R170 PolarHBondContact O-N 3Å; R170-L172 PolarHBondContact O-N 3.32Å
171	P	49.4	Very low	54.9	Low	108 Å²	108	142.6 Å²	142.6	70%	0.701	70%	0.701	S	S	*	*			trans	-60.8	129	177.1	-18.4	31.9	0	0	0	109.3	L169 E173	L169-P171 VanDerWaalsContact O-CD 3.22Å; L169-P171 WeakPolarHBondContact O-CD 3.5Å; P171-E173 PolarHBondContact O-N 3.08Å
172	L	54.9	Low	53	Low	156 Å²	156	144.9 Å²	144.9	82%	0.817	71%	0.711	S	S	*	*			trans	-70.5	68.4	171.8	-76.9	156.9	0	0	0	109	R170 N174	R170-L172 PolarHBondContact O-N 3.32Å; L172-N174 PolarHBondContact O-N 3.04Å; L172-N174 VanDerWaalsContact O-N 3.15Å
173	E	51.2	Low	51.4	Low	166 Å²	166	145.9 Å²	145.9	78%	0.776	72%	0.722	S	S	*	*			trans	-92.5	57.2	-177.8	-140.1	169.4	-155.8	0	0	109.9	P171	P171-E173 PolarHBondContact O-N 3.08Å
174	N	49.9	Very low	50.2	Low	145 Å²	145	142.9 Å²	142.9	78%	0.775	73%	0.727	S	S	*	*			trans	-94.6	76.4	156.8	-73	-22.8	0	0	0	106.7	L172	L172-N174 PolarHBondContact O-N 3.04Å; L172-N174 VanDerWaalsContact O-N 3.15Å
175	F	47.9	Very low	48.5	Very low	170 Å²	170	144.1 Å²	144.1	75%	0.746	73%	0.733	S	S	*	*			trans	-119.9	86.3	162.5	-68.4	-72.3	0	0	0	108.1	L177	F175-L177 PolarHBondContact O-N 3.03Å
176	V	43.4	Very low	47.1	Very low	133 Å²	133	144 Å²	144	81%	0.806	74%	0.737	S	S	*	*			trans	-63.9	106.4	156.4	177.2	0	0	0	0	105.7	E178	V176-E178 HydrophobicContact CG1-CG 4.47Å
177	L	46.8	Very low	46.1	Very low	163 Å²	163	145.7 Å²	145.7	85%	0.853	75%	0.754	S	S	*	*			trans	-106	109.4	162.8	-83	162.7	0	0	0	106	F175	F175-L177 PolarHBondContact O-N 3.03Å
178	E	42.5	Very low	44.8	Very low	176 Å²	176	148 Å²	148	82%	0.822	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-57.6	138.8	175.3	-66	179.5	155.9	0	0	111	V176	V176-E178 HydrophobicContact CG1-CG 4.47Å
179	D	40.8	Very low	43.9	Very low	156 Å²	156	150.2 Å²	150.2	83%	0.834	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-61.4	130.1	176.3	-94.5	-31	0	0	0	111.8	L181	D179-L181 PolarHBondContact O-N 3.5Å
180	P	42.5	Very low	43.2	Very low	124 Å²	124	147.7 Å²	147.7	81%	0.805	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-75.5	116.5	169.6	-12	27.9	0	0	0	111.5
181	L	39.9	Very low	42.2	Very low	154 Å²	154	144.9 Å²	144.9	81%	0.806	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-74.4	144.9	166.5	-77.6	152.6	0	0	0	111.3	D179	D179-L181 PolarHBondContact O-N 3.5Å
182	Y	30.1	Very low	41.8	Very low	212 Å²	212	147.7 Å²	147.7	83%	0.831	79%	0.793	S	S	*	*			trans	82.2	148	173	-73.9	-92.5	0	0	0	117.8
183	P	41.5	Very low	41.1	Very low	115 Å²	115	146.2 Å²	146.2	75%	0.747	79%	0.791	S	S	*	*			cis	-143.6	164.9	26.3	40.7	-21.1	0	0	0	118.2
184	S	43.4	Very low	40.9	Very low	107 Å²	107	141.8 Å²	141.8	75%	0.748	78%	0.783	S	S	*	*				162.6	106.8	128.8	70.5	0	0	0	0	110
185	E	33.5	Very low	40.6	Very low	162 Å²	162	141.5 Å²	141.5	76%	0.757	78%	0.781	S	S	*	*				67.8	116.9	78.2	-81.4	-159.3	-159.2	0	0	116.3
186	K	35.1	Very low	40.2	Very low	152 Å²	152	140.5 Å²	140.5	66%	0.661	78%	0.782	S	S	*	*			trans	86.1	102.8	141.9	-49.7	-108.1	-179.5	-179.4	0	118.5
187	C	39.8	Very low	40.1	Very low	129 Å²	129	142.9 Å²	142.9	87%	0.872	78%	0.784	S	S	*	*			trans	-143.3	106.3	132.2	-96.6	0	0	0	0	108.4	H189	C187-H189 PolarHBondContact O-N 3.13Å
188	D	36.3	Very low	39.7	Very low	136 Å²	136	141.4 Å²	141.4	73%	0.727	78%	0.782	S	S	*	*			trans	-69.6	110.4	171.9	-59.2	-56.5	0	0	0	109.4
189	H	41.8	Very low	39.8	Very low	179 Å²	179	139.1 Å²	139.1	83%	0.829	78%	0.783	S	S	*	*			trans	-118.3	90.3	155.8	-81.6	14.2	0	0	0	107.3	C187 T191	C187-H189 PolarHBondContact O-N 3.13Å; H189-T191 PolarHBondContact O-N 3.38Å; H189-T191 VanDerWaalsContact O-N 3.14Å
190	G	36	Very low	39.6	Very low	80 Å²	80	134.2 Å²	134.2	83%	0.825	77%	0.768	S	S	*	*			trans	-63	106.9	164.9	0	0	0	0	0	109.2
191	T	39	Very low	39.3	Very low	119 Å²	119	136 Å²	136	73%	0.73	77%	0.769	S	S	*	*			trans	-119.4	104.5	148.8	45.3	0	0	0	0	106.9	H189 T193	H189-T191 PolarHBondContact O-N 3.38Å; H189-T191 VanDerWaalsContact O-N 3.14Å; T191-T193 VanDerWaalsContact C-N 3.34Å; T191-T193 PolarHBondContact O-N 2.91Å
192	D	42.4	Very low	39.3	Very low	167 Å²	167	137.5 Å²	137.5	89%	0.893	77%	0.772	S	S	*	*			trans	-51.2	94.5	161.4	-126.7	-9.4	0	0	0	108.7
193	T	39.8	Very low	39.5	Very low	126 Å²	126	138.6 Å²	138.6	77%	0.773	78%	0.775	S	S	*	*			trans	-127.3	85.2	157.9	51.7	0	0	0	0	106.4	T191	T191-T193 VanDerWaalsContact C-N 3.34Å; T191-T193 PolarHBondContact O-N 2.91Å
194	A	46	Very low	39.7	Very low	72 Å²	72	141 Å²	141	60%	0.595	78%	0.776	S	S	*	*			trans	-47.2	139.4	161.1	0	0	0	0	0	110.6
195	D	43.6	Very low	39.8	Very low	139 Å²	139	140.8 Å²	140.8	74%	0.743	77%	0.773	S	S	*	*			trans	59.9	93.7	148.8	-49.5	-26.5	0	0	0	115.9
196	I	40.1	Very low	40.2	Very low	150 Å²	150	139 Å²	139	77%	0.769	77%	0.773	S	S	*	*				51.6	97.9	90.5	-54.9	165.8	0	0	0	110.9
197	E	41	Very low	40.7	Very low	182 Å²	182	137 Å²	137	85%	0.85	78%	0.776	S	S	*	*				-158.9	114.1	123	-106	172.6	-157.5	0	0	107.7	P199	E197-P199 WeakPolarHBondContact O-CD 3.43Å
198	V	37.9	Very low	40.7	Very low	133 Å²	133	137.7 Å²	137.7	81%	0.806	78%	0.776	S	S	*	*			trans	-66	115.9	172.3	173.1	0	0	0	0	107.2	G200	V198-G200 PolarHBondContact O-N 3.37Å
199	P	45.3	Very low	41	Very low	128 Å²	128	139.7 Å²	139.7	83%	0.831	78%	0.783	S	S	*	*			trans	-68.7	103.8	164.8	-13.4	30.6	0	0	0	106.9	E197	E197-P199 WeakPolarHBondContact O-CD 3.43Å
200	G	35.8	Very low	40.7	Very low	52 Å²	52	139.8 Å²	139.8	54%	0.536	78%	0.784	S	S	.	*			trans	-70.3	134.1	168.9	0	0	0	0	0	110.1	V198	V198-G200 PolarHBondContact O-N 3.37Å
201	I	37.5	Very low	40.9	Very low	161 Å²	161	143.5 Å²	143.5	83%	0.826	79%	0.785	S	S	*	*			trans	70.9	116.9	149.8	-58.4	154.7	0	0	0	111.3
202	E	38.7	Very low	40.8	Very low	186 Å²	186	147 Å²	147	87%	0.869	79%	0.793	S	S	*	*				-155.6	152.8	75.4	-80	177.2	178.7	0	0	112.6
203	R	35.4	Very low	41	Very low	235 Å²	235	146.6 Å²	146.6	89%	0.887	79%	0.791	S	S	*	*			trans	-86.9	156.6	-177.3	-162.5	-175.9	-172.7	-172.7	0.8	109.5
204	E	44.2	Very low	41.1	Very low	165 Å²	165	149.9 Å²	149.9	77%	0.771	80%	0.797	S	S	*	*			trans	84.3	151.4	164.9	-81.5	-163.7	152.2	0	0	119.5
205	P	46.3	Very low	41.1	Very low	104 Å²	104	151.9 Å²	151.9	68%	0.675	81%	0.807	S	S	*	*			cis	-120.9	153.6	5.4	29.6	-10.3	0	0	0	114.8	P207	P205-P207 WeakPolarHBondContact O-CD 3.44Å
206	T	42	Very low	41.4	Very low	123 Å²	123	152.4 Å²	152.4	76%	0.755	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-52.5	119.6	164.1	-16.8	0	0	0	0	109.4	T208	T206-T208 PolarHBondContact O-N 2.88Å
207	P	46	Very low	41.9	Very low	112 Å²	112	153.7 Å²	153.7	73%	0.727	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-69.7	129.6	175.7	27.6	-31.1	0	0	0	109	P205 M209	P205-P207 WeakPolarHBondContact O-CD 3.44Å; P207-M209 PolarHBondContact O-N 3.35Å
208	T	40.4	Very low	42.6	Very low	142 Å²	142	151.5 Å²	151.5	87%	0.871	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-59.4	120.7	169.3	34.6	0	0	0	0	109.2	T206 E210	T206-T208 PolarHBondContact O-N 2.88Å; T208-E210 PolarHBondContact O-N 3.36Å
209	M	40.9	Very low	43.3	Very low	178 Å²	178	152.1 Å²	152.1	88%	0.877	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-68.2	118.4	173	-58	-153.4	-45.5	0	0	109.1	P207	P207-M209 PolarHBondContact O-N 3.35Å
210	E	36.7	Very low	43.9	Very low	182 Å²	182	150.3 Å²	150.3	85%	0.85	80%	0.801	S	S	*	*			trans	-158.7	93.4	151.5	-103.6	168.8	-141.9	0	0	105	T208	T208-E210 PolarHBondContact O-N 3.36Å
211	N	39.5	Very low	45.1	Very low	158 Å²	158	154.4 Å²	154.4	85%	0.845	81%	0.811	S	S	*	*			trans	-160.5	112.1	146.6	-84.2	-31.4	0	0	0	107.2	D213	N211-D213 PolarHBondContact O-N 3.46Å
212	E	36.6	Very low	46.2	Very low	191 Å²	191	152.1 Å²	152.1	89%	0.893	80%	0.796	S	S	*	*			trans	-59.1	118.5	158	-57.5	177.3	156.3	0	0	107.4
213	D	47.3	Very low	47.4	Very low	160 Å²	160	146 Å²	146	86%	0.856	78%	0.778	S	S	*	*			trans	-147.6	116.9	159.4	-91.5	-37	0	0	0	108.3	N211	N211-D213 PolarHBondContact O-N 3.46Å
214	E	40.9	Very low	48.9	Very low	195 Å²	195	142.5 Å²	142.5	91%	0.911	77%	0.766	S	S	*	*			trans	-70.4	135.9	-178.4	-61.2	163.4	150.1	0	0	111.1
215	S	47.8	Very low	49.5	Very low	113 Å²	113	141.7 Å²	141.7	79%	0.79	76%	0.757	S	S	*	*			trans	-175.9	87.4	150.4	-179.7	0	0	0	0	111
216	D	48.3	Very low	50.3	Low	150 Å²	150	144.1 Å²	144.1	80%	0.802	76%	0.759	S	S	*	*			trans	-85.2	168	160.5	-66	-35.3	0	0	0	110
217	E	50.4	Low	51.2	Low	178 Å²	178	147.9 Å²	147.9	83%	0.832	76%	0.76	S	S	*	*			trans	99.2	132.6	175.7	-58.6	157.5	-178.5	0	0	115.4
218	D	56	Low	51.5	Low	135 Å²	135	149.1 Å²	149.1	72%	0.722	76%	0.755	S	S	*	*			cis	-168.9	111.5	6.9	-106.8	-22.3	0	0	0	109.7
219	T	52.6	Low	52.2	Low	147 Å²	147	148.7 Å²	148.7	90%	0.902	75%	0.747	S	S	*	*			trans	-163.3	66.7	157.6	-21.7	0	0	0	0	110.9
220	S	58.6	Low	52.8	Low	90 Å²	90	145.7 Å²	145.7	63%	0.629	74%	0.741	S	S	*	*			trans	-79.4	136.2	-171.1	61.1	0	0	0	0	113.6	E222	S220-E222 PolarHBondContact O-N 3.39Å
221	D	61.7	Low	53.4	Low	137 Å²	137	145.1 Å²	145.1	73%	0.733	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-0.3	174.9	-68.5	-34.9	0	0	0	114.5	A223 Y224 Y225	D221-A223 PolarHBondContact O-N 3.5Å; D221-Y224 PolarHBondContact O-N 2.8Å; D221-Y225 HydrophobicContact CB-CE2 4.47Å; D221-Y225 VanDerWaalsContact O-CD2 3.24Å; D221-Y225 WeakPolarHBondContact O-CD2 3.35Å
222	E	59.4	Low	54.1	Low	113 Å²	113	145.3 Å²	145.3	53%	0.528	74%	0.736	S	S	.	*	H	α-helix	trans	-66	-34.9	-176.2	-166.8	54.5	-139.6	0	0	112.9	S220 Y224 Y225	S220-E222 PolarHBondContact O-N 3.39Å; E222-Y224 PolarHBondContact O-N 2.75Å; E222-Y225 PolarHBondContact O-N 3.29Å
223	A	63.8	Low	55.1	Low	59 Å²	59	138.8 Å²	138.8	49%	0.488	71%	0.71	S	S	.	*	H	α-helix	trans	-67.3	-20.9	-178.4	0	0	0	0	0	113.8	D221	D221-A223 PolarHBondContact O-N 3.5Å
224	Y	66.8	Low	55.6	Low	160 Å²	160	139 Å²	139	63%	0.627	71%	0.706	S	S	*	*	H	α-helix	trans	-79.3	-37.9	-179.6	-178.7	-101.4	0	0	0	111.9	D221 E222	D221-Y224 PolarHBondContact O-N 2.8Å; E222-Y224 PolarHBondContact O-N 2.75Å
225	Y	57.6	Low	56.6	Low	148 Å²	148	136.8 Å²	136.8	58%	0.58	70%	0.695	S	S	*	*	H	α-helix	trans	-72	-31.8	-174.6	-71.3	-71.2	0	0	0	113.3	D221 E222 R227	D221-Y225 HydrophobicContact CB-CE2 4.47Å; D221-Y225 VanDerWaalsContact O-CD2 3.24Å; D221-Y225 WeakPolarHBondContact O-CD2 3.35Å; E222-Y225 PolarHBondContact O-N 3.29Å; Y225-R227 VanDerWaalsContact C-N 3.3Å; Y225-R227 PolarHBondContact O-N 3.16Å
226	Q	62.4	Low	57.4	Low	156 Å²	156	138.4 Å²	138.4	73%	0.729	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-26.6	-179.3	-73.4	-179.9	-6.2	0	0	114.5
227	R	62.5	Low	58.4	Low	201 Å²	201	135.3 Å²	135.3	76%	0.758	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-18.9	-174.2	-70.4	-174.4	-150.5	-178.9	6.5	115.1	Y225	Y225-R227 VanDerWaalsContact C-N 3.3Å; Y225-R227 PolarHBondContact O-N 3.16Å
228	H	51.3	Low	59.4	Low	138 Å²	138	131.2 Å²	131.2	64%	0.639	66%	0.661	S	S	*	*	S	Bend	trans	-125	12.7	-163.4	-68.5	-57.6	0	0	0	115.7
229	L	54.8	Low	60.3	Low	133 Å²	133	127.5 Å²	127.5	70%	0.696	64%	0.641	S	S	*	*	S	Bend	trans	-80.4	132.1	167.1	-100.8	76.4	0	0	0	111.7	M231	L229-M231 PolarHBondContact O-N 3.12Å
230	P	52.8	Low	61.4	Low	116 Å²	116	122.8 Å²	122.8	75%	0.753	62%	0.617	S	S	*	*			trans	-71.8	103.9	-178.7	27	-31.4	0	0	0	110.7	E232	P230-E232 PolarHBondContact O-N 3.45Å
231	M	49.7	Very low	62.3	Low	170 Å²	170	123.3 Å²	123.3	84%	0.837	61%	0.61	S	S	*	*			trans	-65.4	78	168.3	-69.1	-150.2	-43.9	0	0	111.3	L229 T233	L229-M231 PolarHBondContact O-N 3.12Å; M231-T233 PolarHBondContact O-N 2.93Å
232	E	54.1	Low	62.9	Low	162 Å²	162	124 Å²	124	76%	0.757	60%	0.602	S	S	*	*			trans	-71.7	84.8	153.3	-74	-163.1	164.8	0	0	107.3	P230 E234	P230-E232 PolarHBondContact O-N 3.45Å; E232-E234 PolarHBondContact O-N 2.9Å; E232-E234 VanDerWaalsContact O-N 3.16Å
233	T	59.3	Low	63.9	Low	54 Å²	54	124 Å²	124	33%	0.331	60%	0.598	S	S	.	*			trans	-32.4	115.7	-174	57.9	0	0	0	0	111.9	M231 E235 K236	M231-T233 PolarHBondContact O-N 2.93Å; T233-E235 PolarHBondContact O-N 3.06Å; T233-K236 PolarHBondContact O-N 2.76Å
234	E	56.5	Low	64.9	Low	165 Å²	165	129.5 Å²	129.5	77%	0.771	61%	0.605	S	S	*	*	H	α-helix	trans	-44.3	-34.7	-178.2	-63.5	173.6	166	0	0	112	E232 K236 V237 V238	E232-E234 PolarHBondContact O-N 2.9Å; E232-E234 VanDerWaalsContact O-N 3.16Å; E234-K236 VanDerWaalsContact C-N 3.31Å; E234-K236 PolarHBondContact O-N 3.41Å; E234-V237 PolarHBondContact O-N 3.36Å; E234-V238 WeakPolarHBondContact O-CB 3.46Å; E234-V238 VanDerWaalsContact O-CG2 3.29Å; E234-V238 WeakPolarHBondContact O-CG2 3.46Å; E234-V238 PolarHBondContact O-N 2.85Å
235	E	62.8	Low	65.8	Low	147 Å²	147	127 Å²	127	69%	0.687	60%	0.602	S	S	*	*	H	α-helix	trans	-50.8	-41.2	173.6	-162.3	-168.6	173.6	0	0	114.2	T233 N239	T233-E235 PolarHBondContact O-N 3.06Å; E235-N239 WeakPolarHBondContact O-CB 3.41Å; E235-N239 PolarHBondContact O-N 3.32Å
236	K	64.8	Low	67.1	Low	147 Å²	147	124.3 Å²	124.3	64%	0.639	60%	0.596	S	S	*	*	H	α-helix	trans	-68.5	-39.1	178.7	-74.2	176.9	-176.2	168	0	111.5	T233 E234 A240	T233-K236 PolarHBondContact O-N 2.76Å; E234-K236 VanDerWaalsContact C-N 3.31Å; E234-K236 PolarHBondContact O-N 3.41Å; K236-A240 VanDerWaalsContact O-CB 3.3Å; K236-A240 WeakPolarHBondContact O-CB 3.33Å; K236-A240 PolarHBondContact O-N 2.87Å
237	V	68.4	Low	68.2	Low	85 Å²	85	125 Å²	125	52%	0.515	59%	0.592	S	S	.	*	H	α-helix	trans	-68.2	-50.1	177.8	-179	0	0	0	0	109.6	E234 N239 A240 E241	E234-V237 PolarHBondContact O-N 3.36Å; V237-N239 VanDerWaalsContact C-N 3.31Å; V237-N239 PolarHBondContact O-N 2.84Å; V237-A240 WeakPolarHBondContact O-CB 3.43Å; V237-A240 PolarHBondContact O-N 3.02Å; V237-A240 VanDerWaalsContact O-N 3.12Å; V237-E241 PolarHBondContact O-N 2.9Å
238	V	71.5	Confident	69.2	Low	92 Å²	92	118.1 Å²	118.1	56%	0.558	58%	0.579	S	S	*	*	H	α-helix	trans	-57.4	-43.8	175.8	173.1	0	0	0	0	111	E234 E241 R242	E234-V238 WeakPolarHBondContact O-CB 3.46Å; E234-V238 VanDerWaalsContact O-CG2 3.29Å; E234-V238 WeakPolarHBondContact O-CG2 3.46Å; E234-V238 PolarHBondContact O-N 2.85Å; V238-E241 PolarHBondContact O-N 2.97Å; V238-R242 WeakPolarHBondContact O-CB 3.48Å; V238-R242 PolarHBondContact O-N 3.08Å
239	N	76	Confident	70.6	Confident	57 Å²	57	119.2 Å²	119.2	31%	0.305	58%	0.577	S	S	.	*	H	α-helix	trans	-70.8	-34.3	179	-164.4	-2.1	0	0	0	112.1	E235 V237 E241 R243	E235-N239 WeakPolarHBondContact O-CB 3.41Å; E235-N239 PolarHBondContact O-N 3.32Å; V237-N239 VanDerWaalsContact C-N 3.31Å; V237-N239 PolarHBondContact O-N 2.84Å; N239-E241 VanDerWaalsContact C-N 3.35Å; N239-R243 PolarHBondContact ND2-NH1 2.65Å; N239-R243 WeakPolarHBondContact O-CB 3.02Å; N239-R243 WeakPolarHBondContact O-CG 3.32Å; N239-R243 PolarHBondContact O-N 3.01Å; N239-R243 PolarHBondContact O-NE 2.85Å; N239-R243 PolarHBondContact OD1-NH1 3.16Å
240	A	73.8	Confident	72	Confident	49 Å²	49	117.4 Å²	117.4	41%	0.405	57%	0.566	S	S	.	*	H	α-helix	trans	-64.4	-40.8	171.7	0	0	0	0	0	111.8	K236 V237 R243 R244	K236-A240 VanDerWaalsContact O-CB 3.3Å; K236-A240 WeakPolarHBondContact O-CB 3.33Å; K236-A240 PolarHBondContact O-N 2.87Å; V237-A240 WeakPolarHBondContact O-CB 3.43Å; V237-A240 PolarHBondContact O-N 3.02Å; V237-A240 VanDerWaalsContact O-N 3.12Å; A240-R243 PolarHBondContact O-N 3.35Å; A240-R244 PolarHBondContact O-N 3.12Å
241	E	77.8	Confident	73.5	Confident	100 Å²	100	119.1 Å²	119.1	47%	0.467	56%	0.562	S	S	.	*	H	α-helix	trans	-67.7	-44.7	175.4	-175.1	150.5	-137	0	0	112.3	V237 V238 N239 R243 R244 L245	V237-E241 PolarHBondContact O-N 2.9Å; V238-E241 PolarHBondContact O-N 2.97Å; N239-E241 VanDerWaalsContact C-N 3.35Å; E241-R243 VanDerWaalsContact C-N 3.31Å; E241-R243 PolarHBondContact O-N 2.82Å; E241-R244 WeakPolarHBondContact O-CA 3.5Å; E241-R244 WeakPolarHBondContact O-CB 3.41Å; E241-R244 PolarHBondContact O-N 2.99Å; E241-L245 HydrophobicContact CG-CD1 4.21Å; E241-L245 HydrophobicContact CG-CG 4.47Å; E241-L245 PolarHBondContact O-N 3.46Å
242	R	73.8	Confident	75.1	Confident	151 Å²	151	120 Å²	120	57%	0.57	56%	0.556	S	S	*	*	H	α-helix	trans	-52.9	-48.1	172.2	-175.5	-177.6	-179.8	-154.8	2.8	111.5	V238 R244 L245 M246	V238-R242 WeakPolarHBondContact O-CB 3.48Å; V238-R242 PolarHBondContact O-N 3.08Å; R242-R244 VanDerWaalsContact C-N 3.33Å; R242-R244 PolarHBondContact O-N 3.43Å; R242-L245 PolarHBondContact O-N 2.91Å; R242-M246 WeakPolarHBondContact O-CB 3.37Å; R242-M246 VanDerWaalsContact O-CG 3.31Å; R242-M246 WeakPolarHBondContact O-CG 3.44Å; R242-M246 PolarHBondContact O-N 3.09Å
243	R	81.6	Confident	76.1	Confident	115 Å²	115	117.2 Å²	117.2	43%	0.434	54%	0.538	S	S	.	.	H	α-helix	trans	-64.1	-36.8	176.9	-74	-176.2	-68.2	-108.5	2.4	112.4	N239 A240 E241 R247	N239-R243 PolarHBondContact ND2-NH1 2.65Å; N239-R243 WeakPolarHBondContact O-CB 3.02Å; N239-R243 WeakPolarHBondContact O-CG 3.32Å; N239-R243 PolarHBondContact O-N 3.01Å; N239-R243 PolarHBondContact O-NE 2.85Å; N239-R243 PolarHBondContact OD1-NH1 3.16Å; A240-R243 PolarHBondContact O-N 3.35Å; E241-R243 VanDerWaalsContact C-N 3.31Å; E241-R243 PolarHBondContact O-N 2.82Å; R243-R247 WeakPolarHBondContact O-CB 3.31Å; R243-R247 VanDerWaalsContact O-CG 3.26Å; R243-R247 WeakPolarHBondContact O-CG 3.49Å; R243-R247 PolarHBondContact O-N 3.36Å; R243-R247 VanDerWaalsContact O-N 3.08Å
244	R	85.2	Confident	77.1	Confident	173 Å²	173	120.3 Å²	120.3	65%	0.653	55%	0.549	S	S	*	.	H	α-helix	trans	-64.4	-47.4	175.9	175.7	-173.9	163.2	-155.3	-4.4	110.8	A240 E241 R242 R247 A248	A240-R244 PolarHBondContact O-N 3.12Å; E241-R244 WeakPolarHBondContact O-CA 3.5Å; E241-R244 WeakPolarHBondContact O-CB 3.41Å; E241-R244 PolarHBondContact O-N 2.99Å; R242-R244 VanDerWaalsContact C-N 3.33Å; R242-R244 PolarHBondContact O-N 3.43Å; R244-R247 PolarHBondContact O-N 3.33Å; R244-A248 PolarHBondContact O-N 3.49Å
245	L	84.8	Confident	78.1	Confident	108 Å²	108	114.8 Å²	114.8	57%	0.565	53%	0.532	S	S	*	.	H	α-helix	trans	-63.5	-45.7	178.2	-70.1	172.6	0	0	0	111.5	E241 R242 R247 A248 W249	E241-L245 HydrophobicContact CG-CD1 4.21Å; E241-L245 HydrophobicContact CG-CG 4.47Å; E241-L245 PolarHBondContact O-N 3.46Å; R242-L245 PolarHBondContact O-N 2.91Å; L245-R247 VanDerWaalsContact C-N 3.34Å; L245-R247 PolarHBondContact O-N 3.45Å; L245-A248 PolarHBondContact O-N 2.75Å; L245-A248 VanDerWaalsContact O-N 3.13Å; L245-W249 PolarHBondContact O-N 2.82Å
246	M	85	Confident	78.9	Confident	92 Å²	92	112.3 Å²	112.3	45%	0.453	52%	0.523	S	S	.	.	H	α-helix	trans	-58.1	-43.7	175.6	-75.1	-65.3	-77.1	0	0	112.4	R242 A248 W249 M250	R242-M246 WeakPolarHBondContact O-CB 3.37Å; R242-M246 VanDerWaalsContact O-CG 3.31Å; R242-M246 WeakPolarHBondContact O-CG 3.44Å; R242-M246 PolarHBondContact O-N 3.09Å; M246-A248 PolarHBondContact O-N 3.06Å; M246-W249 PolarHBondContact O-N 3.35Å; M246-M250 HydrophobicContact CE-CE 4.11Å; M246-M250 WeakPolarHBondContact O-CB 3.35Å; M246-M250 WeakPolarHBondContact O-CG 3.38Å; M246-M250 PolarHBondContact O-N 2.97Å
247	R	85.3	Confident	79.4	Confident	169 Å²	169	108.2 Å²	108.2	64%	0.638	51%	0.508	S	S	*	.	H	α-helix	trans	-65	-39.1	176.3	-73	173.4	-171.9	167.2	3.5	112.4	R243 R244 L245 K251	R243-R247 WeakPolarHBondContact O-CB 3.31Å; R243-R247 VanDerWaalsContact O-CG 3.26Å; R243-R247 WeakPolarHBondContact O-CG 3.49Å; R243-R247 PolarHBondContact O-N 3.36Å; R243-R247 VanDerWaalsContact O-N 3.08Å; R244-R247 PolarHBondContact O-N 3.33Å; L245-R247 VanDerWaalsContact C-N 3.34Å; L245-R247 PolarHBondContact O-N 3.45Å; R247-K251 WeakPolarHBondContact O-CB 3.3Å; R247-K251 WeakPolarHBondContact O-CG 3.48Å; R247-K251 PolarHBondContact O-N 2.98Å
248	A	83.3	Confident	79.7	Confident	58 Å²	58	110.9 Å²	110.9	48%	0.479	51%	0.513	S	S	.	.	H	α-helix	trans	-65	-43	176.5	0	0	0	0	0	111.1	R244 L245 M246 K251 R252	R244-A248 PolarHBondContact O-N 3.49Å; L245-A248 PolarHBondContact O-N 2.75Å; L245-A248 VanDerWaalsContact O-N 3.13Å; M246-A248 PolarHBondContact O-N 3.06Å; A248-K251 PolarHBondContact O-N 2.88Å; A248-R252 PolarHBondContact O-N 3.01Å
249	W	80.7	Confident	79.7	Confident	160 Å²	160	115.1 Å²	115.1	61%	0.606	52%	0.518	S	S	*	.	H	α-helix	trans	-64.6	-47.8	176.5	-177.9	87.4	0	0	0	112.3	L245 M246 K251 R252 R253	L245-W249 PolarHBondContact O-N 2.82Å; M246-W249 PolarHBondContact O-N 3.35Å; W249-K251 VanDerWaalsContact C-N 3.29Å; W249-K251 PolarHBondContact O-N 3.34Å; W249-R252 WeakPolarHBondContact O-CB 3.48Å; W249-R252 PolarHBondContact O-N 3.41Å; W249-R252 VanDerWaalsContact O-N 3.08Å; W249-R253 PolarHBondContact O-N 3.37Å
250	M	85.7	Confident	79.4	Confident	95 Å²	95	117.9 Å²	117.9	47%	0.468	53%	0.53	S	S	.	.	H	α-helix	trans	-58.3	-40.6	175.9	-74	-178.2	-173.7	0	0	112	M246 R253 Q254	M246-M250 HydrophobicContact CE-CE 4.11Å; M246-M250 WeakPolarHBondContact O-CB 3.35Å; M246-M250 WeakPolarHBondContact O-CG 3.38Å; M246-M250 PolarHBondContact O-N 2.97Å; M250-R253 PolarHBondContact O-N 3.47Å; M250-Q254 WeakPolarHBondContact O-CB 3.43Å; M250-Q254 WeakPolarHBondContact O-CG 3.46Å; M250-Q254 PolarHBondContact O-N 3.07Å
251	K	84	Confident	78.8	Confident	153 Å²	153	120.6 Å²	120.6	67%	0.665	53%	0.534	S	S	*	.	H	α-helix	trans	-62.5	-44.6	174.4	-80	-179.2	177.1	-176.7	0	112.1	R247 A248 W249 R253 Q254 A255	R247-K251 WeakPolarHBondContact O-CB 3.3Å; R247-K251 WeakPolarHBondContact O-CG 3.48Å; R247-K251 PolarHBondContact O-N 2.98Å; A248-K251 PolarHBondContact O-N 2.88Å; W249-K251 VanDerWaalsContact C-N 3.29Å; W249-K251 PolarHBondContact O-N 3.34Å; K251-R253 VanDerWaalsContact C-N 3.34Å; K251-Q254 PolarHBondContact O-N 2.7Å; K251-A255 WeakPolarHBondContact O-CB 3.3Å; K251-A255 PolarHBondContact O-N 3.27Å
252	R	83	Confident	78.1	Confident	187 Å²	187	119.2 Å²	119.2	71%	0.706	54%	0.535	S	S	*	.	H	α-helix	trans	-62.3	-42.8	176.4	-170.3	173.9	-176.5	172.3	0.3	110.8	A248 W249 A255 L256	A248-R252 PolarHBondContact O-N 3.01Å; W249-R252 WeakPolarHBondContact O-CB 3.48Å; W249-R252 PolarHBondContact O-N 3.41Å; W249-R252 VanDerWaalsContact O-N 3.08Å; R252-A255 PolarHBondContact O-N 2.7Å; R252-L256 WeakPolarHBondContact O-CG 3.22Å; R252-L256 PolarHBondContact O-N 3.5Å
253	R	74.5	Confident	77.6	Confident	104 Å²	104	117.5 Å²	117.5	39%	0.392	54%	0.537	S	S	.	.	H	α-helix	trans	-64.1	-46	176.7	-179.8	57.9	177.3	139.8	-2.5	112.4	W249 M250 K251 A255 L256 L257	W249-R253 PolarHBondContact O-N 3.37Å; M250-R253 PolarHBondContact O-N 3.47Å; K251-R253 VanDerWaalsContact C-N 3.34Å; R253-A255 VanDerWaalsContact C-N 3.3Å; R253-A255 PolarHBondContact O-N 3.5Å; R253-L256 PolarHBondContact O-N 3.49Å; R253-L256 VanDerWaalsContact O-N 3.16Å; R253-L257 HydrophobicContact CG-CD1 4.25Å; R253-L257 VanDerWaalsContact CZ-CD2 3.44Å; R253-L257 VanDerWaalsContact NH1-CD2 3.31Å; R253-L257 PolarHBondContact O-N 3.25Å
254	Q	81.2	Confident	76.3	Confident	119 Å²	119	115 Å²	115	56%	0.556	54%	0.537	S	S	*	.	H	α-helix	trans	-61.5	-38.4	175.4	-76.4	-179.4	-5.3	0	0	111.9	M250 K251 L256 L257 K258	M250-Q254 WeakPolarHBondContact O-CB 3.43Å; M250-Q254 WeakPolarHBondContact O-CG 3.46Å; M250-Q254 PolarHBondContact O-N 3.07Å; K251-Q254 PolarHBondContact O-N 2.7Å; Q254-L256 VanDerWaalsContact C-N 3.34Å; Q254-L257 PolarHBondContact O-N 2.9Å; Q254-K258 WeakPolarHBondContact O-CB 3.32Å; Q254-K258 VanDerWaalsContact O-CG 3.32Å; Q254-K258 WeakPolarHBondContact O-CG 3.42Å; Q254-K258 PolarHBondContact O-N 2.89Å
255	A	77	Confident	74.6	Confident	50 Å²	50	114.7 Å²	114.7	41%	0.413	54%	0.536	S	S	.	.	H	α-helix	trans	-64.2	-39.5	174.4	0	0	0	0	0	112	K251 R252 R253 R259	K251-A255 WeakPolarHBondContact O-CB 3.3Å; K251-A255 PolarHBondContact O-N 3.27Å; R252-A255 PolarHBondContact O-N 2.7Å; R253-A255 VanDerWaalsContact C-N 3.3Å; R253-A255 PolarHBondContact O-N 3.5Å; A255-R259 WeakPolarHBondContact O-CG 3.31Å; A255-R259 PolarHBondContact O-N 2.9Å; A255-R259 VanDerWaalsContact O-N 3.09Å
256	L	78.6	Confident	72.9	Confident	94 Å²	94	111.5 Å²	111.5	49%	0.492	52%	0.523	S	S	.	.	H	α-helix	trans	-68.7	-42.4	175.1	-70.3	172.4	0	0	0	112.3	R252 R253 Q254 R259 Q260	R252-L256 WeakPolarHBondContact O-CG 3.22Å; R252-L256 PolarHBondContact O-N 3.5Å; R253-L256 PolarHBondContact O-N 3.49Å; R253-L256 VanDerWaalsContact O-N 3.16Å; Q254-L256 VanDerWaalsContact C-N 3.34Å; L256-R259 WeakPolarHBondContact O-CB 3.25Å; L256-R259 PolarHBondContact O-N 2.89Å; L256-Q260 PolarHBondContact O-N 3.13Å
257	L	76.8	Confident	71.2	Confident	61 Å²	61	110.7 Å²	110.7	32%	0.319	52%	0.519	S	S	.	.	H	α-helix	trans	-62.2	-44.8	175.5	-79.4	173.5	0	0	0	111.7	R253 Q254 R259 Q260 E261	R253-L257 HydrophobicContact CG-CD1 4.25Å; R253-L257 VanDerWaalsContact CZ-CD2 3.44Å; R253-L257 VanDerWaalsContact NH1-CD2 3.31Å; R253-L257 PolarHBondContact O-N 3.25Å; Q254-L257 PolarHBondContact O-N 2.9Å; L257-R259 VanDerWaalsContact C-N 3.29Å; L257-R259 PolarHBondContact O-N 3.2Å; L257-Q260 CarbonylContact O-C 3.55Å; L257-Q260 WeakPolarHBondContact O-CA 3.34Å; L257-Q260 WeakPolarHBondContact O-CB 3.47Å; L257-Q260 PolarHBondContact O-N 3.1Å; L257-E261 PolarHBondContact O-N 3.33Å
258	K	73.3	Confident	69.4	Low	142 Å²	142	104.5 Å²	104.5	62%	0.617	51%	0.507	S	S	*	.	H	α-helix	trans	-60.8	-38.6	174.8	-75.8	-178.6	177.3	-170.9	0	112.5	Q254 Q260 S262	Q254-K258 WeakPolarHBondContact O-CB 3.32Å; Q254-K258 VanDerWaalsContact O-CG 3.32Å; Q254-K258 WeakPolarHBondContact O-CG 3.42Å; Q254-K258 PolarHBondContact O-N 2.89Å; K258-Q260 VanDerWaalsContact C-N 3.34Å; K258-S262 WeakPolarHBondContact O-CB 3.13Å; K258-S262 PolarHBondContact O-N 2.7Å; K258-S262 PolarHBondContact O-OG 2.74Å
259	R	72.7	Confident	67.5	Low	180 Å²	180	108.9 Å²	108.9	68%	0.679	51%	0.511	S	S	*	.	H	α-helix	trans	-63.6	-41.8	172.8	-76.7	178	178.9	-129.4	0.2	111.1	A255 L256 L257 S262 L263	A255-R259 WeakPolarHBondContact O-CG 3.31Å; A255-R259 PolarHBondContact O-N 2.9Å; A255-R259 VanDerWaalsContact O-N 3.09Å; L256-R259 WeakPolarHBondContact O-CB 3.25Å; L256-R259 PolarHBondContact O-N 2.89Å; L257-R259 VanDerWaalsContact C-N 3.29Å; L257-R259 PolarHBondContact O-N 3.2Å; R259-S262 WeakPolarHBondContact CA-OG 3.49Å; R259-S262 PolarHBondContact O-N 2.76Å; R259-S262 PolarHBondContact O-OG 3.34Å; R259-L263 WeakPolarHBondContact O-CG 3.35Å; R259-L263 PolarHBondContact O-N 3.12Å
260	Q	69.7	Low	65.6	Low	116 Å²	116	104.1 Å²	104.1	54%	0.542	50%	0.502	S	S	.	.	H	α-helix	trans	-68.1	-40.4	177	-169	177.9	2.9	0	0	112.5	L256 L257 K258 L263 S264	L256-Q260 PolarHBondContact O-N 3.13Å; L257-Q260 CarbonylContact O-C 3.55Å; L257-Q260 WeakPolarHBondContact O-CA 3.34Å; L257-Q260 WeakPolarHBondContact O-CB 3.47Å; L257-Q260 PolarHBondContact O-N 3.1Å; K258-Q260 VanDerWaalsContact C-N 3.34Å; Q260-L263 CarbonylContact O-C 2.74Å; Q260-L263 WeakPolarHBondContact O-CA 3.21Å; Q260-L263 WeakPolarHBondContact O-CB 3.36Å; Q260-L263 PolarHBondContact O-N 3.17Å; Q260-L263 VanDerWaalsContact O-N 3.17Å; Q260-S264 PolarHBondContact O-N 3.42Å
261	E	61.8	Low	63.3	Low	106 Å²	106	109.4 Å²	109.4	50%	0.495	52%	0.517	S	S	.	.	H	α-helix	trans	-63	-41.6	172.8	-76.9	173.8	-179.5	0	0	111.2	L257 L263 S264 W265	L257-E261 PolarHBondContact O-N 3.33Å; E261-L263 PolarHBondContact O-N 2.86Å; E261-S264 WeakPolarHBondContact CA-OG 3.42Å; E261-S264 CarbonylContact O-C 3.53Å; E261-S264 PolarHBondContact O-N 3.2Å; E261-S264 VanDerWaalsContact O-N 3.13Å; E261-S264 PolarHBondContact O-OG 3.17Å; E261-S264 VanDerWaalsContact O-OG 3.12Å; E261-W265 VanDerWaalsContact O-CB 3.28Å; E261-W265 WeakPolarHBondContact O-CB 2.87Å; E261-W265 PolarHBondContact O-N 3.04Å
262	S	62.1	Low	61.3	Low	71 Å²	71	107.6 Å²	107.6	50%	0.497	52%	0.523	S	S	.	.	H	α-helix	trans	-63.3	-33.2	174.1	64.9	0	0	0	0	112.1	K258 R259 S266	K258-S262 WeakPolarHBondContact O-CB 3.13Å; K258-S262 PolarHBondContact O-N 2.7Å; K258-S262 PolarHBondContact O-OG 2.74Å; R259-S262 WeakPolarHBondContact CA-OG 3.49Å; R259-S262 PolarHBondContact O-N 2.76Å; R259-S262 PolarHBondContact O-OG 3.34Å; S262-S266 WeakPolarHBondContact O-CB 3.28Å; S262-S266 PolarHBondContact O-N 3.46Å
263	L	63.2	Low	59.1	Low	115 Å²	115	102.2 Å²	102.2	60%	0.602	51%	0.514	S	S	*	.	H	α-helix	trans	-73.1	-37.9	172	-70.6	165.9	0	0	0	111.4	R259 Q260 E261 S266 M267	R259-L263 WeakPolarHBondContact O-CG 3.35Å; R259-L263 PolarHBondContact O-N 3.12Å; Q260-L263 CarbonylContact O-C 2.74Å; Q260-L263 WeakPolarHBondContact O-CA 3.21Å; Q260-L263 WeakPolarHBondContact O-CB 3.36Å; Q260-L263 PolarHBondContact O-N 3.17Å; Q260-L263 VanDerWaalsContact O-N 3.17Å; E261-L263 PolarHBondContact O-N 2.86Å; L263-S266 WeakPolarHBondContact O-CB 3.12Å; L263-M267 WeakPolarHBondContact O-CB 3.44Å; L263-M267 WeakPolarHBondContact O-CG 3.3Å; L263-M267 PolarHBondContact O-N 3.07Å
264	S	54.7	Low	57.3	Low	63 Å²	63	102.6 Å²	102.6	44%	0.441	53%	0.533	S	S	.	.	H	α-helix	trans	-75.2	-23	177.3	73.7	0	0	0	0	113.3	Q260 E261 M267 G268	Q260-S264 PolarHBondContact O-N 3.42Å; E261-S264 WeakPolarHBondContact CA-OG 3.42Å; E261-S264 CarbonylContact O-C 3.53Å; E261-S264 PolarHBondContact O-N 3.2Å; E261-S264 VanDerWaalsContact O-N 3.13Å; E261-S264 PolarHBondContact O-OG 3.17Å; E261-S264 VanDerWaalsContact O-OG 3.12Å; S264-M267 CarbonylContact O-C 2.91Å; S264-M267 WeakPolarHBondContact O-CA 3.37Å; S264-M267 PolarHBondContact O-N 2.87Å; S264-M267 VanDerWaalsContact O-O 3.1Å; S264-G268 PolarHBondContact O-N 2.87Å
265	W	49	Very low	55.4	Low	166 Å²	166	105 Å²	105	63%	0.629	55%	0.549	S	S	*	.	H	α-helix	trans	-86.6	-37.5	174.5	-79.4	39.4	0	0	0	112	E261 M267 G268 I302	E261-W265 VanDerWaalsContact O-CB 3.28Å; E261-W265 WeakPolarHBondContact O-CB 2.87Å; E261-W265 PolarHBondContact O-N 3.04Å; W265-M267 PolarHBondContact O-N 3.29Å; W265-G268 PolarHBondContact O-N 3.35Å; W265-I302 WeakPolarHBondContact O-CD1 3.22Å; W265-I302 VanDerWaalsContact O-CG1 3.26Å; W265-I302 WeakPolarHBondContact O-CG1 3.16Å
266	S	50.2	Low	53.4	Low	41 Å²	41	110.2 Å²	110.2	29%	0.287	57%	0.57	S	S	.	*	H	α-helix	trans	-45.1	-49.1	156.5	167.1	0	0	0	0	106.7	S262 L263 G268 I300 T301 I302	S262-S266 WeakPolarHBondContact O-CB 3.28Å; S262-S266 PolarHBondContact O-N 3.46Å; L263-S266 WeakPolarHBondContact O-CB 3.12Å; S266-G268 VanDerWaalsContact C-N 3.25Å; S266-G268 PolarHBondContact O-N 3.42Å; S266-I300 CarbonylContact C-O 3.52Å; S266-I300 CarbonylContact O-C 2.97Å; S266-T301 CarbonylContact O-C 3Å; S266-T301 WeakPolarHBondContact O-CA 3.26Å; S266-T301 PolarHBondContact O-N 3.43Å; S266-I302 VanDerWaalsContact O-CG1 3.29Å; S266-I302 WeakPolarHBondContact O-CG1 3.44Å
267	M	48.8	Very low	51.1	Low	75 Å²	75	112.9 Å²	112.9	37%	0.369	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.8	27.5	174	-46.2	-92.7	-103.4	0	0	117.5	L263 S264 W265 S299 I300	L263-M267 WeakPolarHBondContact O-CB 3.44Å; L263-M267 WeakPolarHBondContact O-CG 3.3Å; L263-M267 PolarHBondContact O-N 3.07Å; S264-M267 CarbonylContact O-C 2.91Å; S264-M267 WeakPolarHBondContact O-CA 3.37Å; S264-M267 PolarHBondContact O-N 2.87Å; S264-M267 VanDerWaalsContact O-O 3.1Å; W265-M267 PolarHBondContact O-N 3.29Å; M267-S299 VanDerWaalsContact CB-CA 3.5Å; M267-S299 WeakPolarHBondContact SD-CA 3.21Å; M267-S299 VanDerWaalsContact SD-CB 3.55Å; M267-I300 VanDerWaalsContact CA-CA 3.42Å; M267-I300 VanDerWaalsContact CA-CB 3.49Å; M267-I300 WeakPolarHBondContact CA-O 3.17Å; M267-I300 HydrophobicContact CB-CB 4.32Å; M267-I300 WeakPolarHBondContact CB-O 3.38Å; M267-I300 WeakPolarHBondContact CG-O 2.92Å; M267-I300 PolarHBondContact N-O 2.96Å; M267-I300 VanDerWaalsContact N-O 3.1Å; M267-I300 WeakPolarHBondContact O-CB 3.26Å; M267-I300 WeakPolarHBondContact O-CD1 2.98Å; M267-I300 WeakPolarHBondContact O-CG1 3.29Å; M267-I300 PolarHBondContact O-N 3.36Å; M267-I300 PolarHBondContact SD-N 3.46Å
268	G	46.9	Very low	49	Very low	38 Å²	38	114.3 Å²	114.3	39%	0.392	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.5	-19.1	170.6	0	0	0	0	0	118.8	S264 W265 S266	S264-G268 PolarHBondContact O-N 2.87Å; W265-G268 PolarHBondContact O-N 3.35Å; S266-G268 VanDerWaalsContact C-N 3.25Å; S266-G268 PolarHBondContact O-N 3.42Å
269	R	43.9	Very low	47.1	Very low	151 Å²	151	114 Å²	114	57%	0.57	61%	0.61	S	S	*	*	B	Isolated β-bridge	trans	-127.2	19.9	-159.5	-65.4	-177.7	-180	-128.5	-0.9	118.8	R271 T301 I302 E303	R269-R271 PolarHBondContact O-N 2.58Å; R269-T301 CarbonylContact C-O 3.05Å; R269-T301 WeakPolarHBondContact CA-O 2.79Å; R269-T301 PolarHBondContact N-O 2.9Å; R269-I302 HydrophobicContact CB-CB 3.79Å; R269-I302 HydrophobicContact CB-CD1 4.43Å; R269-I302 HydrophobicContact CB-CG1 3.76Å; R269-I302 HydrophobicContact CB-CG2 3.52Å; R269-I302 HydrophobicContact CG-CG1 4.4Å; R269-I302 HydrophobicContact CG-CG2 4.23Å; R269-E303 PolarHBondContact O-N 3.25Å; R269-E303 VanDerWaalsContact O-N 3.09Å
270	S	41.5	Very low	45.5	Very low	59 Å²	59	109.9 Å²	109.9	41%	0.413	61%	0.614	S	S	.	*	S	Bend	trans	-91.9	49	164.3	-68.1	0	0	0	0	107.2	T301 I302	S270-T301 WeakPolarHBondContact CA-O 3.49Å; S270-T301 WeakPolarHBondContact CB-O 3.19Å; S270-T301 PolarHBondContact N-O 2.92Å; S270-T301 WeakPolarHBondContact OG-CA 3.41Å; S270-T301 VanDerWaalsContact OG-CB 3.23Å; S270-T301 WeakPolarHBondContact OG-CB 3.48Å; S270-T301 PolarHBondContact OG-N 2.86Å; S270-T301 PolarHBondContact OG-O 3.42Å; S270-I302 PolarHBondContact OG-N 3.08Å
271	R	37.6	Very low	43.8	Very low	207 Å²	207	111.5 Å²	111.5	78%	0.781	63%	0.627	S	S	*	*	S	Bend	trans	-142.7	113.8	163.6	-67.5	-171.9	71.5	-173.6	-1.2	109	R269	R269-R271 PolarHBondContact O-N 2.58Å
272	S	41.2	Very low	42.1	Very low	114 Å²	114	116.5 Å²	116.5	80%	0.797	64%	0.643	S	S	*	*			trans	74.8	95.4	145.8	65.8	0	0	0	0	119.1
273	S	36.7	Very low	40.7	Very low	74 Å²	74	119.3 Å²	119.3	52%	0.517	66%	0.659	S	S	.	*				-134.3	107.6	126.6	67.7	0	0	0	0	111.2	V305	S273-V305 WeakPolarHBondContact OG-CG2 3.46Å
274	S	37.5	Very low	39.2	Very low	113 Å²	113	121.5 Å²	121.5	79%	0.79	67%	0.671	S	S	*	*				-169.9	112.1	121.8	68.7	0	0	0	0	108.2
275	L	40.9	Very low	38.1	Very low	168 Å²	168	122 Å²	122	88%	0.88	69%	0.686	S	S	*	*			trans	-64.4	126.2	159.8	-72	109.9	0	0	0	108.2
276	N	34.3	Very low	37.3	Very low	161 Å²	161	123.7 Å²	123.7	86%	0.861	70%	0.704	S	S	*	*			trans	-157.2	126.1	140.5	-92.5	-13	0	0	0	108.5
277	D	31.4	Very low	36.3	Very low	149 Å²	149	124.8 Å²	124.8	80%	0.797	72%	0.721	S	S	*	*			trans	79.5	116.2	146.1	-141.1	5.2	0	0	0	120.1
278	S	32.5	Very low	35.4	Very low	91 Å²	91	127 Å²	127	64%	0.636	74%	0.744	S	S	*	*			trans	68.2	120.1	141	-76.9	0	0	0	0	120.1
279	T	32.3	Very low	35	Very low	135 Å²	135	130.6 Å²	130.6	83%	0.828	76%	0.761	S	S	*	*			trans	77.9	86.7	146.5	-28.3	0	0	0	0	116.3
280	A	38.6	Very low	34.3	Very low	94 Å²	94	130.3 Å²	130.3	78%	0.777	78%	0.776	S	S	*	*				-171.1	101.7	129.6	0	0	0	0	0	108.4	Y282	A280-Y282 PolarHBondContact O-N 3.25Å
281	D	34	Very low	33.9	Very low	150 Å²	150	131.6 Å²	131.6	80%	0.802	79%	0.79	S	S	*	*			trans	-45.3	131.9	165.2	-65	-65	0	0	0	111.7	P283	D281-P283 WeakPolarHBondContact O-CD 3.05Å
282	Y	27.4	Very low	33.6	Very low	212 Å²	212	130.8 Å²	130.8	83%	0.831	80%	0.797	S	S	*	*			trans	-44.5	119.6	161.6	-68.2	-98.9	0	0	0	110.7	A280 N284	A280-Y282 PolarHBondContact O-N 3.25Å; Y282-N284 PolarHBondContact O-N 3.1Å; Y282-N284 VanDerWaalsContact O-N 3.08Å
283	P	33.2	Very low	33.1	Very low	129 Å²	129	128.8 Å²	128.8	84%	0.838	80%	0.795	S	S	*	*			trans	-72.4	108	154.8	30.3	-26.2	0	0	0	106.4	D281	D281-P283 WeakPolarHBondContact O-CD 3.05Å
284	N	31.7	Very low	32.9	Very low	161 Å²	161	128.7 Å²	128.7	86%	0.861	79%	0.794	S	S	*	*			trans	-31.9	134.9	161.2	-69.2	-50.4	0	0	0	112.9	Y282	Y282-N284 PolarHBondContact O-N 3.1Å; Y282-N284 VanDerWaalsContact O-N 3.08Å
285	G	30.7	Very low	32.9	Very low	73 Å²	73	127.4 Å²	127.4	75%	0.753	78%	0.783	S	S	*	*			trans	174.9	83.2	168.4	0	0	0	0	0	112
286	M	32.1	Very low	32.8	Very low	203 Å²	203	123.3 Å²	123.3	100%	1	77%	0.774	S	S	*	*			trans	-48.2	138.9	166.9	-65.6	-168.7	99.4	0	0	111.4
287	G	28.7	Very low	32.7	Very low	63 Å²	63	121.6 Å²	121.6	65%	0.649	77%	0.765	S	S	*	*			trans	168.8	96.1	161.6	0	0	0	0	0	110.9	P289	G287-P289 WeakPolarHBondContact O-CD 3.2Å
288	S	29.6	Very low	33	Very low	122 Å²	122	119.6 Å²	119.6	85%	0.853	76%	0.758	S	S	*	*			trans	-55.3	127.4	152.3	-84	0	0	0	0	108.8
289	P	40	Very low	32.9	Very low	114 Å²	114	118.9 Å²	118.9	74%	0.74	75%	0.753	S	S	*	*			trans	-103	97.9	145.6	28.1	-9.5	0	0	0	106.5	G287 A291	G287-P289 WeakPolarHBondContact O-CD 3.2Å; P289-A291 PolarHBondContact O-N 3.27Å
290	T	29.2	Very low	32.9	Very low	144 Å²	144	114.5 Å²	114.5	88%	0.883	72%	0.724	S	S	*	*			trans	-54.2	96.1	143.2	23.4	0	0	0	0	107.7
291	A	33	Very low	32.6	Very low	86 Å²	86	114.5 Å²	114.5	71%	0.711	72%	0.715	S	S	*	*			trans	-166.9	117.2	152.3	0	0	0	0	0	109.7	P289	P289-A291 PolarHBondContact O-N 3.27Å
292	M	30.4	Very low	32.4	Very low	190 Å²	190	111 Å²	111	94%	0.936	70%	0.695	S	S	*	*			trans	-54.6	143.3	166.9	-67.8	-130.3	77.5	0	0	111.9
293	G	30	Very low	32.5	Very low	73 Å²	73	108.8 Å²	108.8	75%	0.753	69%	0.692	S	S	*	*			trans	179.6	88.1	170.1	0	0	0	0	0	115.5
294	S	33	Very low	32.9	Very low	72 Å²	72	106.7 Å²	106.7	50%	0.503	69%	0.685	S	S	.	*			trans	68.8	115	151	-100.8	0	0	0	0	121.5	T20 A296	T20-S294 WeakPolarHBondContact CG2-OG 3.38Å; T20-S294 PolarHBondContact OG1-OG 3.24Å; S294-A296 PolarHBondContact O-N 3.33Å
295	P	37.5	Very low	33.1	Very low	85 Å²	85	103.7 Å²	103.7	55%	0.552	67%	0.673	S	S	*	*			trans	-84.8	105.7	176.1	32.9	-34.4	0	0	0	113.6	T20	T20-P295 WeakPolarHBondContact CB-O 3.41Å; T20-P295 VanDerWaalsContact CG2-C 3.43Å; T20-P295 WeakPolarHBondContact CG2-O 3.23Å; T20-P295 WeakPolarHBondContact OG1-CD 3.09Å
296	A	38.7	Very low	33.4	Very low	83 Å²	83	107.5 Å²	107.5	69%	0.686	68%	0.676	S	S	*	*			trans	-91	115.2	168.8	0	0	0	0	0	111.3	S294 T298	S294-A296 PolarHBondContact O-N 3.33Å; A296-T298 PolarHBondContact O-N 3.26Å
297	N	33.6	Very low	33.5	Very low	125 Å²	125	103.4 Å²	103.4	67%	0.668	67%	0.668	S	S	*	*			trans	2.2	104.4	154.4	-58	-28.5	0	0	0	117.4	T21	T21-N297 PolarHBondContact OG1-OD1 3.09Å
298	T	36.3	Very low	33.7	Very low	107 Å²	107	112.1 Å²	112.1	66%	0.656	68%	0.681	S	S	*	*			trans	-148.6	119	146.1	41.7	0	0	0	0	105.5	A296	A296-T298 PolarHBondContact O-N 3.26Å
299	S	31.4	Very low	34	Very low	76 Å²	76	111 Å²	111	53%	0.531	67%	0.673	S	S	.	*				53.9	92.1	66.4	90.4	0	0	0	0	118.9	M267	M267-S299 VanDerWaalsContact CB-CA 3.5Å; M267-S299 WeakPolarHBondContact SD-CA 3.21Å; M267-S299 VanDerWaalsContact SD-CB 3.55Å
300	I	32.4	Very low	34.1	Very low	42 Å²	42	110 Å²	110	22%	0.215	67%	0.674	C	S	.	*			trans	-144.6	158.2	174.3	-41.2	171	0	0	0	105.5	S266 M267	S266-I300 CarbonylContact C-O 3.52Å; S266-I300 CarbonylContact O-C 2.97Å; M267-I300 VanDerWaalsContact CA-CA 3.42Å; M267-I300 VanDerWaalsContact CA-CB 3.49Å; M267-I300 WeakPolarHBondContact CA-O 3.17Å; M267-I300 HydrophobicContact CB-CB 4.32Å; M267-I300 WeakPolarHBondContact CB-O 3.38Å; M267-I300 WeakPolarHBondContact CG-O 2.92Å; M267-I300 PolarHBondContact N-O 2.96Å; M267-I300 VanDerWaalsContact N-O 3.1Å; M267-I300 WeakPolarHBondContact O-CB 3.26Å; M267-I300 WeakPolarHBondContact O-CD1 2.98Å; M267-I300 WeakPolarHBondContact O-CG1 3.29Å; M267-I300 PolarHBondContact O-N 3.36Å; M267-I300 PolarHBondContact SD-N 3.46Å
301	T	30.9	Very low	34.5	Very low	95 Å²	95	112.3 Å²	112.3	58%	0.583	67%	0.674	S	S	*	*			trans	-106.8	-174.3	164.6	-49.9	0	0	0	0	104.7	S266 R269 S270	S266-T301 CarbonylContact O-C 3Å; S266-T301 WeakPolarHBondContact O-CA 3.26Å; S266-T301 PolarHBondContact O-N 3.43Å; R269-T301 CarbonylContact C-O 3.05Å; R269-T301 WeakPolarHBondContact CA-O 2.79Å; R269-T301 PolarHBondContact N-O 2.9Å; S270-T301 WeakPolarHBondContact CA-O 3.49Å; S270-T301 WeakPolarHBondContact CB-O 3.19Å; S270-T301 PolarHBondContact N-O 2.92Å; S270-T301 WeakPolarHBondContact OG-CA 3.41Å; S270-T301 VanDerWaalsContact OG-CB 3.23Å; S270-T301 WeakPolarHBondContact OG-CB 3.48Å; S270-T301 PolarHBondContact OG-N 2.86Å; S270-T301 PolarHBondContact OG-O 3.42Å
302	I	31.5	Very low	34.9	Very low	76 Å²	76	113.7 Å²	113.7	39%	0.39	68%	0.679	S	S	.	*	B	Isolated β-bridge	trans	-126.4	125.7	-178.8	-55.1	-174.8	0	0	0	107.7	W265 S266 R269 S270	W265-I302 WeakPolarHBondContact O-CD1 3.22Å; W265-I302 VanDerWaalsContact O-CG1 3.26Å; W265-I302 WeakPolarHBondContact O-CG1 3.16Å; S266-I302 VanDerWaalsContact O-CG1 3.29Å; S266-I302 WeakPolarHBondContact O-CG1 3.44Å; R269-I302 HydrophobicContact CB-CB 3.79Å; R269-I302 HydrophobicContact CB-CD1 4.43Å; R269-I302 HydrophobicContact CB-CG1 3.76Å; R269-I302 HydrophobicContact CB-CG2 3.52Å; R269-I302 HydrophobicContact CG-CG1 4.4Å; R269-I302 HydrophobicContact CG-CG2 4.23Å; S270-I302 PolarHBondContact OG-N 3.08Å
303	E	28.9	Very low	35.6	Very low	166 Å²	166	112.4 Å²	112.4	78%	0.776	68%	0.676	S	S	*	*			trans	-138.5	160.3	160.2	-76.8	-148	178.7	0	0	113.7	R269	R269-E303 PolarHBondContact O-N 3.25Å; R269-E303 VanDerWaalsContact O-N 3.09Å
304	A	40.5	Very low	36.3	Very low	84 Å²	84	117.9 Å²	117.9	69%	0.694	68%	0.682	S	S	*	*			trans	-91.7	147.4	-136.5	0	0	0	0	0	114.4
305	V	36.2	Very low	37.1	Very low	99 Å²	99	118.3 Å²	118.3	60%	0.6	70%	0.698	S	S	*	*			trans	-118.2	115.2	171.5	178.9	0	0	0	0	109.5	S273	S273-V305 WeakPolarHBondContact OG-CG2 3.46Å
306	D	36.9	Very low	37	Very low	153 Å²	153	119.6 Å²	119.6	82%	0.818	71%	0.709	S	S	*	*			trans	-71.6	145.4	169.3	-74	-46.7	0	0	0	112.1
307	S	35.4	Very low	37	Very low	117 Å²	117	128.6 Å²	128.6	82%	0.818	74%	0.737	S	S	*	*			trans	-135.7	90.3	168.4	-69.3	0	0	0	0	111.5
308	R	32.2	Very low	37.2	Very low	245 Å²	245	128.8 Å²	128.8	93%	0.925	74%	0.74	S	S	*	*			trans	10	133.8	138.9	-161.3	160.5	-169.1	-169.8	5.1	122.8
309	S	35.5	Very low	37.2	Very low	100 Å²	100	129.9 Å²	129.9	70%	0.699	75%	0.745	S	S	*	*			trans	70.3	98.9	141.6	-164.6	0	0	0	0	118.2
310	A	42.1	Very low	37.6	Very low	92 Å²	92	132.9 Å²	132.9	76%	0.76	76%	0.757	S	S	*	*				71.6	112.8	59.4	0	0	0	0	0	113.3
311	H	37.2	Very low	37.9	Very low	192 Å²	192	138.3 Å²	138.3	89%	0.889	79%	0.788	S	S	*	*			trans	-72.2	147.6	-170.9	-86.9	-91.3	0	0	0	113.9
312	S	42.7	Very low	38.3	Very low	115 Å²	115	141 Å²	141	80%	0.804	80%	0.801	S	S	*	*			trans	-78.8	129.4	159.4	-39.8	0	0	0	0	109.1
313	D	45.1	Very low	38.8	Very low	164 Å²	164	145.3 Å²	145.3	88%	0.877	83%	0.829	S	S	*	*			trans	-131.7	120.5	161.8	-115.4	-19.7	0	0	0	107.8
314	E	45.2	Very low	39.5	Very low	187 Å²	187	143.9 Å²	143.9	87%	0.874	83%	0.832	S	S	*	*			trans	-82.3	124.2	172.3	-66.8	-155.2	161.3	0	0	109.5
315	G	48.5	Very low	39.4	Very low	81 Å²	81	148.5 Å²	148.5	84%	0.835	84%	0.843	S	S	*	*			trans	-108.1	113	168.2	0	0	0	0	0	109.6
316	S	35.8	Very low	39.6	Very low	113 Å²	113	152.6 Å²	152.6	79%	0.79	86%	0.863	S	S	*	*			trans	-85.2	124.9	166.6	-61.7	0	0	0	0	110
317	E	39	Very low	39.9	Very low	272 Å²	272	152.5 Å²	152.5	100%	1.271	87%	0.868	S	S	*	*			trans	-173.1	0	132.6	-103.3	-179.8	-179.7	0	0	109.6

Retrieved 317 of 317 residues in 406.4 ms (Link to these results)

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