A0A5K4EJS1_SCHMA Loading...

BZIP domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4EJS1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 162 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	38.1	Very low	39.9	Very low	241 Å²	241	162.7 Å²	162.7	100%	1.187	85%	0.85	S	S	*	*				0	125.3	0	-78.9	-172.1	175.6	0	0	109.4
2	N	40.9	Very low	39.8	Very low	169 Å²	169	169.1 Å²	169.1	90%	0.904	85%	0.854	S	S	*	*			trans	-171.9	106.2	136.2	-105.1	-19.4	0	0	0	109
3	I	37.4	Very low	39.4	Very low	169 Å²	169	164.7 Å²	164.7	87%	0.867	84%	0.841	S	S	*	*			trans	-93.8	117	170.5	-61.6	164.7	0	0	0	105.5
4	S	56.4	Low	39.2	Very low	124 Å²	124	165.3 Å²	165.3	87%	0.867	85%	0.846	S	S	*	*			trans	-109.6	134.5	170.2	-170.8	0	0	0	0	110.4
5	K	42.4	Very low	38.8	Very low	192 Å²	192	165.8 Å²	165.8	84%	0.835	84%	0.84	S	S	*	*			trans	-80.1	142.2	-152.5	-70.3	173.4	173.8	175.1	0	113.7
6	R	36	Very low	38.4	Very low	210 Å²	210	164.9 Å²	164.9	79%	0.792	84%	0.838	S	S	*	*			trans	-34	127	152.9	-165.4	178.8	-178.4	162.1	-0.1	113	D8	R6-D8 HydrophobicContact CG-CB 4.25Å; R6-D8 IonicContact CZ-OD2 3.03Å; R6-D8 IonicContact NE-OD2 3.56Å; R6-D8 PolarHBondContact NE-OD2 3.34Å; R6-D8 IonicContact NH2-OD2 2.63Å; R6-D8 PolarHBondContact NH2-OD2 2.9Å
7	A	42.4	Very low	38.4	Very low	106 Å²	106	166.4 Å²	166.4	88%	0.876	84%	0.84	S	S	*	*			trans	-104.3	88.7	157.4	0	0	0	0	0	107.8
8	D	36.9	Very low	38.2	Very low	104 Å²	104	163.2 Å²	163.2	56%	0.556	84%	0.836	S	S	*	*			trans	-84.4	119.4	164.4	-142.6	-34	0	0	0	106	R6	R6-D8 HydrophobicContact CG-CB 4.25Å; R6-D8 IonicContact CZ-OD2 3.03Å; R6-D8 IonicContact NE-OD2 3.56Å; R6-D8 PolarHBondContact NE-OD2 3.34Å; R6-D8 IonicContact NH2-OD2 2.63Å; R6-D8 PolarHBondContact NH2-OD2 2.9Å
9	N	41.1	Very low	38.4	Very low	169 Å²	169	161.1 Å²	161.1	90%	0.904	83%	0.834	S	S	*	*			trans	-158	100.3	166.5	-96.1	-26	0	0	0	111.3
10	G	34.4	Very low	38.3	Very low	62 Å²	62	160.9 Å²	160.9	64%	0.639	83%	0.833	S	S	*	*				102.9	70.4	122.4	0	0	0	0	0	117.3	R12	G10-R12 PolarHBondContact O-N 3.49Å; G10-R12 VanDerWaalsContact O-N 3.09Å
11	R	32.4	Very low	38	Very low	244 Å²	244	160.9 Å²	160.9	92%	0.921	83%	0.834	S	S	*	*			trans	-43.5	103.9	146.4	-170.5	-175.2	-140.7	-162.3	4.1	110.2
12	R	39.2	Very low	37.9	Very low	239 Å²	239	155.1 Å²	155.1	90%	0.902	81%	0.813	S	S	*	*			trans	-105.6	110.5	161.9	-74.9	-170.1	-159	-156.3	3.6	108.9	G10 L14	G10-R12 PolarHBondContact O-N 3.49Å; G10-R12 VanDerWaalsContact O-N 3.09Å; R12-L14 PolarHBondContact O-N 3.15Å
13	T	34	Very low	37.4	Very low	112 Å²	112	152.7 Å²	152.7	69%	0.687	81%	0.809	S	S	*	*			trans	-66.3	111.2	167.9	47.2	0	0	0	0	109.2
14	L	36.8	Very low	37.5	Very low	173 Å²	173	150.7 Å²	150.7	91%	0.906	81%	0.807	S	S	*	*			trans	-91.3	105.9	166.1	-115.2	145.8	0	0	0	107	R12	R12-L14 PolarHBondContact O-N 3.15Å
15	K	34.1	Very low	36.5	Very low	173 Å²	173	150.3 Å²	150.3	75%	0.752	80%	0.804	S	S	*	*			trans	-70.1	155.3	174.2	-75.2	176.5	172.7	-178.3	0	110.3
16	D	31.8	Very low	35.9	Very low	151 Å²	151	146 Å²	146	81%	0.807	80%	0.798	S	S	*	*			trans	-51.1	132	-175.2	-52.1	-67.7	0	0	0	114.8
17	H	38.3	Very low	35.9	Very low	190 Å²	190	142.7 Å²	142.7	88%	0.88	80%	0.801	S	S	*	*			trans	-136	124	150.5	-74.3	-59.3	0	0	0	109.1
18	S	35.4	Very low	35.3	Very low	110 Å²	110	140.9 Å²	140.9	77%	0.769	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-59.4	150.8	-171.2	-50.8	0	0	0	0	114.8
19	P	41	Very low	35.3	Very low	123 Å²	123	142.5 Å²	142.5	80%	0.799	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-76.8	127.4	-179.8	28.5	-31.5	0	0	0	112.4
20	I	37.2	Very low	35.1	Very low	157 Å²	157	146.1 Å²	146.1	81%	0.805	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-79.2	118.7	164.9	-66.3	172.9	0	0	0	107.5	T22	I20-T22 PolarHBondContact O-N 3.45Å
21	N	32.1	Very low	35.5	Very low	161 Å²	161	147.2 Å²	147.2	86%	0.861	81%	0.811	S	S	*	*			trans	-59.8	111.8	170.2	-83.9	-29.3	0	0	0	110.3
22	T	35.7	Very low	36.1	Very low	120 Å²	120	140.3 Å²	140.3	74%	0.736	80%	0.8	S	S	*	*			trans	-135.4	107.1	159.6	-40.4	0	0	0	0	108.7	I20 P24	I20-T22 PolarHBondContact O-N 3.45Å; T22-P24 WeakPolarHBondContact O-CD 3.4Å
23	S	31	Very low	36.3	Very low	118 Å²	118	137.3 Å²	137.3	83%	0.825	80%	0.796	S	S	*	*			trans	-71.7	139.1	170.7	-49.1	0	0	0	0	110.3
24	P	39.8	Very low	37.1	Very low	127 Å²	127	139.8 Å²	139.8	83%	0.825	79%	0.794	S	S	*	*			trans	-127.2	157.8	148.3	30.1	-14	0	0	0	113.3	T22	T22-P24 WeakPolarHBondContact O-CD 3.4Å
25	S	33.5	Very low	37.6	Very low	116 Å²	116	136.5 Å²	136.5	81%	0.811	78%	0.784	S	S	*	*			trans	-63	140.3	-165.4	-172.8	0	0	0	0	115.6	T27	S25-T27 PolarHBondContact O-N 3.26Å
26	S	31.4	Very low	38.6	Very low	102 Å²	102	131.8 Å²	131.8	71%	0.713	77%	0.771	S	S	*	*			trans	-29.2	111.6	155.2	164.3	0	0	0	0	114.8
27	T	35.2	Very low	40.3	Very low	139 Å²	139	127.7 Å²	127.7	85%	0.853	75%	0.754	S	S	*	*				-169.2	127.5	122.4	-2.5	0	0	0	0	110.5	S25	S25-T27 PolarHBondContact O-N 3.26Å
28	G	29.4	Very low	41.7	Very low	68 Å²	68	125.2 Å²	125.2	70%	0.701	76%	0.755	S	S	*	*	S	Bend	trans	101	111.4	147.1	0	0	0	0	0	117.1
29	V	37.7	Very low	43.2	Very low	139 Å²	139	124.8 Å²	124.8	84%	0.842	75%	0.752	S	S	*	*			trans	74.3	97.4	157.8	-163.3	0	0	0	0	114.4	A31	V29-A31 PolarHBondContact O-N 3.13Å
30	R	36.8	Very low	44.4	Very low	245 Å²	245	124.2 Å²	124.2	93%	0.925	74%	0.739	S	S	*	*			trans	-34.5	69.6	156.1	-164.3	-175.6	-170.9	-169.8	3.6	112.9	S32	R30-S32 PolarHBondContact O-N 3.1Å
31	A	43.2	Very low	46.2	Very low	85 Å²	85	121.8 Å²	121.8	70%	0.702	74%	0.736	S	S	*	*			trans	-68.4	96.6	152.2	0	0	0	0	0	103.6	V29 E33	V29-A31 PolarHBondContact O-N 3.13Å; A31-E33 VanDerWaalsContact C-N 3.28Å; A31-E33 PolarHBondContact O-N 3.28Å
32	S	44.8	Very low	48.3	Very low	99 Å²	99	123.5 Å²	123.5	69%	0.692	73%	0.73	S	S	*	*			trans	-48.4	107.1	162.4	174.7	0	0	0	0	105.4	R30 Y34	R30-S32 PolarHBondContact O-N 3.1Å; S32-Y34 PolarHBondContact O-N 3.42Å
33	E	43.1	Very low	50.4	Low	175 Å²	175	126.4 Å²	126.4	82%	0.818	73%	0.732	S	S	*	*			trans	-58.4	89.2	167.1	-72.5	175.3	171.5	0	0	105.2	A31 C35	A31-E33 VanDerWaalsContact C-N 3.28Å; A31-E33 PolarHBondContact O-N 3.28Å; E33-C35 PolarHBondContact O-N 3.47Å
34	Y	50.8	Low	52.9	Low	165 Å²	165	131.8 Å²	131.8	65%	0.647	74%	0.735	S	S	*	*			trans	-71.3	77.9	165.5	-172.3	-93.1	0	0	0	104.7	S32 P36 Q40	S32-Y34 PolarHBondContact O-N 3.42Å; Y34-P36 HydrophobicContact CD1-CB 4.4Å; Y34-P36 HydrophobicContact CD1-CG 4.42Å; Y34-P36 HydrophobicContact CE1-CB 3.77Å; Y34-P36 HydrophobicContact CE1-CG 4.14Å; Y34-P36 WeakPolarHBondContact O-CD 3.42Å; Y34-Q40 PolarHBondContact OH-OE1 3.43Å
35	C	47.6	Very low	54.8	Low	103 Å²	103	135 Å²	135	70%	0.696	73%	0.732	S	S	*	*			trans	-76.8	97.6	156.6	-79.9	0	0	0	0	104.8	E33 S37	E33-C35 PolarHBondContact O-N 3.47Å; C35-S37 PolarHBondContact O-N 2.97Å
36	P	54.9	Low	57.2	Low	75 Å²	75	138.1 Å²	138.1	49%	0.487	73%	0.734	S	S	.	*			trans	-55.8	123.2	169.3	24	-30.7	0	0	0	106.5	Y34	Y34-P36 HydrophobicContact CD1-CB 4.4Å; Y34-P36 HydrophobicContact CD1-CG 4.42Å; Y34-P36 HydrophobicContact CE1-CB 3.77Å; Y34-P36 HydrophobicContact CE1-CG 4.14Å; Y34-P36 WeakPolarHBondContact O-CD 3.42Å
37	S	67.4	Low	59.8	Low	64 Å²	64	138.8 Å²	138.8	45%	0.448	74%	0.737	S	S	.	*			trans	-50.4	135	176.9	-156	0	0	0	0	108.3	C35 S39 Q40	C35-S37 PolarHBondContact O-N 2.97Å; S37-S39 PolarHBondContact O-N 2.86Å; S37-S39 PolarHBondContact OG-OG 3.34Å; S37-Q40 PolarHBondContact O-N 3.12Å
38	P	67	Low	62.3	Low	139 Å²	139	134.7 Å²	134.7	90%	0.903	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.1	-21.5	-177.2	-25.3	31.6	0	0	0	113.8
39	S	67.5	Low	65.3	Low	101 Å²	101	135.1 Å²	135.1	71%	0.706	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-11.7	179.1	54.5	0	0	0	0	115.1	S37 S41	S37-S39 PolarHBondContact O-N 2.86Å; S37-S39 PolarHBondContact OG-OG 3.34Å; S39-S41 PolarHBondContact O-N 3.07Å
40	Q	67.3	Low	67.8	Low	110 Å²	110	134.5 Å²	134.5	51%	0.514	69%	0.69	S	S	.	*	S	Bend	trans	-73	100.6	174	-80.8	-174.3	-7.1	0	0	109.2	Y34 S37 R42	Y34-Q40 PolarHBondContact OH-OE1 3.43Å; S37-Q40 PolarHBondContact O-N 3.12Å; Q40-R42 PolarHBondContact O-N 3.28Å; Q40-R42 VanDerWaalsContact O-N 3.07Å
41	S	75.1	Confident	70.4	Confident	107 Å²	107	127.5 Å²	127.5	75%	0.748	68%	0.676	S	S	*	*			trans	-48.9	121.8	167.3	63.6	0	0	0	0	108.2	S39 K43	S39-S41 PolarHBondContact O-N 3.07Å; S41-K43 PolarHBondContact O-N 3.3Å
42	R	76.1	Confident	72.8	Confident	197 Å²	197	128.5 Å²	128.5	74%	0.743	67%	0.668	S	S	*	*			trans	-45.4	114.5	-178.3	-168.6	174.5	169.2	174.5	-2.4	108.9	Q40 R44 Y45	Q40-R42 PolarHBondContact O-N 3.28Å; Q40-R42 VanDerWaalsContact O-N 3.07Å; R42-R44 PolarHBondContact O-N 3.04Å; R42-Y45 PolarHBondContact NH2-OH 3.23Å; R42-Y45 VanDerWaalsContact NH2-OH 3.08Å
43	K	79	Confident	75	Confident	180 Å²	180	126.7 Å²	126.7	78%	0.783	65%	0.647	S	S	*	*			trans	-51.4	131.9	179.8	-74	-172.5	179.1	-176.6	0	108.4	S41 Y45	S41-K43 PolarHBondContact O-N 3.3Å; K43-Y45 PolarHBondContact O-N 2.99Å
44	R	83	Confident	77.4	Confident	232 Å²	232	128.7 Å²	128.7	88%	0.875	65%	0.647	S	S	*	*			trans	-58.5	137.6	174.8	-73.4	-171.8	175.4	-163.1	0.3	108	R42 E46	R42-R44 PolarHBondContact O-N 3.04Å; R44-E46 PolarHBondContact O-N 3.48Å
45	Y	79.9	Confident	79.4	Confident	195 Å²	195	123.3 Å²	123.3	77%	0.765	63%	0.632	S	S	*	*			trans	-65.7	107.6	172.8	-73.6	-82	0	0	0	108	R42 K43	R42-Y45 PolarHBondContact NH2-OH 3.23Å; R42-Y45 VanDerWaalsContact NH2-OH 3.08Å; K43-Y45 PolarHBondContact O-N 2.99Å
46	E	85.1	Confident	81.7	Confident	181 Å²	181	122.7 Å²	122.7	85%	0.846	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-83.8	127.3	171.1	-71.8	176.7	-172.3	0	0	109.2	R44 V48	R44-E46 PolarHBondContact O-N 3.48Å; E46-V48 PolarHBondContact O-N 2.9Å
47	C	85.6	Confident	83.6	Confident	116 Å²	116	125.1 Å²	125.1	78%	0.784	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-65.8	129.6	172.2	-80.1	0	0	0	0	109.1
48	V	87.2	Confident	84.9	Confident	52 Å²	52	125.6 Å²	125.6	32%	0.315	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-59.2	133.1	172.5	175.4	0	0	0	0	109.2	E46 M52 K53 Y58	E46-V48 PolarHBondContact O-N 2.9Å; V48-M52 HydrophobicContact CG1-CB 3.57Å; V48-M52 HydrophobicContact CG1-SD 4.4Å; V48-K53 HydrophobicContact CB-CG 4.5Å; V48-K53 HydrophobicContact CG1-CG 4.27Å; V48-K53 WeakPolarHBondContact O-CE 3.45Å; V48-Y58 HydrophobicContact CB-CD2 4.29Å; V48-Y58 HydrophobicContact CB-CE2 3.73Å; V48-Y58 HydrophobicContact CG1-CD2 3.84Å; V48-Y58 HydrophobicContact CG1-CE2 3.78Å; V48-Y58 HydrophobicContact CG2-CD2 4.24Å; V48-Y58 HydrophobicContact CG2-CE2 3.7Å
49	P	91.5	Very high	86.2	Confident	77 Å²	77	122.5 Å²	122.5	50%	0.5	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-55.2	143.3	177.6	-27.4	34.9	0	0	0	112.8	P51 M52 K53	P49-P51 VanDerWaalsContact C-CD 3.44Å; P49-M52 HydrophobicContact CG-SD 4.28Å; P49-M52 WeakPolarHBondContact O-CB 3.32Å; P49-M52 PolarHBondContact O-N 2.91Å; P49-K53 PolarHBondContact O-N 3.26Å
50	E	91	Very high	87.5	Confident	126 Å²	126	121.8 Å²	121.8	59%	0.589	59%	0.591	S	S	*	*	H	α-helix	trans	-52.3	-41.9	-176.3	-66.9	-58.2	145.2	0	0	115	M52 K53	E50-M52 VanDerWaalsContact C-N 3.3Å; E50-M52 PolarHBondContact O-N 3.44Å; E50-K53 WeakPolarHBondContact O-CB 3.35Å; E50-K53 PolarHBondContact O-N 2.93Å; E50-K53 VanDerWaalsContact O-N 3.11Å; E50-K53 WeakPolarHBondContact OE1-CE 3.47Å; E50-K53 IonicContact OE1-NZ 3.04Å; E50-K53 PolarHBondContact OE1-NZ 3.32Å; E50-K53 WeakPolarHBondContact OE2-CD 3.43Å; E50-K53 IonicContact OE2-NZ 3.05Å
51	P	92.2	Very high	88.9	Confident	99 Å²	99	122.5 Å²	122.5	64%	0.643	59%	0.593	S	S	*	*	H	α-helix	trans	-61.6	-39.3	178.2	-23.1	34.3	0	0	0	112.5	P49 K53 R54	P49-P51 VanDerWaalsContact C-CD 3.44Å; P51-K53 PolarHBondContact O-N 3.03Å; P51-R54 PolarHBondContact O-N 3.44Å
52	M	92.1	Very high	89.8	Confident	106 Å²	106	123 Å²	123	52%	0.522	58%	0.578	S	S	.	*	H	α-helix	trans	-67	-27.5	178.6	-67.5	-175.8	77.2	0	0	111.8	V48 P49 E50 R54 T55 Y58	V48-M52 HydrophobicContact CG1-CB 3.57Å; V48-M52 HydrophobicContact CG1-SD 4.4Å; P49-M52 HydrophobicContact CG-SD 4.28Å; P49-M52 WeakPolarHBondContact O-CB 3.32Å; P49-M52 PolarHBondContact O-N 2.91Å; E50-M52 VanDerWaalsContact C-N 3.3Å; E50-M52 PolarHBondContact O-N 3.44Å; M52-R54 PolarHBondContact O-N 3.16Å; M52-T55 WeakPolarHBondContact O-CB 2.83Å; M52-T55 PolarHBondContact O-N 3.25Å; M52-T55 PolarHBondContact O-OG1 2.88Å; M52-Y58 WeakPolarHBondContact O-CB 3.4Å
53	K	91.6	Very high	90.7	Very high	61 Å²	61	118 Å²	118	27%	0.265	57%	0.565	S	S	.	*	H	α-helix	trans	-64.7	-20.2	178.1	-60.4	-172.9	-169.4	168.4	0	113.6	V48 P49 E50 P51 Y58	V48-K53 HydrophobicContact CB-CG 4.5Å; V48-K53 HydrophobicContact CG1-CG 4.27Å; V48-K53 WeakPolarHBondContact O-CE 3.45Å; P49-K53 PolarHBondContact O-N 3.26Å; E50-K53 WeakPolarHBondContact O-CB 3.35Å; E50-K53 PolarHBondContact O-N 2.93Å; E50-K53 VanDerWaalsContact O-N 3.11Å; E50-K53 WeakPolarHBondContact OE1-CE 3.47Å; E50-K53 IonicContact OE1-NZ 3.04Å; E50-K53 PolarHBondContact OE1-NZ 3.32Å; E50-K53 WeakPolarHBondContact OE2-CD 3.43Å; E50-K53 IonicContact OE2-NZ 3.05Å; P51-K53 PolarHBondContact O-N 3.03Å; K53-Y58 HydrophobicContact CB-CD1 3.96Å; K53-Y58 HydrophobicContact CB-CE1 3.72Å; K53-Y58 HydrophobicContact CD-CE1 4.46Å; K53-Y58 HydrophobicContact CG-CD1 4.35Å; K53-Y58 HydrophobicContact CG-CE1 3.79Å; K53-Y58 HydrophobicContact CG-CE2 4.39Å; K53-Y58 VanDerWaalsContact O-CD1 3.24Å; K53-Y58 WeakPolarHBondContact O-CD1 3.37Å
54	R	93.1	Very high	91.5	Very high	216 Å²	216	117.3 Å²	117.3	82%	0.815	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-11.2	176.3	-60.6	-175	-179.9	-177.1	-0.3	113.1	P51 M52	P51-R54 PolarHBondContact O-N 3.44Å; M52-R54 PolarHBondContact O-N 3.16Å
55	T	94.1	Very high	92.1	Very high	52 Å²	52	110.6 Å²	110.6	32%	0.319	54%	0.539	S	S	.	.	S	Bend	trans	-66.2	141.5	178.7	63.6	0	0	0	0	110.4	M52 D57 Y58 I59	M52-T55 WeakPolarHBondContact O-CB 2.83Å; M52-T55 PolarHBondContact O-N 3.25Å; M52-T55 PolarHBondContact O-OG1 2.88Å; T55-D57 PolarHBondContact O-N 3.32Å; T55-Y58 PolarHBondContact O-N 3.3Å; T55-Y58 WeakPolarHBondContact OG1-CB 3.06Å; T55-Y58 PolarHBondContact OG1-N 3.4Å; T55-I59 WeakPolarHBondContact O-CG1 3.41Å; T55-I59 PolarHBondContact O-N 2.98Å
56	P	95.3	Very high	92.9	Very high	90 Å²	90	109.1 Å²	109.1	58%	0.584	53%	0.532	S	S	*	.	H	α-helix	trans	-57.5	-34.8	177.9	19.9	-30.2	0	0	0	112	I59 N60	P56-I59 PolarHBondContact O-N 3.27Å; P56-N60 VanDerWaalsContact O-CB 3.29Å; P56-N60 WeakPolarHBondContact O-CB 3.49Å; P56-N60 PolarHBondContact O-N 3.17Å; P56-N60 PolarHBondContact O-ND2 2.94Å
57	D	94.5	Very high	93.5	Very high	126 Å²	126	102.8 Å²	102.8	67%	0.674	51%	0.508	S	S	*	.	H	α-helix	trans	-62.2	-46.9	176.7	-69.9	-24.6	0	0	0	112.9	T55 N60 K61	T55-D57 PolarHBondContact O-N 3.32Å; D57-N60 PolarHBondContact O-N 3.05Å; D57-K61 VanDerWaalsContact O-CB 3.31Å; D57-K61 WeakPolarHBondContact O-CB 3.41Å; D57-K61 PolarHBondContact O-N 3.38Å
58	Y	94.3	Very high	94	Very high	74 Å²	74	99.9 Å²	99.9	29%	0.29	49%	0.492	S	S	.	.	H	α-helix	trans	-63.7	-43.8	176.1	179.8	-90.7	0	0	0	111.1	V48 M52 K53 T55 K61 R62	V48-Y58 HydrophobicContact CB-CD2 4.29Å; V48-Y58 HydrophobicContact CB-CE2 3.73Å; V48-Y58 HydrophobicContact CG1-CD2 3.84Å; V48-Y58 HydrophobicContact CG1-CE2 3.78Å; V48-Y58 HydrophobicContact CG2-CD2 4.24Å; V48-Y58 HydrophobicContact CG2-CE2 3.7Å; M52-Y58 WeakPolarHBondContact O-CB 3.4Å; K53-Y58 HydrophobicContact CB-CD1 3.96Å; K53-Y58 HydrophobicContact CB-CE1 3.72Å; K53-Y58 HydrophobicContact CD-CE1 4.46Å; K53-Y58 HydrophobicContact CG-CD1 4.35Å; K53-Y58 HydrophobicContact CG-CE1 3.79Å; K53-Y58 HydrophobicContact CG-CE2 4.39Å; K53-Y58 VanDerWaalsContact O-CD1 3.24Å; K53-Y58 WeakPolarHBondContact O-CD1 3.37Å; T55-Y58 PolarHBondContact O-N 3.3Å; T55-Y58 WeakPolarHBondContact OG1-CB 3.06Å; T55-Y58 PolarHBondContact OG1-N 3.4Å; Y58-K61 PolarHBondContact O-N 3.08Å; Y58-R62 HydrophobicContact CE1-CB 4.5Å; Y58-R62 WeakPolarHBondContact O-CB 3.37Å; Y58-R62 PolarHBondContact O-N 3.32Å
59	I	94.2	Very high	94.4	Very high	75 Å²	75	100.8 Å²	100.8	39%	0.385	50%	0.498	S	S	.	.	H	α-helix	trans	-59.6	-49.3	178.1	-67	168.1	0	0	0	110.2	T55 P56 K61 R62 I63	T55-I59 WeakPolarHBondContact O-CG1 3.41Å; T55-I59 PolarHBondContact O-N 2.98Å; P56-I59 PolarHBondContact O-N 3.27Å; I59-K61 PolarHBondContact O-N 3.07Å; I59-R62 PolarHBondContact O-N 3.43Å; I59-I63 HydrophobicContact CG2-CD1 3.81Å; I59-I63 HydrophobicContact CG2-CG1 4.48Å; I59-I63 VanDerWaalsContact O-CG1 3.32Å; I59-I63 WeakPolarHBondContact O-CG1 3.31Å; I59-I63 PolarHBondContact O-N 3.01Å
60	N	96.2	Very high	94.6	Very high	85 Å²	85	104 Å²	104	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-61.2	-42.3	177.9	-74	-23.5	0	0	0	112	P56 D57 I63 R64	P56-N60 VanDerWaalsContact O-CB 3.29Å; P56-N60 WeakPolarHBondContact O-CB 3.49Å; P56-N60 PolarHBondContact O-N 3.17Å; P56-N60 PolarHBondContact O-ND2 2.94Å; D57-N60 PolarHBondContact O-N 3.05Å; N60-I63 PolarHBondContact O-N 2.89Å; N60-R64 WeakPolarHBondContact O-CB 3.35Å; N60-R64 WeakPolarHBondContact O-CG 3.48Å; N60-R64 PolarHBondContact O-N 2.97Å
61	K	95.1	Very high	94.8	Very high	126 Å²	126	107.1 Å²	107.1	55%	0.548	51%	0.51	S	S	.	.	H	α-helix	trans	-63.9	-43.1	174.9	-172.5	174.9	-177.3	176.5	0	111.5	D57 Y58 I59 R64 N65	D57-K61 VanDerWaalsContact O-CB 3.31Å; D57-K61 WeakPolarHBondContact O-CB 3.41Å; D57-K61 PolarHBondContact O-N 3.38Å; Y58-K61 PolarHBondContact O-N 3.08Å; I59-K61 PolarHBondContact O-N 3.07Å; K61-R64 PolarHBondContact O-N 3.38Å; K61-N65 WeakPolarHBondContact O-CB 3.49Å; K61-N65 VanDerWaalsContact O-CG 3.23Å; K61-N65 PolarHBondContact O-N 2.95Å
62	R	94.2	Very high	94.9	Very high	116 Å²	116	109.2 Å²	109.2	44%	0.438	51%	0.509	S	S	.	.	H	α-helix	trans	-61.9	-46.4	176.3	-166.7	-56.3	-149.8	143	3.9	110.2	Y58 I59 N65 R66	Y58-R62 HydrophobicContact CE1-CB 4.5Å; Y58-R62 WeakPolarHBondContact O-CB 3.37Å; Y58-R62 PolarHBondContact O-N 3.32Å; I59-R62 PolarHBondContact O-N 3.43Å; R62-N65 PolarHBondContact O-N 3.4Å; R62-R66 WeakPolarHBondContact O-CB 3.48Å; R62-R66 PolarHBondContact O-N 2.98Å
63	I	95.6	Very high	95	Very high	93 Å²	93	111.8 Å²	111.8	48%	0.477	51%	0.513	S	S	.	.	H	α-helix	trans	-59.7	-48.5	179	-69.5	168.2	0	0	0	110.4	I59 N60 N65 R66 S67	I59-I63 HydrophobicContact CG2-CD1 3.81Å; I59-I63 HydrophobicContact CG2-CG1 4.48Å; I59-I63 VanDerWaalsContact O-CG1 3.32Å; I59-I63 WeakPolarHBondContact O-CG1 3.31Å; I59-I63 PolarHBondContact O-N 3.01Å; N60-I63 PolarHBondContact O-N 2.89Å; I63-N65 PolarHBondContact O-N 3.49Å; I63-R66 PolarHBondContact O-N 2.91Å; I63-S67 PolarHBondContact O-N 3.03Å; I63-S67 PolarHBondContact O-OG 3.3Å
64	R	96.1	Very high	95.1	Very high	166 Å²	166	113 Å²	113	63%	0.626	52%	0.52	S	S	*	.	H	α-helix	trans	-58.8	-45.3	175.2	-74.4	-174.2	-72.5	161.6	-7.4	112.7	N60 K61 R66 S67 A68	N60-R64 WeakPolarHBondContact O-CB 3.35Å; N60-R64 WeakPolarHBondContact O-CG 3.48Å; N60-R64 PolarHBondContact O-N 2.97Å; K61-R64 PolarHBondContact O-N 3.38Å; R64-R66 PolarHBondContact O-N 3.36Å; R64-S67 PolarHBondContact O-N 3.26Å; R64-S67 PolarHBondContact O-OG 2.94Å; R64-A68 VanDerWaalsContact O-CB 3.31Å; R64-A68 WeakPolarHBondContact O-CB 3.42Å; R64-A68 PolarHBondContact O-N 3.41Å
65	N	95.7	Very high	95	Very high	90 Å²	90	110.4 Å²	110.4	48%	0.481	52%	0.515	S	S	.	.	H	α-helix	trans	-64.2	-42.5	178	-73.5	-9.6	0	0	0	111.7	K61 R62 I63 A68 V69	K61-N65 WeakPolarHBondContact O-CB 3.49Å; K61-N65 VanDerWaalsContact O-CG 3.23Å; K61-N65 PolarHBondContact O-N 2.95Å; R62-N65 PolarHBondContact O-N 3.4Å; I63-N65 PolarHBondContact O-N 3.49Å; N65-A68 PolarHBondContact O-N 2.93Å; N65-V69 WeakPolarHBondContact O-CB 3.32Å; N65-V69 VanDerWaalsContact O-CG2 3.29Å; N65-V69 WeakPolarHBondContact O-CG2 3.47Å; N65-V69 PolarHBondContact O-N 3.44Å
66	R	96.4	Very high	94.9	Very high	164 Å²	164	110.3 Å²	110.3	62%	0.619	52%	0.516	S	S	*	.	H	α-helix	trans	-63.7	-42.7	177.4	-176.5	176.9	-179.4	-174.7	8.1	111.4	R62 I63 R64 K70	R62-R66 WeakPolarHBondContact O-CB 3.48Å; R62-R66 PolarHBondContact O-N 2.98Å; I63-R66 PolarHBondContact O-N 2.91Å; R64-R66 PolarHBondContact O-N 3.36Å; R66-K70 WeakPolarHBondContact O-CB 3.37Å; R66-K70 PolarHBondContact O-N 3.35Å
67	S	96.7	Very high	94.7	Very high	49 Å²	49	112 Å²	112	34%	0.343	51%	0.514	S	S	.	.	H	α-helix	trans	-67.2	-40.4	178	67.1	0	0	0	0	111.6	I63 R64 K70 R71	I63-S67 PolarHBondContact O-N 3.03Å; I63-S67 PolarHBondContact O-OG 3.3Å; R64-S67 PolarHBondContact O-N 3.26Å; R64-S67 PolarHBondContact O-OG 2.94Å; S67-K70 PolarHBondContact O-N 3.42Å; S67-R71 WeakPolarHBondContact O-CG 3.46Å; S67-R71 PolarHBondContact O-N 3.49Å
68	A	96.4	Very high	94.3	Very high	54 Å²	54	109.2 Å²	109.2	45%	0.446	50%	0.501	S	S	.	.	H	α-helix	trans	-60.9	-48.4	174.1	0	0	0	0	0	112.1	R64 N65 K70 R71 F72	R64-A68 VanDerWaalsContact O-CB 3.31Å; R64-A68 WeakPolarHBondContact O-CB 3.42Å; R64-A68 PolarHBondContact O-N 3.41Å; N65-A68 PolarHBondContact O-N 2.93Å; A68-K70 VanDerWaalsContact C-N 3.33Å; A68-K70 PolarHBondContact O-N 3.35Å; A68-R71 PolarHBondContact O-N 2.88Å; A68-F72 WeakPolarHBondContact O-CB 3.32Å; A68-F72 PolarHBondContact O-N 2.87Å
69	V	96.1	Very high	94	Very high	71 Å²	71	110.5 Å²	110.5	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-61.8	-41	176.5	171.1	0	0	0	0	111.3	N65 F72 R73	N65-V69 WeakPolarHBondContact O-CB 3.32Å; N65-V69 VanDerWaalsContact O-CG2 3.29Å; N65-V69 WeakPolarHBondContact O-CG2 3.47Å; N65-V69 PolarHBondContact O-N 3.44Å; V69-F72 PolarHBondContact O-N 3.19Å; V69-R73 HydrophobicContact CG1-CG 4.43Å; V69-R73 WeakPolarHBondContact O-CB 3.28Å; V69-R73 VanDerWaalsContact O-CG 3.31Å; V69-R73 WeakPolarHBondContact O-CG 3.45Å; V69-R73 PolarHBondContact O-N 3.31Å
70	K	96.4	Very high	93.7	Very high	144 Å²	144	109.2 Å²	109.2	63%	0.626	51%	0.509	S	S	*	.	H	α-helix	trans	-60.4	-50.9	175.5	-173.5	-179.3	178.8	-175.8	0	110.8	R66 S67 A68 F72 R73 E74	R66-K70 WeakPolarHBondContact O-CB 3.37Å; R66-K70 PolarHBondContact O-N 3.35Å; S67-K70 PolarHBondContact O-N 3.42Å; A68-K70 VanDerWaalsContact C-N 3.33Å; A68-K70 PolarHBondContact O-N 3.35Å; K70-F72 VanDerWaalsContact C-N 3.33Å; K70-F72 PolarHBondContact O-N 3.06Å; K70-R73 PolarHBondContact O-N 3.39Å; K70-E74 WeakPolarHBondContact O-CG 3.44Å; K70-E74 PolarHBondContact O-N 3.37Å
71	R	95	Very high	93.4	Very high	192 Å²	192	111.9 Å²	111.9	73%	0.725	52%	0.517	S	S	*	.	H	α-helix	trans	-59	-43.1	177.7	-72.1	178	-175.2	-176.6	1.5	112.1	S67 A68 E74 K75	S67-R71 WeakPolarHBondContact O-CG 3.46Å; S67-R71 PolarHBondContact O-N 3.49Å; A68-R71 PolarHBondContact O-N 2.88Å; R71-E74 PolarHBondContact O-N 2.86Å; R71-K75 VanDerWaalsContact O-CB 3.31Å; R71-K75 WeakPolarHBondContact O-CB 3.3Å; R71-K75 PolarHBondContact O-N 3.05Å
72	F	94.4	Very high	93	Very high	143 Å²	143	114.5 Å²	114.5	63%	0.627	52%	0.523	S	S	*	.	H	α-helix	trans	-60.8	-46	176.6	175.2	-94.9	0	0	0	112	A68 V69 K70 K75 S76	A68-F72 WeakPolarHBondContact O-CB 3.32Å; A68-F72 PolarHBondContact O-N 2.87Å; V69-F72 PolarHBondContact O-N 3.19Å; K70-F72 VanDerWaalsContact C-N 3.33Å; K70-F72 PolarHBondContact O-N 3.06Å; F72-K75 PolarHBondContact O-N 2.99Å; F72-S76 WeakPolarHBondContact O-CB 3.31Å; F72-S76 PolarHBondContact O-N 2.7Å; F72-S76 PolarHBondContact O-OG 3.3Å
73	R	93.6	Very high	92.8	Very high	160 Å²	160	112.2 Å²	112.2	60%	0.604	52%	0.518	S	S	*	.	H	α-helix	trans	-63.3	-45.4	178	-74.2	176.3	-179.6	-169.3	-0.4	111.7	V69 K70 S76 K77	V69-R73 HydrophobicContact CG1-CG 4.43Å; V69-R73 WeakPolarHBondContact O-CB 3.28Å; V69-R73 VanDerWaalsContact O-CG 3.31Å; V69-R73 WeakPolarHBondContact O-CG 3.45Å; V69-R73 PolarHBondContact O-N 3.31Å; K70-R73 PolarHBondContact O-N 3.39Å; R73-S76 PolarHBondContact O-N 2.89Å; R73-K77 WeakPolarHBondContact O-CB 3.43Å; R73-K77 VanDerWaalsContact O-CG 3.29Å; R73-K77 WeakPolarHBondContact O-CG 3.4Å; R73-K77 PolarHBondContact O-N 3.48Å
74	E	93.5	Very high	92.5	Very high	88 Å²	88	113.3 Å²	113.3	41%	0.411	52%	0.521	S	S	.	.	H	α-helix	trans	-64.2	-43.9	177.4	-66.2	-48.3	138.5	0	0	111.5	K70 R71 S76 K77 T78	K70-E74 WeakPolarHBondContact O-CG 3.44Å; K70-E74 PolarHBondContact O-N 3.37Å; R71-E74 PolarHBondContact O-N 2.86Å; E74-S76 VanDerWaalsContact C-N 3.31Å; E74-S76 PolarHBondContact O-N 3.37Å; E74-K77 PolarHBondContact O-N 3.38Å; E74-K77 IonicContact OE1-NZ 2.94Å; E74-T78 WeakPolarHBondContact O-CG2 3.35Å; E74-T78 PolarHBondContact O-N 3.06Å; E74-T78 PolarHBondContact O-OG1 2.99Å; E74-T78 VanDerWaalsContact O-OG1 3.12Å
75	K	91.4	Very high	92.1	Very high	161 Å²	161	109.2 Å²	109.2	70%	0.7	51%	0.511	S	S	*	.	H	α-helix	trans	-59.7	-40.4	173.9	-174.2	177.7	179.1	-179.4	0	112.4	R71 F72 T78 K79	R71-K75 VanDerWaalsContact O-CB 3.31Å; R71-K75 WeakPolarHBondContact O-CB 3.3Å; R71-K75 PolarHBondContact O-N 3.05Å; F72-K75 PolarHBondContact O-N 2.99Å; K75-T78 WeakPolarHBondContact CA-OG1 3.4Å; K75-T78 PolarHBondContact O-OG1 2.78Å; K75-K79 WeakPolarHBondContact O-CB 3.43Å; K75-K79 PolarHBondContact O-N 3.32Å
76	S	91.5	Very high	91.7	Very high	49 Å²	49	106.1 Å²	106.1	34%	0.343	50%	0.495	S	S	.	.	H	α-helix	trans	-69.4	-42.5	179.6	-57.8	0	0	0	0	111.6	F72 R73 E74 K79 A80	F72-S76 WeakPolarHBondContact O-CB 3.31Å; F72-S76 PolarHBondContact O-N 2.7Å; F72-S76 PolarHBondContact O-OG 3.3Å; R73-S76 PolarHBondContact O-N 2.89Å; E74-S76 VanDerWaalsContact C-N 3.31Å; E74-S76 PolarHBondContact O-N 3.37Å; S76-K79 PolarHBondContact O-N 2.91Å; S76-A80 WeakPolarHBondContact O-CB 3.35Å; S76-A80 PolarHBondContact O-N 3.5Å
77	K	90.6	Very high	91.3	Very high	127 Å²	127	103.7 Å²	103.7	55%	0.552	49%	0.49	S	S	*	.	H	α-helix	trans	-62.5	-42.7	175.3	-74	174.6	-179.4	178.9	0	111.8	R73 E74 A80 K81	R73-K77 WeakPolarHBondContact O-CB 3.43Å; R73-K77 VanDerWaalsContact O-CG 3.29Å; R73-K77 WeakPolarHBondContact O-CG 3.4Å; R73-K77 PolarHBondContact O-N 3.48Å; E74-K77 PolarHBondContact O-N 3.38Å; E74-K77 IonicContact OE1-NZ 2.94Å; K77-A80 PolarHBondContact O-N 3.32Å; K77-K81 WeakPolarHBondContact O-CB 3.27Å; K77-K81 PolarHBondContact O-N 3.44Å
78	T	87.6	Confident	91	Very high	66 Å²	66	104 Å²	104	41%	0.405	50%	0.495	S	S	.	.	H	α-helix	trans	-68.1	-38.7	177.5	55.9	0	0	0	0	111.8	E74 K75 R82	E74-T78 WeakPolarHBondContact O-CG2 3.35Å; E74-T78 PolarHBondContact O-N 3.06Å; E74-T78 PolarHBondContact O-OG1 2.99Å; E74-T78 VanDerWaalsContact O-OG1 3.12Å; K75-T78 WeakPolarHBondContact CA-OG1 3.4Å; K75-T78 PolarHBondContact O-OG1 2.78Å; T78-R82 WeakPolarHBondContact O-CB 3.32Å; T78-R82 WeakPolarHBondContact O-CG 3.34Å; T78-R82 PolarHBondContact O-N 3.34Å
79	K	88	Confident	90.6	Very high	101 Å²	101	103.9 Å²	103.9	44%	0.439	49%	0.487	S	S	.	.	H	α-helix	trans	-60.2	-50.6	172.4	-172.5	177.1	-179.5	-179.7	0	111	K75 S76 K81 R82 Q83	K75-K79 WeakPolarHBondContact O-CB 3.43Å; K75-K79 PolarHBondContact O-N 3.32Å; S76-K79 PolarHBondContact O-N 2.91Å; K79-K81 PolarHBondContact O-N 2.89Å; K79-R82 PolarHBondContact O-N 3.5Å; K79-Q83 WeakPolarHBondContact O-CG 3.35Å; K79-Q83 PolarHBondContact O-N 3.02Å
80	A	87.4	Confident	90.3	Very high	49 Å²	49	104.1 Å²	104.1	41%	0.405	49%	0.485	S	S	.	.	H	α-helix	trans	-60.7	-45.2	179.9	0	0	0	0	0	112.1	S76 K77 R82 Q83 E84	S76-A80 WeakPolarHBondContact O-CB 3.35Å; S76-A80 PolarHBondContact O-N 3.5Å; K77-A80 PolarHBondContact O-N 3.32Å; A80-R82 PolarHBondContact O-N 3.21Å; A80-Q83 PolarHBondContact O-N 3.34Å; A80-E84 PolarHBondContact O-N 3Å
81	K	89.1	Confident	90	Very high	141 Å²	141	100.9 Å²	100.9	61%	0.613	47%	0.474	S	S	*	.	H	α-helix	trans	-59.7	-46.7	176.4	-174.6	178.5	177.5	-177.2	0	111.8	K77 K79 Q83 E84 D85	K77-K81 WeakPolarHBondContact O-CB 3.27Å; K77-K81 PolarHBondContact O-N 3.44Å; K79-K81 PolarHBondContact O-N 2.89Å; K81-Q83 VanDerWaalsContact C-N 3.28Å; K81-Q83 PolarHBondContact O-N 2.66Å; K81-E84 PolarHBondContact O-N 3.2Å; K81-D85 VanDerWaalsContact O-CG 3.23Å; K81-D85 PolarHBondContact O-N 2.98Å
82	R	88.1	Confident	89.8	Confident	180 Å²	180	95.4 Å²	95.4	68%	0.679	46%	0.459	S	S	*	.	H	α-helix	trans	-58.4	-40.3	176.6	-74.1	172.3	-176.3	-174.6	-0.5	112.2	T78 K79 A80 D85 V86	T78-R82 WeakPolarHBondContact O-CB 3.32Å; T78-R82 WeakPolarHBondContact O-CG 3.34Å; T78-R82 PolarHBondContact O-N 3.34Å; K79-R82 PolarHBondContact O-N 3.5Å; A80-R82 PolarHBondContact O-N 3.21Å; R82-D85 PolarHBondContact O-N 3.44Å; R82-V86 VanDerWaalsContact O-CG2 3.28Å; R82-V86 WeakPolarHBondContact O-CG2 3.42Å; R82-V86 PolarHBondContact O-N 2.81Å
83	Q	88.9	Confident	89.7	Confident	68 Å²	68	90 Å²	90	32%	0.318	44%	0.437	S	S	.	.	H	α-helix	trans	-66	-41.6	177.7	-71.3	177.7	-36.6	0	0	112.1	K79 A80 K81 V86 K87 L160	K79-Q83 WeakPolarHBondContact O-CG 3.35Å; K79-Q83 PolarHBondContact O-N 3.02Å; A80-Q83 PolarHBondContact O-N 3.34Å; K81-Q83 VanDerWaalsContact C-N 3.28Å; K81-Q83 PolarHBondContact O-N 2.66Å; Q83-V86 PolarHBondContact O-N 3.33Å; Q83-K87 WeakPolarHBondContact O-CB 3.45Å; Q83-K87 PolarHBondContact O-N 2.71Å; Q83-L160 HydrophobicContact CB-CD2 4.39Å; Q83-L160 HydrophobicContact CG-CD2 3.93Å
84	E	89.4	Confident	89.6	Confident	116 Å²	116	86 Å²	86	54%	0.542	43%	0.43	S	S	.	.	H	α-helix	trans	-64.7	-40.8	174.5	-68.9	-59.3	149.8	0	0	112	A80 K81 K87 A88	A80-E84 PolarHBondContact O-N 3Å; K81-E84 PolarHBondContact O-N 3.2Å; E84-K87 PolarHBondContact O-N 2.89Å; E84-A88 WeakPolarHBondContact O-CB 3.41Å; E84-A88 PolarHBondContact O-N 3.43Å
85	D	87.9	Confident	89.6	Confident	81 Å²	81	89.6 Å²	89.6	43%	0.433	44%	0.44	S	S	.	.	H	α-helix	trans	-62.7	-43.5	176	-64.9	-25	0	0	0	111.1	K81 R82 A88 N89	K81-D85 VanDerWaalsContact O-CG 3.23Å; K81-D85 PolarHBondContact O-N 2.98Å; R82-D85 PolarHBondContact O-N 3.44Å; D85-A88 PolarHBondContact O-N 3.25Å; D85-N89 VanDerWaalsContact O-CG 3.32Å; D85-N89 PolarHBondContact O-N 2.95Å; D85-N89 PolarHBondContact O-ND2 3.44Å
86	V	87.4	Confident	89.6	Confident	24 Å²	24	84 Å²	84	15%	0.145	42%	0.415	C	S	.	.	H	α-helix	trans	-63.6	-44.1	175.5	171.7	0	0	0	0	111.3	R82 Q83 A88 N89 L90 L160	R82-V86 VanDerWaalsContact O-CG2 3.28Å; R82-V86 WeakPolarHBondContact O-CG2 3.42Å; R82-V86 PolarHBondContact O-N 2.81Å; Q83-V86 PolarHBondContact O-N 3.33Å; V86-A88 VanDerWaalsContact C-N 3.35Å; V86-A88 PolarHBondContact O-N 3.48Å; V86-N89 PolarHBondContact O-N 3.34Å; V86-L90 HydrophobicContact CG1-CD1 3.87Å; V86-L90 HydrophobicContact CG1-CG 4.45Å; V86-L90 PolarHBondContact O-N 3.31Å; V86-L160 HydrophobicContact CB-CD1 4.2Å; V86-L160 HydrophobicContact CG1-CD1 3.6Å; V86-L160 HydrophobicContact CG2-CD1 4.44Å
87	K	89.1	Confident	89.8	Confident	114 Å²	114	87.3 Å²	87.3	50%	0.496	42%	0.421	S	S	.	.	H	α-helix	trans	-60.9	-43.4	177.1	-179.3	-176.9	173.7	-171.4	0	111.7	Q83 E84 N89 L90 I91	Q83-K87 WeakPolarHBondContact O-CB 3.45Å; Q83-K87 PolarHBondContact O-N 2.71Å; E84-K87 PolarHBondContact O-N 2.89Å; K87-N89 VanDerWaalsContact C-N 3.34Å; K87-N89 PolarHBondContact O-N 3.47Å; K87-L90 PolarHBondContact O-N 2.98Å; K87-I91 HydrophobicContact CG-CD1 4.05Å; K87-I91 VanDerWaalsContact O-CG1 3.27Å; K87-I91 WeakPolarHBondContact O-CG1 3.33Å; K87-I91 PolarHBondContact O-N 3.4Å
88	A	89	Confident	90.1	Very high	56 Å²	56	85.1 Å²	85.1	46%	0.463	42%	0.416	S	S	.	.	H	α-helix	trans	-61.4	-42.9	176.5	0	0	0	0	0	111.7	E84 D85 V86 I91 L92	E84-A88 WeakPolarHBondContact O-CB 3.41Å; E84-A88 PolarHBondContact O-N 3.43Å; D85-A88 PolarHBondContact O-N 3.25Å; V86-A88 VanDerWaalsContact C-N 3.35Å; V86-A88 PolarHBondContact O-N 3.48Å; A88-I91 PolarHBondContact O-N 2.93Å; A88-L92 PolarHBondContact O-N 2.94Å
89	N	87.8	Confident	90.4	Very high	51 Å²	51	86.6 Å²	86.6	27%	0.273	42%	0.421	S	S	.	.	H	α-helix	trans	-64.8	-42	176.2	-71.2	-21.2	0	0	0	112.6	D85 V86 K87 L92 L93 W152	D85-N89 VanDerWaalsContact O-CG 3.32Å; D85-N89 PolarHBondContact O-N 2.95Å; D85-N89 PolarHBondContact O-ND2 3.44Å; V86-N89 PolarHBondContact O-N 3.34Å; K87-N89 VanDerWaalsContact C-N 3.34Å; K87-N89 PolarHBondContact O-N 3.47Å; N89-L92 WeakPolarHBondContact O-CB 3.5Å; N89-L92 PolarHBondContact O-N 2.86Å; N89-L93 WeakPolarHBondContact O-CB 3.44Å; N89-L93 PolarHBondContact O-N 2.96Å; N89-W152 HydrophobicContact CB-CZ2 4.36Å
90	L	89.9	Confident	90.8	Very high	75 Å²	75	83.1 Å²	83.1	39%	0.393	41%	0.406	S	S	.	.	H	α-helix	trans	-59.3	-46	174.2	-82.3	162.8	0	0	0	111.5	V86 K87 L92 L93 T94 W152	V86-L90 HydrophobicContact CG1-CD1 3.87Å; V86-L90 HydrophobicContact CG1-CG 4.45Å; V86-L90 PolarHBondContact O-N 3.31Å; K87-L90 PolarHBondContact O-N 2.98Å; L90-L92 VanDerWaalsContact C-N 3.3Å; L90-L92 PolarHBondContact O-N 3.49Å; L90-L93 PolarHBondContact O-N 3.22Å; L90-T94 PolarHBondContact O-N 3.04Å; L90-T94 PolarHBondContact O-OG1 3.2Å; L90-T94 VanDerWaalsContact O-OG1 3.06Å; L90-W152 HydrophobicContact CD2-CH2 3.19Å; L90-W152 HydrophobicContact CD2-CZ2 3.97Å; L90-W152 HydrophobicContact CD2-CZ3 3.81Å; L90-W152 HydrophobicContact CG-CH2 3.66Å; L90-W152 HydrophobicContact CG-CZ2 3.92Å; L90-W152 HydrophobicContact CG-CZ3 4.49Å
91	I	91.5	Very high	91.2	Very high	77 Å²	77	84.9 Å²	84.9	40%	0.395	41%	0.408	S	S	.	.	H	α-helix	trans	-60.4	-42.2	176.7	-69.6	165.2	0	0	0	110.9	K87 A88 R95	K87-I91 HydrophobicContact CG-CD1 4.05Å; K87-I91 VanDerWaalsContact O-CG1 3.27Å; K87-I91 WeakPolarHBondContact O-CG1 3.33Å; K87-I91 PolarHBondContact O-N 3.4Å; A88-I91 PolarHBondContact O-N 2.93Å; I91-R95 WeakPolarHBondContact O-CG 3.47Å; I91-R95 PolarHBondContact O-N 3.37Å; I91-R95 VanDerWaalsContact O-N 3.11Å
92	L	90.1	Very high	91.6	Very high	76 Å²	76	83.5 Å²	83.5	40%	0.398	41%	0.407	S	S	.	.	H	α-helix	trans	-63.1	-44.5	176.9	-175.9	119.8	0	0	0	111.5	A88 N89 L90 R95 F96 V149	A88-L92 PolarHBondContact O-N 2.94Å; N89-L92 WeakPolarHBondContact O-CB 3.5Å; N89-L92 PolarHBondContact O-N 2.86Å; L90-L92 VanDerWaalsContact C-N 3.3Å; L90-L92 PolarHBondContact O-N 3.49Å; L92-R95 WeakPolarHBondContact O-CB 3.24Å; L92-R95 PolarHBondContact O-N 2.91Å; L92-F96 HydrophobicContact CD2-CD2 4.04Å; L92-F96 HydrophobicContact CD2-CE2 3.4Å; L92-F96 HydrophobicContact CD2-CZ 4.04Å; L92-F96 HydrophobicContact CG-CD2 4.47Å; L92-F96 HydrophobicContact CG-CE2 4Å; L92-F96 HydrophobicContact CG-CZ 4.33Å; L92-F96 PolarHBondContact O-N 3.08Å; L92-F96 VanDerWaalsContact O-N 3.08Å; L92-V149 HydrophobicContact CD2-CG2 3.86Å
93	L	91.2	Very high	92	Very high	31 Å²	31	77.4 Å²	77.4	16%	0.162	38%	0.384	C	S	.	.	H	α-helix	trans	-62.5	-45.4	177.9	-174.1	63.4	0	0	0	111.7	N89 L90 R95 F96 Y97 L146 W152	N89-L93 WeakPolarHBondContact O-CB 3.44Å; N89-L93 PolarHBondContact O-N 2.96Å; L90-L93 PolarHBondContact O-N 3.22Å; L93-R95 VanDerWaalsContact C-N 3.3Å; L93-R95 PolarHBondContact O-N 3.04Å; L93-F96 PolarHBondContact O-N 3.06Å; L93-F96 VanDerWaalsContact O-N 3.13Å; L93-Y97 HydrophobicContact CD1-CD2 4.02Å; L93-Y97 HydrophobicContact CD1-CE2 3.49Å; L93-Y97 VanDerWaalsContact CD1-CE2 3.49Å; L93-Y97 HydrophobicContact CD2-CE2 4.06Å; L93-Y97 HydrophobicContact CG-CD2 3.85Å; L93-Y97 HydrophobicContact CG-CE2 3.55Å; L93-Y97 VanDerWaalsContact O-CD2 3.24Å; L93-Y97 WeakPolarHBondContact O-CD2 3.37Å; L93-Y97 PolarHBondContact O-N 3.3Å; L93-L146 HydrophobicContact CD1-CD1 3.61Å; L93-W152 HydrophobicContact CD2-CH2 3.79Å; L93-W152 HydrophobicContact CD2-CZ2 4.39Å; L93-W152 HydrophobicContact CD2-CZ3 4.49Å
94	T	93	Very high	92.3	Very high	76 Å²	76	78.3 Å²	78.3	47%	0.466	39%	0.39	S	S	.	.	H	α-helix	trans	-55.4	-46.2	174.5	-60	0	0	0	0	111.2	L90 F96 Y97 D98	L90-T94 PolarHBondContact O-N 3.04Å; L90-T94 PolarHBondContact O-OG1 3.2Å; L90-T94 VanDerWaalsContact O-OG1 3.06Å; T94-F96 VanDerWaalsContact C-N 3.32Å; T94-F96 PolarHBondContact O-N 2.86Å; T94-Y97 PolarHBondContact O-N 3.45Å; T94-D98 VanDerWaalsContact O-CG 3.31Å; T94-D98 PolarHBondContact O-N 3.14Å
95	R	92.7	Very high	92.7	Very high	163 Å²	163	78.6 Å²	78.6	62%	0.615	39%	0.389	S	S	*	.	H	α-helix	trans	-61.1	-39.3	177.4	-71.6	174.5	-176.9	-176.8	1.3	112.8	I91 L92 L93 N99	I91-R95 WeakPolarHBondContact O-CG 3.47Å; I91-R95 PolarHBondContact O-N 3.37Å; I91-R95 VanDerWaalsContact O-N 3.11Å; L92-R95 WeakPolarHBondContact O-CB 3.24Å; L92-R95 PolarHBondContact O-N 2.91Å; L93-R95 VanDerWaalsContact C-N 3.3Å; L93-R95 PolarHBondContact O-N 3.04Å; R95-N99 WeakPolarHBondContact O-CB 3.43Å; R95-N99 PolarHBondContact O-N 3.18Å; R95-N99 PolarHBondContact O-ND2 3.13Å
96	F	91.9	Very high	93.2	Very high	42 Å²	42	79.3 Å²	79.3	18%	0.184	39%	0.39	C	S	.	.	H	α-helix	trans	-62.5	-47.9	175.1	-71.3	-39.5	0	0	0	111.2	L92 L93 T94 D98 N99 E100 F142 Q145 V149	L92-F96 HydrophobicContact CD2-CD2 4.04Å; L92-F96 HydrophobicContact CD2-CE2 3.4Å; L92-F96 HydrophobicContact CD2-CZ 4.04Å; L92-F96 HydrophobicContact CG-CD2 4.47Å; L92-F96 HydrophobicContact CG-CE2 4Å; L92-F96 HydrophobicContact CG-CZ 4.33Å; L92-F96 PolarHBondContact O-N 3.08Å; L92-F96 VanDerWaalsContact O-N 3.08Å; L93-F96 PolarHBondContact O-N 3.06Å; L93-F96 VanDerWaalsContact O-N 3.13Å; T94-F96 VanDerWaalsContact C-N 3.32Å; T94-F96 PolarHBondContact O-N 2.86Å; F96-D98 PolarHBondContact O-N 3.13Å; F96-N99 PolarHBondContact O-N 3.26Å; F96-E100 WeakPolarHBondContact O-CG 3.49Å; F96-E100 PolarHBondContact O-N 3.15Å; F96-F142 HydrophobicContact CB-CE2 3.98Å; F96-Q145 HydrophobicContact CZ-CB 4.35Å; F96-V149 HydrophobicContact CD2-CG2 4.39Å; F96-V149 HydrophobicContact CE2-CG2 3.96Å
97	Y	95.3	Very high	93.6	Very high	119 Å²	119	79 Å²	79	47%	0.467	39%	0.389	S	S	.	.	H	α-helix	trans	-62.9	-39.2	177.1	-77.3	-68.8	0	0	0	113.5	L93 T94 N99 E100 L101 F142	L93-Y97 HydrophobicContact CD1-CD2 4.02Å; L93-Y97 HydrophobicContact CD1-CE2 3.49Å; L93-Y97 VanDerWaalsContact CD1-CE2 3.49Å; L93-Y97 HydrophobicContact CD2-CE2 4.06Å; L93-Y97 HydrophobicContact CG-CD2 3.85Å; L93-Y97 HydrophobicContact CG-CE2 3.55Å; L93-Y97 VanDerWaalsContact O-CD2 3.24Å; L93-Y97 WeakPolarHBondContact O-CD2 3.37Å; L93-Y97 PolarHBondContact O-N 3.3Å; T94-Y97 PolarHBondContact O-N 3.45Å; Y97-N99 VanDerWaalsContact C-N 3.35Å; Y97-N99 PolarHBondContact O-N 3.19Å; Y97-E100 PolarHBondContact O-N 2.92Å; Y97-L101 WeakPolarHBondContact O-CB 3.44Å; Y97-L101 PolarHBondContact O-N 3.49Å; Y97-F142 AromaticContact CD1-CZ 3.99Å; Y97-F142 HydrophobicContact CD1-CZ 3.99Å; Y97-F142 HydrophobicContact CE1-CE1 4.43Å; Y97-F142 AromaticContact CE1-CZ 3.74Å; Y97-F142 HydrophobicContact CE1-CZ 3.74Å
98	D	96.8	Very high	94	Very high	82 Å²	82	79.6 Å²	79.6	44%	0.439	39%	0.391	S	S	.	.	H	α-helix	trans	-63.1	-42.2	176.9	-72.2	-22.6	0	0	0	111.4	T94 F96 L101 I102	T94-D98 VanDerWaalsContact O-CG 3.31Å; T94-D98 PolarHBondContact O-N 3.14Å; F96-D98 PolarHBondContact O-N 3.13Å; D98-L101 PolarHBondContact O-N 3.03Å; D98-I102 WeakPolarHBondContact O-CG1 3.41Å; D98-I102 PolarHBondContact O-N 3.19Å
99	N	94.7	Very high	94.4	Very high	97 Å²	97	82.7 Å²	82.7	52%	0.519	40%	0.396	S	S	.	.	H	α-helix	trans	-64	-42.3	175.8	-70.9	-23	0	0	0	111.8	R95 F96 Y97 L101 I102 R103	R95-N99 WeakPolarHBondContact O-CB 3.43Å; R95-N99 PolarHBondContact O-N 3.18Å; R95-N99 PolarHBondContact O-ND2 3.13Å; F96-N99 PolarHBondContact O-N 3.26Å; Y97-N99 VanDerWaalsContact C-N 3.35Å; Y97-N99 PolarHBondContact O-N 3.19Å; N99-L101 VanDerWaalsContact C-N 3.33Å; N99-L101 PolarHBondContact O-N 3.45Å; N99-I102 PolarHBondContact O-N 2.62Å; N99-R103 PolarHBondContact O-N 3.26Å
100	E	95.7	Very high	94.9	Very high	27 Å²	27	83.7 Å²	83.7	13%	0.126	40%	0.399	C	S	.	.	H	α-helix	trans	-61.6	-42.7	174.7	-69.5	-60.7	103.3	0	0	111.7	F96 Y97 I102 R103 I104 F142	F96-E100 WeakPolarHBondContact O-CG 3.49Å; F96-E100 PolarHBondContact O-N 3.15Å; Y97-E100 PolarHBondContact O-N 2.92Å; E100-I102 VanDerWaalsContact C-N 3.33Å; E100-I102 PolarHBondContact O-N 3.26Å; E100-R103 PolarHBondContact O-N 3.11Å; E100-R103 IonicContact OE1-CZ 3.68Å; E100-R103 IonicContact OE1-NH1 3.36Å; E100-R103 PolarHBondContact OE1-NH1 3.21Å; E100-R103 IonicContact OE2-CZ 2.86Å; E100-R103 IonicContact OE2-NH1 3.56Å; E100-R103 PolarHBondContact OE2-NH1 3.49Å; E100-R103 IonicContact OE2-NH2 3.65Å; E100-R103 PolarHBondContact OE2-NH2 3.3Å; E100-I104 VanDerWaalsContact O-CG1 3.3Å; E100-I104 WeakPolarHBondContact O-CG1 3.36Å; E100-I104 PolarHBondContact O-N 3.02Å; E100-F142 VanDerWaalsContact CD-CB 3.49Å; E100-F142 HydrophobicContact CG-CB 4.31Å; E100-F142 HydrophobicContact CG-CD1 4.09Å; E100-F142 HydrophobicContact CG-CD2 3.24Å; E100-F142 HydrophobicContact CG-CE1 4.22Å; E100-F142 HydrophobicContact CG-CE2 3.4Å; E100-F142 HydrophobicContact CG-CG 3.61Å; E100-F142 HydrophobicContact CG-CZ 3.9Å; E100-F142 WeakPolarHBondContact OE2-CB 3.47Å; E100-F142 WeakPolarHBondContact OE2-CG 3.47Å
101	L	96.9	Very high	95.2	Very high	86 Å²	86	83.4 Å²	83.4	45%	0.45	40%	0.398	S	S	.	.	H	α-helix	trans	-61.7	-42.7	178.1	-179.7	62.5	0	0	0	111.5	Y97 D98 N99 K105	Y97-L101 WeakPolarHBondContact O-CB 3.44Å; Y97-L101 PolarHBondContact O-N 3.49Å; D98-L101 PolarHBondContact O-N 3.03Å; N99-L101 VanDerWaalsContact C-N 3.33Å; N99-L101 PolarHBondContact O-N 3.45Å; L101-K105 HydrophobicContact CG-CD 4.38Å; L101-K105 WeakPolarHBondContact O-CB 3.48Å; L101-K105 VanDerWaalsContact O-CG 3.28Å; L101-K105 WeakPolarHBondContact O-CG 3.35Å; L101-K105 PolarHBondContact O-N 2.88Å
102	I	96.9	Very high	95.4	Very high	113 Å²	113	84 Å²	84	58%	0.579	40%	0.399	S	S	*	.	H	α-helix	trans	-61.7	-45.8	175	-68.5	166.2	0	0	0	110.4	D98 N99 E100 K105 H106	D98-I102 WeakPolarHBondContact O-CG1 3.41Å; D98-I102 PolarHBondContact O-N 3.19Å; N99-I102 PolarHBondContact O-N 2.62Å; E100-I102 VanDerWaalsContact C-N 3.33Å; E100-I102 PolarHBondContact O-N 3.26Å; I102-K105 PolarHBondContact O-N 3.24Å; I102-H106 PolarHBondContact O-N 3.41Å
103	R	95.8	Very high	95.8	Very high	52 Å²	52	85.1 Å²	85.1	20%	0.196	41%	0.405	C	S	.	.	H	α-helix	trans	-59.4	-51.2	178.1	-172.5	-169.2	75.7	-137.2	-4.2	111.6	N99 E100 K105 H106 S107 E135 A138	N99-R103 PolarHBondContact O-N 3.26Å; E100-R103 PolarHBondContact O-N 3.11Å; E100-R103 IonicContact OE1-CZ 3.68Å; E100-R103 IonicContact OE1-NH1 3.36Å; E100-R103 PolarHBondContact OE1-NH1 3.21Å; E100-R103 IonicContact OE2-CZ 2.86Å; E100-R103 IonicContact OE2-NH1 3.56Å; E100-R103 PolarHBondContact OE2-NH1 3.49Å; E100-R103 IonicContact OE2-NH2 3.65Å; E100-R103 PolarHBondContact OE2-NH2 3.3Å; R103-K105 VanDerWaalsContact C-N 3.28Å; R103-K105 PolarHBondContact O-N 2.89Å; R103-H106 WeakPolarHBondContact O-CB 3.27Å; R103-H106 PolarHBondContact O-N 3.25Å; R103-S107 PolarHBondContact O-N 3.11Å; R103-S107 PolarHBondContact O-OG 3.38Å; R103-E135 IonicContact CZ-OE1 2.7Å; R103-E135 IonicContact CZ-OE2 3.68Å; R103-E135 IonicContact NE-OE1 2.71Å; R103-E135 IonicContact NE-OE2 3.09Å; R103-E135 PolarHBondContact NE-OE2 3.33Å; R103-E135 IonicContact NH2-OE1 2.66Å; R103-E135 PolarHBondContact NH2-OE1 2.95Å; R103-E135 IonicContact NH2-OE2 3.77Å; R103-E135 PolarHBondContact NH2-OE2 3.2Å; R103-A138 VanDerWaalsContact CZ-CB 3.48Å; R103-A138 VanDerWaalsContact NH1-CB 3.32Å; R103-A138 PolarHBondContact NH1-O 3.3Å
104	I	96.4	Very high	96	Very high	87 Å²	87	84.2 Å²	84.2	45%	0.446	40%	0.4	S	S	.	.	H	α-helix	trans	-60.2	-41	-179.2	-68.5	166.4	0	0	0	110.6	E100 H106 S107 K108	E100-I104 VanDerWaalsContact O-CG1 3.3Å; E100-I104 WeakPolarHBondContact O-CG1 3.36Å; E100-I104 PolarHBondContact O-N 3.02Å; I104-H106 VanDerWaalsContact C-N 3.34Å; I104-H106 PolarHBondContact O-N 3.36Å; I104-S107 PolarHBondContact O-N 3.36Å; I104-K108 WeakPolarHBondContact O-CB 3.4Å; I104-K108 PolarHBondContact O-N 3.4Å
105	K	97.8	Very high	96.1	Very high	122 Å²	122	86.3 Å²	86.3	53%	0.53	41%	0.408	S	S	.	.	H	α-helix	trans	-60.8	-42.8	174.3	-77.2	175.3	178.6	178	0	112.1	L101 I102 R103 K108 Q109	L101-K105 HydrophobicContact CG-CD 4.38Å; L101-K105 WeakPolarHBondContact O-CB 3.48Å; L101-K105 VanDerWaalsContact O-CG 3.28Å; L101-K105 WeakPolarHBondContact O-CG 3.35Å; L101-K105 PolarHBondContact O-N 2.88Å; I102-K105 PolarHBondContact O-N 3.24Å; R103-K105 VanDerWaalsContact C-N 3.28Å; R103-K105 PolarHBondContact O-N 2.89Å; K105-K108 WeakPolarHBondContact O-CB 3.49Å; K105-K108 PolarHBondContact O-N 2.83Å; K105-Q109 WeakPolarHBondContact O-CG 3.43Å; K105-Q109 PolarHBondContact O-N 3.41Å; K105-Q109 VanDerWaalsContact O-N 3.07Å
106	H	97.4	Very high	96.3	Very high	96 Å²	96	87 Å²	87	44%	0.444	41%	0.412	S	S	.	.	H	α-helix	trans	-64.5	-48.2	176.3	-179.7	-91.8	0	0	0	111.8	I102 R103 I104 K108 Q109 Q110	I102-H106 PolarHBondContact O-N 3.41Å; R103-H106 WeakPolarHBondContact O-CB 3.27Å; R103-H106 PolarHBondContact O-N 3.25Å; I104-H106 VanDerWaalsContact C-N 3.34Å; I104-H106 PolarHBondContact O-N 3.36Å; H106-K108 VanDerWaalsContact C-N 3.26Å; H106-K108 PolarHBondContact O-N 2.83Å; H106-Q109 WeakPolarHBondContact O-CB 3.22Å; H106-Q109 PolarHBondContact O-N 2.95Å; H106-Q109 VanDerWaalsContact O-N 3.08Å; H106-Q110 PolarHBondContact CE1-NE2 3.37Å; H106-Q110 PolarHBondContact CE1-OE1 2.99Å; H106-Q110 PolarHBondContact ND1-OE1 3Å; H106-Q110 WeakPolarHBondContact O-CG 3.28Å; H106-Q110 PolarHBondContact O-N 2.92Å
107	S	96.7	Very high	96.5	Very high	18 Å²	18	87.5 Å²	87.5	13%	0.126	41%	0.414	C	S	.	.	H	α-helix	trans	-59.1	-38.9	176.3	-61.7	0	0	0	0	111.9	R103 I104 Q110 L111	R103-S107 PolarHBondContact O-N 3.11Å; R103-S107 PolarHBondContact O-OG 3.38Å; I104-S107 PolarHBondContact O-N 3.36Å; S107-Q110 PolarHBondContact O-N 3.45Å; S107-L111 WeakPolarHBondContact O-CG 3.44Å; S107-L111 PolarHBondContact O-N 3.42Å
108	K	97	Very high	96.6	Very high	125 Å²	125	87 Å²	87	54%	0.543	42%	0.416	S	S	.	.	H	α-helix	trans	-58.5	-49	172.4	176	-177.5	166.9	179.3	0	111.6	I104 K105 H106 Q110 L111 E112	I104-K108 WeakPolarHBondContact O-CB 3.4Å; I104-K108 PolarHBondContact O-N 3.4Å; K105-K108 WeakPolarHBondContact O-CB 3.49Å; K105-K108 PolarHBondContact O-N 2.83Å; H106-K108 VanDerWaalsContact C-N 3.26Å; H106-K108 PolarHBondContact O-N 2.83Å; K108-Q110 VanDerWaalsContact C-N 3.28Å; K108-Q110 PolarHBondContact O-N 3.36Å; K108-L111 PolarHBondContact O-N 3.5Å; K108-E112 WeakPolarHBondContact CE-OE1 3.35Å; K108-E112 IonicContact NZ-OE1 2.78Å; K108-E112 WeakPolarHBondContact O-CG 3.44Å; K108-E112 PolarHBondContact O-N 3.26Å
109	Q	97.7	Very high	96.5	Very high	121 Å²	121	86.5 Å²	86.5	57%	0.565	42%	0.424	S	S	*	.	H	α-helix	trans	-60.6	-38.6	178.1	-71.3	171.2	-22.7	0	0	112.1	K105 H106 E112 L113	K105-Q109 WeakPolarHBondContact O-CG 3.43Å; K105-Q109 PolarHBondContact O-N 3.41Å; K105-Q109 VanDerWaalsContact O-N 3.07Å; H106-Q109 WeakPolarHBondContact O-CB 3.22Å; H106-Q109 PolarHBondContact O-N 2.95Å; H106-Q109 VanDerWaalsContact O-N 3.08Å; Q109-E112 PolarHBondContact O-N 3.05Å; Q109-L113 PolarHBondContact O-N 3.39Å
110	Q	96.8	Very high	96.5	Very high	72 Å²	72	84.8 Å²	84.8	34%	0.336	42%	0.423	S	S	.	.	H	α-helix	trans	-64.7	-42.1	175.1	-66.6	178.1	-63.4	0	0	111.9	H106 S107 K108 L113 L114 I131	H106-Q110 PolarHBondContact CE1-NE2 3.37Å; H106-Q110 PolarHBondContact CE1-OE1 2.99Å; H106-Q110 PolarHBondContact ND1-OE1 3Å; H106-Q110 WeakPolarHBondContact O-CG 3.28Å; H106-Q110 PolarHBondContact O-N 2.92Å; S107-Q110 PolarHBondContact O-N 3.45Å; K108-Q110 VanDerWaalsContact C-N 3.28Å; K108-Q110 PolarHBondContact O-N 3.36Å; Q110-L113 WeakPolarHBondContact O-CB 3.31Å; Q110-L113 PolarHBondContact O-N 2.9Å; Q110-L114 WeakPolarHBondContact O-CG 3.03Å; Q110-L114 PolarHBondContact O-N 3.38Å; Q110-I131 HydrophobicContact CB-CD1 3.75Å
111	L	96.8	Very high	96.5	Very high	70 Å²	70	92.3 Å²	92.3	37%	0.366	46%	0.457	S	S	.	.	H	α-helix	trans	-65.6	-40.1	176.1	-71.4	173	0	0	0	112.1	S107 K108 L113 L114 L115 L128 I131	S107-L111 WeakPolarHBondContact O-CG 3.44Å; S107-L111 PolarHBondContact O-N 3.42Å; K108-L111 PolarHBondContact O-N 3.5Å; L111-L113 VanDerWaalsContact C-N 3.32Å; L111-L113 PolarHBondContact O-N 3.33Å; L111-L114 PolarHBondContact O-N 3.4Å; L111-L115 PolarHBondContact O-N 3.03Å; L111-L128 HydrophobicContact CD2-CD1 3.76Å; L111-I131 HydrophobicContact CD2-CD1 4.14Å; L111-I131 HydrophobicContact CD2-CG2 4.02Å; L111-I131 HydrophobicContact CG-CG2 4.23Å
112	E	96.8	Very high	96.3	Very high	88 Å²	88	94.1 Å²	94.1	41%	0.411	46%	0.462	S	S	.	.	H	α-helix	trans	-60	-43.6	173.1	-72.9	172.7	169	0	0	110.9	K108 Q109 L115 Y116	K108-E112 WeakPolarHBondContact CE-OE1 3.35Å; K108-E112 IonicContact NZ-OE1 2.78Å; K108-E112 WeakPolarHBondContact O-CG 3.44Å; K108-E112 PolarHBondContact O-N 3.26Å; Q109-E112 PolarHBondContact O-N 3.05Å; E112-L115 WeakPolarHBondContact O-CB 3.36Å; E112-L115 PolarHBondContact O-N 3.46Å; E112-Y116 WeakPolarHBondContact O-CD2 3.46Å; E112-Y116 PolarHBondContact O-N 3.28Å; E112-Y116 VanDerWaalsContact O-N 3.15Å
113	L	96.4	Very high	96.2	Very high	101 Å²	101	94.6 Å²	94.6	53%	0.529	47%	0.465	S	S	.	.	H	α-helix	trans	-62	-43.3	174.8	-175.7	65.8	0	0	0	112.2	Q109 Q110 L111 L115 Y116 Q117	Q109-L113 PolarHBondContact O-N 3.39Å; Q110-L113 WeakPolarHBondContact O-CB 3.31Å; Q110-L113 PolarHBondContact O-N 2.9Å; L111-L113 VanDerWaalsContact C-N 3.32Å; L111-L113 PolarHBondContact O-N 3.33Å; L113-L115 VanDerWaalsContact C-N 3.28Å; L113-L115 PolarHBondContact O-N 2.65Å; L113-Y116 PolarHBondContact O-N 3.01Å; L113-Q117 WeakPolarHBondContact O-CG 3.41Å; L113-Q117 PolarHBondContact O-N 3.35Å
114	L	96.5	Very high	96.2	Very high	12 Å²	12	93 Å²	93	6%	0.063	46%	0.461	C	S	.	.	H	α-helix	trans	-62	-37.7	175.5	-73.5	-171.8	0	0	0	111.9	Q110 L111 Y116 Q117 H118 I124 Q127 L128 I131	Q110-L114 WeakPolarHBondContact O-CG 3.03Å; Q110-L114 PolarHBondContact O-N 3.38Å; L111-L114 PolarHBondContact O-N 3.4Å; L114-Y116 VanDerWaalsContact C-N 3.33Å; L114-Y116 PolarHBondContact O-N 3.21Å; L114-Q117 PolarHBondContact O-N 2.81Å; L114-Q117 VanDerWaalsContact O-N 3.16Å; L114-H118 WeakPolarHBondContact O-CB 3.31Å; L114-H118 PolarHBondContact O-N 2.92Å; L114-I124 HydrophobicContact CB-CD1 4.46Å; L114-I124 HydrophobicContact CD2-CB 4.39Å; L114-I124 HydrophobicContact CD2-CG2 4.29Å; L114-Q127 HydrophobicContact CD1-CB 3.9Å; L114-Q127 HydrophobicContact CD2-CB 3.62Å; L114-Q127 HydrophobicContact CD2-CG 4.19Å; L114-Q127 HydrophobicContact CG-CB 4.42Å; L114-L128 HydrophobicContact CD1-CB 4.32Å; L114-I131 HydrophobicContact CD1-CD1 3.46Å; L114-I131 VanDerWaalsContact CD1-CD1 3.46Å; L114-I131 HydrophobicContact CG-CD1 4.17Å
115	L	95.8	Very high	96.2	Very high	120 Å²	120	93.6 Å²	93.6	63%	0.628	46%	0.464	S	S	*	.	H	α-helix	trans	-61.2	-43.3	176.2	-172.1	67.3	0	0	0	111.4	L111 E112 L113 Q117 H118 A119	L111-L115 PolarHBondContact O-N 3.03Å; E112-L115 WeakPolarHBondContact O-CB 3.36Å; E112-L115 PolarHBondContact O-N 3.46Å; L113-L115 VanDerWaalsContact C-N 3.28Å; L113-L115 PolarHBondContact O-N 2.65Å; L115-Q117 VanDerWaalsContact C-N 3.33Å; L115-Q117 PolarHBondContact O-N 3.47Å; L115-H118 PolarHBondContact O-N 2.93Å; L115-A119 PolarHBondContact O-N 3.46Å
116	Y	96.7	Very high	96.1	Very high	177 Å²	177	92 Å²	92	69%	0.694	47%	0.468	S	S	*	.	H	α-helix	trans	-62.5	-39.1	173.8	-71.2	-64.3	0	0	0	112.5	E112 L113 L114 A119 A120	E112-Y116 WeakPolarHBondContact O-CD2 3.46Å; E112-Y116 PolarHBondContact O-N 3.28Å; E112-Y116 VanDerWaalsContact O-N 3.15Å; L113-Y116 PolarHBondContact O-N 3.01Å; L114-Y116 VanDerWaalsContact C-N 3.33Å; L114-Y116 PolarHBondContact O-N 3.21Å; Y116-A119 PolarHBondContact O-N 3.03Å; Y116-A120 PolarHBondContact O-N 2.97Å; Y116-A120 VanDerWaalsContact O-N 3.13Å
117	Q	96.2	Very high	96	Very high	52 Å²	52	90.9 Å²	90.9	24%	0.243	46%	0.463	C	S	.	.	H	α-helix	trans	-66.4	-40.3	176.6	-69.6	177.9	2.7	0	0	112.3	L113 L114 L115 A120 H121 K122 I124	L113-Q117 WeakPolarHBondContact O-CG 3.41Å; L113-Q117 PolarHBondContact O-N 3.35Å; L114-Q117 PolarHBondContact O-N 2.81Å; L114-Q117 VanDerWaalsContact O-N 3.16Å; L115-Q117 VanDerWaalsContact C-N 3.33Å; L115-Q117 PolarHBondContact O-N 3.47Å; Q117-A120 CarbonylContact O-C 3.39Å; Q117-A120 WeakPolarHBondContact O-CA 3.29Å; Q117-A120 WeakPolarHBondContact O-CB 3.48Å; Q117-A120 PolarHBondContact O-N 2.99Å; Q117-A120 VanDerWaalsContact O-N 3.1Å; Q117-H121 PolarHBondContact O-N 3.09Å; Q117-K122 HydrophobicContact CB-CB 4.32Å; Q117-K122 HydrophobicContact CB-CD 4.16Å; Q117-K122 HydrophobicContact CG-CD 4.35Å; Q117-K122 VanDerWaalsContact O-CB 3.32Å; Q117-K122 WeakPolarHBondContact O-CB 3.35Å; Q117-K122 PolarHBondContact O-N 3.22Å; Q117-K122 VanDerWaalsContact O-N 3.07Å; Q117-I124 HydrophobicContact CB-CG2 3.91Å
118	H	96.1	Very high	96	Very high	110 Å²	110	92.6 Å²	92.6	51%	0.509	47%	0.47	S	S	.	.	H	α-helix	trans	-64.6	-40.6	175.5	-179.3	-103.4	0	0	0	111.9	L114 L115 A120 H121 I124	L114-H118 WeakPolarHBondContact O-CB 3.31Å; L114-H118 PolarHBondContact O-N 2.92Å; L115-H118 PolarHBondContact O-N 2.93Å; H118-A120 PolarHBondContact O-N 3.38Å; H118-H121 WeakPolarHBondContact O-CA 3.46Å; H118-H121 PolarHBondContact O-N 3.03Å; H118-I124 HydrophobicContact CB-CD1 3.67Å; H118-I124 HydrophobicContact CB-CG1 3.96Å; H118-I124 HydrophobicContact CB-CG2 4.02Å
119	A	95.5	Very high	96	Very high	71 Å²	71	91.1 Å²	91.1	59%	0.587	47%	0.468	S	S	*	.	H	α-helix	trans	-61	-28.5	172.1	0	0	0	0	0	112.4	L115 Y116 H121	L115-A119 PolarHBondContact O-N 3.46Å; Y116-A119 PolarHBondContact O-N 3.03Å; A119-H121 PolarHBondContact O-N 3.47Å
120	A	95.7	Very high	96	Very high	61 Å²	61	91 Å²	91	50%	0.504	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	21.2	170.6	0	0	0	0	0	113.6	Y116 Q117 H118 K122	Y116-A120 PolarHBondContact O-N 2.97Å; Y116-A120 VanDerWaalsContact O-N 3.13Å; Q117-A120 CarbonylContact O-C 3.39Å; Q117-A120 WeakPolarHBondContact O-CA 3.29Å; Q117-A120 WeakPolarHBondContact O-CB 3.48Å; Q117-A120 PolarHBondContact O-N 2.99Å; Q117-A120 VanDerWaalsContact O-N 3.1Å; H118-A120 PolarHBondContact O-N 3.38Å; A120-K122 PolarHBondContact O-N 2.8Å; A120-K122 VanDerWaalsContact O-N 3.12Å
121	H	93.7	Very high	95.9	Very high	184 Å²	184	88.4 Å²	88.4	85%	0.852	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	23.3	179.1	-54.4	-69.9	0	0	0	115.2	Q117 H118 A119	Q117-H121 PolarHBondContact O-N 3.09Å; H118-H121 WeakPolarHBondContact O-CA 3.46Å; H118-H121 PolarHBondContact O-N 3.03Å; A119-H121 PolarHBondContact O-N 3.47Å
122	K	94.6	Very high	95.9	Very high	124 Å²	124	89.7 Å²	89.7	54%	0.539	46%	0.463	S	S	.	.			trans	-80.3	142.8	172.4	-59.8	-178.5	178.3	179.7	0	109.8	Q117 A120 I124	Q117-K122 HydrophobicContact CB-CB 4.32Å; Q117-K122 HydrophobicContact CB-CD 4.16Å; Q117-K122 HydrophobicContact CG-CD 4.35Å; Q117-K122 VanDerWaalsContact O-CB 3.32Å; Q117-K122 WeakPolarHBondContact O-CB 3.35Å; Q117-K122 PolarHBondContact O-N 3.22Å; Q117-K122 VanDerWaalsContact O-N 3.07Å; A120-K122 PolarHBondContact O-N 2.8Å; A120-K122 VanDerWaalsContact O-N 3.12Å; K122-I124 PolarHBondContact O-N 2.78Å
123	N	94.4	Very high	95.9	Very high	123 Å²	123	89.1 Å²	89.1	66%	0.658	47%	0.468	S	S	*	.			trans	-71	117.2	169.7	-175.5	-4.9	0	0	0	109.3	I125 Q127	N123-I125 WeakPolarHBondContact OD1-CB 3.45Å; N123-I125 WeakPolarHBondContact OD1-CG1 3.37Å; N123-I125 PolarHBondContact OD1-N 2.91Å; N123-Q127 PolarHBondContact O-OE1 2.69Å
124	I	95.4	Very high	95.9	Very high	20 Å²	20	88.6 Å²	88.6	10%	0.103	47%	0.466	C	S	.	.			trans	-108.5	-0.9	-178.1	60.6	153.2	0	0	0	113.4	L114 Q117 H118 K122 S126 Q127 L128	L114-I124 HydrophobicContact CB-CD1 4.46Å; L114-I124 HydrophobicContact CD2-CB 4.39Å; L114-I124 HydrophobicContact CD2-CG2 4.29Å; Q117-I124 HydrophobicContact CB-CG2 3.91Å; H118-I124 HydrophobicContact CB-CD1 3.67Å; H118-I124 HydrophobicContact CB-CG1 3.96Å; H118-I124 HydrophobicContact CB-CG2 4.02Å; K122-I124 PolarHBondContact O-N 2.78Å; I124-S126 VanDerWaalsContact C-N 3.32Å; I124-S126 PolarHBondContact O-N 3.3Å; I124-Q127 VanDerWaalsContact C-OE1 3.29Å; I124-Q127 PolarHBondContact O-N 2.86Å; I124-Q127 PolarHBondContact O-OE1 3.37Å; I124-L128 WeakPolarHBondContact O-CB 3.31Å; I124-L128 PolarHBondContact O-N 3.38Å
125	I	95.3	Very high	95.9	Very high	99 Å²	99	90.3 Å²	90.3	51%	0.508	47%	0.474	S	S	.	.	H	α-helix	trans	-61.7	-40.5	-168.2	-61.7	-61.4	0	0	0	111.5	N123 N129	N123-I125 WeakPolarHBondContact OD1-CB 3.45Å; N123-I125 WeakPolarHBondContact OD1-CG1 3.37Å; N123-I125 PolarHBondContact OD1-N 2.91Å; I125-N129 WeakPolarHBondContact O-CB 3.29Å; I125-N129 PolarHBondContact O-N 2.93Å; I125-N129 PolarHBondContact O-ND2 3.34Å
126	S	95.9	Very high	95.9	Very high	88 Å²	88	87.7 Å²	87.7	62%	0.615	47%	0.469	S	S	*	.	H	α-helix	trans	-63.4	-48.3	178.4	-170	0	0	0	0	111.6	I124 N129 E130	I124-S126 VanDerWaalsContact C-N 3.32Å; I124-S126 PolarHBondContact O-N 3.3Å; S126-N129 PolarHBondContact O-N 2.88Å; S126-E130 PolarHBondContact O-N 2.9Å
127	Q	96.5	Very high	95.9	Very high	73 Å²	73	85.5 Å²	85.5	34%	0.341	47%	0.465	S	S	.	.	H	α-helix	trans	-68	-36.7	-178.8	-59.9	89	-25.3	0	0	111.6	L114 N123 I124 E130 I131	L114-Q127 HydrophobicContact CD1-CB 3.9Å; L114-Q127 HydrophobicContact CD2-CB 3.62Å; L114-Q127 HydrophobicContact CD2-CG 4.19Å; L114-Q127 HydrophobicContact CG-CB 4.42Å; N123-Q127 PolarHBondContact O-OE1 2.69Å; I124-Q127 VanDerWaalsContact C-OE1 3.29Å; I124-Q127 PolarHBondContact O-N 2.86Å; I124-Q127 PolarHBondContact O-OE1 3.37Å; Q127-E130 PolarHBondContact O-N 2.99Å; Q127-I131 WeakPolarHBondContact O-CG1 3.38Å; Q127-I131 PolarHBondContact O-N 3.07Å
128	L	96.7	Very high	95.8	Very high	53 Å²	53	84 Å²	84	28%	0.277	46%	0.462	S	S	.	.	H	α-helix	trans	-61.7	-48.4	174.8	179	63.1	0	0	0	110.9	L111 L114 I124 E130 I131 L132	L111-L128 HydrophobicContact CD2-CD1 3.76Å; L114-L128 HydrophobicContact CD1-CB 4.32Å; I124-L128 WeakPolarHBondContact O-CB 3.31Å; I124-L128 PolarHBondContact O-N 3.38Å; L128-E130 VanDerWaalsContact C-N 3.28Å; L128-E130 PolarHBondContact O-N 2.96Å; L128-I131 PolarHBondContact O-N 2.87Å; L128-L132 HydrophobicContact CD1-CD1 4.37Å; L128-L132 HydrophobicContact CD1-CG 4.43Å; L128-L132 HydrophobicContact CG-CD1 4.17Å; L128-L132 VanDerWaalsContact O-CG 3.31Å; L128-L132 WeakPolarHBondContact O-CG 3.31Å; L128-L132 PolarHBondContact O-N 3.12Å
129	N	97	Very high	95.8	Very high	95 Å²	95	86 Å²	86	51%	0.508	47%	0.465	S	S	.	.	H	α-helix	trans	-62.6	-36.5	177.6	-74.3	-27.4	0	0	0	112.2	I125 S126 L132 S133	I125-N129 WeakPolarHBondContact O-CB 3.29Å; I125-N129 PolarHBondContact O-N 2.93Å; I125-N129 PolarHBondContact O-ND2 3.34Å; S126-N129 PolarHBondContact O-N 2.88Å; N129-L132 PolarHBondContact O-N 2.95Å; N129-S133 WeakPolarHBondContact O-CB 3.48Å; N129-S133 PolarHBondContact O-N 3.42Å
130	E	96.8	Very high	95.8	Very high	118 Å²	118	87.8 Å²	87.8	55%	0.551	46%	0.464	S	S	*	.	H	α-helix	trans	-62.7	-49.3	174.4	-174.1	179.8	-177.1	0	0	111.7	S126 Q127 L128 L132 S133 L134	S126-E130 PolarHBondContact O-N 2.9Å; Q127-E130 PolarHBondContact O-N 2.99Å; L128-E130 VanDerWaalsContact C-N 3.28Å; L128-E130 PolarHBondContact O-N 2.96Å; E130-L132 VanDerWaalsContact C-N 3.32Å; E130-L132 PolarHBondContact O-N 3.42Å; E130-S133 PolarHBondContact O-N 3.28Å; E130-L134 HydrophobicContact CG-CD1 4.13Å; E130-L134 WeakPolarHBondContact O-CB 3.49Å; E130-L134 WeakPolarHBondContact O-CG 3.36Å; E130-L134 PolarHBondContact O-N 2.87Å
131	I	95.8	Very high	95.7	Very high	18 Å²	18	91.4 Å²	91.4	9%	0.092	47%	0.468	C	S	.	.	H	α-helix	trans	-59.5	-44.3	177.1	-68.5	173.4	0	0	0	111	Q110 L111 L114 Q127 L128 L134 E135	Q110-I131 HydrophobicContact CB-CD1 3.75Å; L111-I131 HydrophobicContact CD2-CD1 4.14Å; L111-I131 HydrophobicContact CD2-CG2 4.02Å; L111-I131 HydrophobicContact CG-CG2 4.23Å; L114-I131 HydrophobicContact CD1-CD1 3.46Å; L114-I131 VanDerWaalsContact CD1-CD1 3.46Å; L114-I131 HydrophobicContact CG-CD1 4.17Å; Q127-I131 WeakPolarHBondContact O-CG1 3.38Å; Q127-I131 PolarHBondContact O-N 3.07Å; L128-I131 PolarHBondContact O-N 2.87Å; I131-L134 PolarHBondContact O-N 3.29Å; I131-E135 WeakPolarHBondContact O-CB 3.42Å; I131-E135 PolarHBondContact O-N 3.24Å
132	L	96	Very high	95.7	Very high	96 Å²	96	84 Å²	84	50%	0.503	43%	0.434	S	S	.	.	H	α-helix	trans	-63.5	-41.8	178.9	-70.6	174.6	0	0	0	112.1	L128 N129 E130 E135 A136	L128-L132 HydrophobicContact CD1-CD1 4.37Å; L128-L132 HydrophobicContact CD1-CG 4.43Å; L128-L132 HydrophobicContact CG-CD1 4.17Å; L128-L132 VanDerWaalsContact O-CG 3.31Å; L128-L132 WeakPolarHBondContact O-CG 3.31Å; L128-L132 PolarHBondContact O-N 3.12Å; N129-L132 PolarHBondContact O-N 2.95Å; E130-L132 VanDerWaalsContact C-N 3.32Å; E130-L132 PolarHBondContact O-N 3.42Å; L132-E135 PolarHBondContact O-N 3.42Å; L132-A136 WeakPolarHBondContact O-CB 3.38Å; L132-A136 PolarHBondContact O-N 2.86Å
133	S	97.3	Very high	95.6	Very high	76 Å²	76	82.8 Å²	82.8	53%	0.531	43%	0.43	S	S	.	.	H	α-helix	trans	-63.9	-47.3	176.7	-176.6	0	0	0	0	111.7	N129 E130 E135 A136 Q137	N129-S133 WeakPolarHBondContact O-CB 3.48Å; N129-S133 PolarHBondContact O-N 3.42Å; E130-S133 PolarHBondContact O-N 3.28Å; S133-E135 VanDerWaalsContact C-N 3.29Å; S133-E135 PolarHBondContact O-N 3.42Å; S133-A136 PolarHBondContact O-N 2.97Å; S133-Q137 PolarHBondContact O-N 3.25Å
134	L	96.1	Very high	95.5	Very high	90 Å²	90	81.1 Å²	81.1	47%	0.471	43%	0.425	S	S	.	.	H	α-helix	trans	-60	-40.8	176.7	-72	173.8	0	0	0	111.4	E130 I131 Q137 A138	E130-L134 HydrophobicContact CG-CD1 4.13Å; E130-L134 WeakPolarHBondContact O-CB 3.49Å; E130-L134 WeakPolarHBondContact O-CG 3.36Å; E130-L134 PolarHBondContact O-N 2.87Å; I131-L134 PolarHBondContact O-N 3.29Å; L134-Q137 PolarHBondContact O-N 2.92Å; L134-A138 VanDerWaalsContact O-CB 3.27Å; L134-A138 WeakPolarHBondContact O-CB 3.32Å; L134-A138 PolarHBondContact O-N 3.08Å
135	E	96	Very high	95.2	Very high	49 Å²	49	83.4 Å²	83.4	23%	0.229	44%	0.435	C	S	.	.	H	α-helix	trans	-72.8	-36.3	179.5	178.4	50.1	178.9	0	0	113.1	R103 I131 L132 S133 Q137 A138 R139	R103-E135 IonicContact CZ-OE1 2.7Å; R103-E135 IonicContact CZ-OE2 3.68Å; R103-E135 IonicContact NE-OE1 2.71Å; R103-E135 IonicContact NE-OE2 3.09Å; R103-E135 PolarHBondContact NE-OE2 3.33Å; R103-E135 IonicContact NH2-OE1 2.66Å; R103-E135 PolarHBondContact NH2-OE1 2.95Å; R103-E135 IonicContact NH2-OE2 3.77Å; R103-E135 PolarHBondContact NH2-OE2 3.2Å; I131-E135 WeakPolarHBondContact O-CB 3.42Å; I131-E135 PolarHBondContact O-N 3.24Å; L132-E135 PolarHBondContact O-N 3.42Å; S133-E135 VanDerWaalsContact C-N 3.29Å; S133-E135 PolarHBondContact O-N 3.42Å; E135-Q137 VanDerWaalsContact C-N 3.34Å; E135-Q137 PolarHBondContact O-N 3.43Å; E135-A138 PolarHBondContact O-N 3.49Å; E135-R139 VanDerWaalsContact O-CB 3.31Å; E135-R139 WeakPolarHBondContact O-CB 3.29Å; E135-R139 PolarHBondContact O-N 3.4Å
136	A	95.6	Very high	94.9	Very high	64 Å²	64	81.7 Å²	81.7	53%	0.529	43%	0.426	S	S	.	.	H	α-helix	trans	-60.5	-44.8	172.1	0	0	0	0	0	111.4	L132 S133 L140	L132-A136 WeakPolarHBondContact O-CB 3.38Å; L132-A136 PolarHBondContact O-N 2.86Å; S133-A136 PolarHBondContact O-N 2.97Å; A136-L140 PolarHBondContact O-N 3.33Å
137	Q	97.2	Very high	94.5	Very high	131 Å²	131	81.6 Å²	81.6	61%	0.612	43%	0.431	S	S	*	.	H	α-helix	trans	-64.9	-42.4	177.1	-172.9	-179.3	7.2	0	0	111.9	S133 L134 E135 L140 K141	S133-Q137 PolarHBondContact O-N 3.25Å; L134-Q137 PolarHBondContact O-N 2.92Å; E135-Q137 VanDerWaalsContact C-N 3.34Å; E135-Q137 PolarHBondContact O-N 3.43Å; Q137-L140 PolarHBondContact O-N 2.87Å; Q137-K141 PolarHBondContact O-N 2.9Å
138	A	95.3	Very high	93.8	Very high	22 Å²	22	82.3 Å²	82.3	18%	0.182	44%	0.444	C	S	.	.	H	α-helix	trans	-67.4	-40.8	-179.4	0	0	0	0	0	111.6	R103 L134 E135 L140 K141 F142	R103-A138 VanDerWaalsContact CZ-CB 3.48Å; R103-A138 VanDerWaalsContact NH1-CB 3.32Å; R103-A138 PolarHBondContact NH1-O 3.3Å; L134-A138 VanDerWaalsContact O-CB 3.27Å; L134-A138 WeakPolarHBondContact O-CB 3.32Å; L134-A138 PolarHBondContact O-N 3.08Å; E135-A138 PolarHBondContact O-N 3.49Å; A138-L140 PolarHBondContact O-N 2.87Å; A138-K141 WeakPolarHBondContact O-CB 3.34Å; A138-K141 PolarHBondContact O-N 2.9Å; A138-F142 PolarHBondContact O-N 3.33Å
139	R	94.9	Very high	93	Very high	152 Å²	152	80.7 Å²	80.7	57%	0.574	44%	0.436	S	S	*	.	H	α-helix	trans	-60.2	-43.7	172.2	-177.5	176.2	179.2	172.9	2	112.3	E135 K141 F142 Q143	E135-R139 VanDerWaalsContact O-CB 3.31Å; E135-R139 WeakPolarHBondContact O-CB 3.29Å; E135-R139 PolarHBondContact O-N 3.4Å; R139-K141 VanDerWaalsContact C-N 3.32Å; R139-K141 PolarHBondContact O-N 3.48Å; R139-F142 PolarHBondContact O-N 2.94Å; R139-Q143 WeakPolarHBondContact O-CG 3.14Å; R139-Q143 PolarHBondContact O-N 3.42Å
140	L	95.7	Very high	91.8	Very high	108 Å²	108	80.2 Å²	80.2	57%	0.565	44%	0.438	S	S	*	.	H	α-helix	trans	-62.4	-41.6	176.5	-179.5	64.4	0	0	0	111.6	A136 Q137 A138 Q143 T144	A136-L140 PolarHBondContact O-N 3.33Å; Q137-L140 PolarHBondContact O-N 2.87Å; A138-L140 PolarHBondContact O-N 2.87Å; L140-Q143 PolarHBondContact O-N 3.02Å; L140-T144 PolarHBondContact O-N 2.82Å; L140-T144 PolarHBondContact O-OG1 2.9Å
141	K	94.4	Very high	90.2	Very high	136 Å²	136	84.1 Å²	84.1	59%	0.591	46%	0.456	S	S	*	.	H	α-helix	trans	-61.4	-47	175.5	-176.4	-178.7	179.1	-178.2	0	111.1	Q137 A138 R139 T144 Q145	Q137-K141 PolarHBondContact O-N 2.9Å; A138-K141 WeakPolarHBondContact O-CB 3.34Å; A138-K141 PolarHBondContact O-N 2.9Å; R139-K141 VanDerWaalsContact C-N 3.32Å; R139-K141 PolarHBondContact O-N 3.48Å; K141-T144 PolarHBondContact O-N 3.42Å; K141-Q145 WeakPolarHBondContact O-CG 3.34Å; K141-Q145 PolarHBondContact O-N 3.38Å
142	F	94	Very high	88.5	Confident	29 Å²	29	87.3 Å²	87.3	13%	0.127	47%	0.468	C	S	.	.	H	α-helix	trans	-60.7	-44.8	177.1	173.8	-112.2	0	0	0	112.1	F96 Y97 E100 A138 R139 T144 Q145 L146	F96-F142 HydrophobicContact CB-CE2 3.98Å; Y97-F142 AromaticContact CD1-CZ 3.99Å; Y97-F142 HydrophobicContact CD1-CZ 3.99Å; Y97-F142 HydrophobicContact CE1-CE1 4.43Å; Y97-F142 AromaticContact CE1-CZ 3.74Å; Y97-F142 HydrophobicContact CE1-CZ 3.74Å; E100-F142 VanDerWaalsContact CD-CB 3.49Å; E100-F142 HydrophobicContact CG-CB 4.31Å; E100-F142 HydrophobicContact CG-CD1 4.09Å; E100-F142 HydrophobicContact CG-CD2 3.24Å; E100-F142 HydrophobicContact CG-CE1 4.22Å; E100-F142 HydrophobicContact CG-CE2 3.4Å; E100-F142 HydrophobicContact CG-CG 3.61Å; E100-F142 HydrophobicContact CG-CZ 3.9Å; E100-F142 WeakPolarHBondContact OE2-CB 3.47Å; E100-F142 WeakPolarHBondContact OE2-CG 3.47Å; A138-F142 PolarHBondContact O-N 3.33Å; R139-F142 PolarHBondContact O-N 2.94Å; F142-T144 VanDerWaalsContact C-N 3.35Å; F142-T144 PolarHBondContact O-N 2.95Å; F142-Q145 PolarHBondContact O-N 2.94Å; F142-L146 HydrophobicContact CE2-CD1 4.34Å; F142-L146 HydrophobicContact CZ-CD1 3.94Å; F142-L146 WeakPolarHBondContact O-CB 2.96Å; F142-L146 PolarHBondContact O-N 3.03Å
143	Q	92.4	Very high	86.2	Confident	98 Å²	98	86 Å²	86	46%	0.458	47%	0.466	S	S	.	.	H	α-helix	trans	-60.6	-43.2	176.4	-74.6	177.1	-12.6	0	0	112.3	R139 L140 Q145 L146 A147	R139-Q143 WeakPolarHBondContact O-CG 3.14Å; R139-Q143 PolarHBondContact O-N 3.42Å; L140-Q143 PolarHBondContact O-N 3.02Å; Q143-Q145 VanDerWaalsContact C-N 3.33Å; Q143-Q145 PolarHBondContact O-N 3.46Å; Q143-L146 PolarHBondContact O-N 2.9Å; Q143-A147 WeakPolarHBondContact O-CB 3.24Å; Q143-A147 PolarHBondContact O-N 3.21Å
144	T	91.8	Very high	84.1	Confident	89 Å²	89	88.1 Å²	88.1	55%	0.546	48%	0.476	S	S	.	.	H	α-helix	trans	-62	-41.8	175.5	-54	0	0	0	0	111.5	L140 K141 F142 A147 S148	L140-T144 PolarHBondContact O-N 2.82Å; L140-T144 PolarHBondContact O-OG1 2.9Å; K141-T144 PolarHBondContact O-N 3.42Å; F142-T144 VanDerWaalsContact C-N 3.35Å; F142-T144 PolarHBondContact O-N 2.95Å; T144-A147 PolarHBondContact O-N 3.01Å; T144-S148 PolarHBondContact O-N 3.44Å
145	Q	89.9	Confident	82	Confident	67 Å²	67	86.3 Å²	86.3	31%	0.313	47%	0.471	S	S	.	.	H	α-helix	trans	-66.5	-42.3	176.9	-73.7	178.2	-39.6	0	0	111.9	F96 K141 F142 Q143 A147 S148 V149	F96-Q145 HydrophobicContact CZ-CB 4.35Å; K141-Q145 WeakPolarHBondContact O-CG 3.34Å; K141-Q145 PolarHBondContact O-N 3.38Å; F142-Q145 PolarHBondContact O-N 2.94Å; Q143-Q145 VanDerWaalsContact C-N 3.33Å; Q143-Q145 PolarHBondContact O-N 3.46Å; Q145-A147 PolarHBondContact O-N 3.35Å; Q145-S148 WeakPolarHBondContact O-CB 3.38Å; Q145-S148 PolarHBondContact O-N 3.27Å; Q145-S148 VanDerWaalsContact O-N 3.15Å; Q145-S148 PolarHBondContact O-OG 3.44Å; Q145-V149 PolarHBondContact O-N 3.31Å
146	L	88.5	Confident	79.9	Confident	63 Å²	63	86.2 Å²	86.2	33%	0.33	48%	0.476	S	S	.	.	H	α-helix	trans	-61.8	-43.6	176.7	-163.8	94.2	0	0	0	111.3	L93 F142 Q143 S148 V149	L93-L146 HydrophobicContact CD1-CD1 3.61Å; F142-L146 HydrophobicContact CE2-CD1 4.34Å; F142-L146 HydrophobicContact CZ-CD1 3.94Å; F142-L146 WeakPolarHBondContact O-CB 2.96Å; F142-L146 PolarHBondContact O-N 3.03Å; Q143-L146 PolarHBondContact O-N 2.9Å; L146-S148 PolarHBondContact O-N 2.83Å; L146-V149 WeakPolarHBondContact O-CB 3.48Å; L146-V149 PolarHBondContact O-N 2.86Å
147	A	86.6	Confident	77.9	Confident	86 Å²	86	86.1 Å²	86.1	71%	0.711	47%	0.468	S	S	*	.	H	α-helix	trans	-64.5	-23.2	177.1	0	0	0	0	0	113.2	Q143 T144 Q145 V149	Q143-A147 WeakPolarHBondContact O-CB 3.24Å; Q143-A147 PolarHBondContact O-N 3.21Å; T144-A147 PolarHBondContact O-N 3.01Å; Q145-A147 PolarHBondContact O-N 3.35Å; A147-V149 VanDerWaalsContact C-N 3.32Å
148	S	82.3	Confident	76.1	Confident	89 Å²	89	86.1 Å²	86.1	62%	0.622	47%	0.468	S	S	*	.	H	α-helix	trans	-78.1	-16.5	174.2	78.6	0	0	0	0	113.5	T144 Q145 L146 P150	T144-S148 PolarHBondContact O-N 3.44Å; Q145-S148 WeakPolarHBondContact O-CB 3.38Å; Q145-S148 PolarHBondContact O-N 3.27Å; Q145-S148 VanDerWaalsContact O-N 3.15Å; Q145-S148 PolarHBondContact O-OG 3.44Å; L146-S148 PolarHBondContact O-N 2.83Å; S148-P150 WeakPolarHBondContact O-CD 3.46Å
149	V	79.4	Confident	74.1	Confident	18 Å²	18	91 Å²	91	11%	0.109	49%	0.487	C	S	.	.	S	Bend	trans	-75.1	122	171.1	-175.3	0	0	0	0	107	L92 F96 Q145 L146 A147 E151	L92-V149 HydrophobicContact CD2-CG2 3.86Å; F96-V149 HydrophobicContact CD2-CG2 4.39Å; F96-V149 HydrophobicContact CE2-CG2 3.96Å; Q145-V149 PolarHBondContact O-N 3.31Å; L146-V149 WeakPolarHBondContact O-CB 3.48Å; L146-V149 PolarHBondContact O-N 2.86Å; A147-V149 VanDerWaalsContact C-N 3.32Å; V149-E151 PolarHBondContact O-N 3.41Å
150	P	72.4	Confident	72.1	Confident	86 Å²	86	87.1 Å²	87.1	56%	0.558	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-52.8	126.3	-179.2	-24.5	32	0	0	0	111	S148 W152	S148-P150 WeakPolarHBondContact O-CD 3.46Å; P150-W152 PolarHBondContact O-N 3.33Å
151	E	63.9	Low	70	Confident	199 Å²	199	88.7 Å²	88.7	93%	0.93	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-52.4	123.5	173.2	-83.4	-175.6	158.6	0	0	109.4	V149 S153	V149-E151 PolarHBondContact O-N 3.41Å; E151-S153 PolarHBondContact O-N 3.18Å
152	W	58.8	Low	67.5	Low	86 Å²	86	90.4 Å²	90.4	33%	0.326	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-71.4	121.5	166.5	-58.5	-17.2	0	0	0	107.2	N89 L90 L93 P150 T154 V157	N89-W152 HydrophobicContact CB-CZ2 4.36Å; L90-W152 HydrophobicContact CD2-CH2 3.19Å; L90-W152 HydrophobicContact CD2-CZ2 3.97Å; L90-W152 HydrophobicContact CD2-CZ3 3.81Å; L90-W152 HydrophobicContact CG-CH2 3.66Å; L90-W152 HydrophobicContact CG-CZ2 3.92Å; L90-W152 HydrophobicContact CG-CZ3 4.49Å; L93-W152 HydrophobicContact CD2-CH2 3.79Å; L93-W152 HydrophobicContact CD2-CZ2 4.39Å; L93-W152 HydrophobicContact CD2-CZ3 4.49Å; P150-W152 PolarHBondContact O-N 3.33Å; W152-T154 PolarHBondContact O-N 2.66Å; W152-T154 VanDerWaalsContact O-N 3.13Å; W152-V157 HydrophobicContact CE3-CG2 4.12Å
153	S	48	Very low	66.2	Low	68 Å²	68	93.5 Å²	93.5	48%	0.476	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-57.6	122.1	151.7	60.7	0	0	0	0	106.1	E151 S155 S156	E151-S153 PolarHBondContact O-N 3.18Å; S153-S155 WeakPolarHBondContact CB-OG 3.49Å; S153-S155 PolarHBondContact O-N 3.33Å; S153-S155 PolarHBondContact OG-OG 3.23Å; S153-S156 WeakPolarHBondContact O-CB 3.41Å; S153-S156 PolarHBondContact O-N 2.63Å; S153-S156 PolarHBondContact O-OG 3.36Å; S153-S156 PolarHBondContact OG-OG 3.06Å
154	T	52.2	Low	64.8	Low	121 Å²	121	93.3 Å²	93.3	74%	0.742	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.2	-28.2	176.8	39.2	0	0	0	0	112.8	W152 S156 V157	W152-T154 PolarHBondContact O-N 2.66Å; W152-T154 VanDerWaalsContact O-N 3.13Å; T154-S156 PolarHBondContact O-N 3.03Å; T154-S156 VanDerWaalsContact O-N 3.14Å; T154-V157 PolarHBondContact O-N 3.11Å
155	S	52.6	Low	63.4	Low	51 Å²	51	93.5 Å²	93.5	36%	0.357	52%	0.521	S	S	.	.	H	α-helix	trans	-54	-27	171.5	69.3	0	0	0	0	115.4	S153 H159	S153-S155 WeakPolarHBondContact CB-OG 3.49Å; S153-S155 PolarHBondContact O-N 3.33Å; S153-S155 PolarHBondContact OG-OG 3.23Å; S155-H159 PolarHBondContact O-CD2 3.05Å
156	S	52.9	Low	61.8	Low	47 Å²	47	95.1 Å²	95.1	33%	0.329	53%	0.534	S	S	.	.	H	α-helix	trans	-76.9	-28.4	-173.9	-62.9	0	0	0	0	112.8	S153 T154	S153-S156 WeakPolarHBondContact O-CB 3.41Å; S153-S156 PolarHBondContact O-N 2.63Å; S153-S156 PolarHBondContact O-OG 3.36Å; S153-S156 PolarHBondContact OG-OG 3.06Å; T154-S156 PolarHBondContact O-N 3.03Å; T154-S156 VanDerWaalsContact O-N 3.14Å
157	V	53.7	Low	60.1	Low	62 Å²	62	97.1 Å²	97.1	38%	0.376	55%	0.546	S	S	.	.	H	α-helix	trans	-80.7	-36.9	179.9	-177	0	0	0	0	111.1	W152 T154 H159 L160	W152-V157 HydrophobicContact CE3-CG2 4.12Å; T154-V157 PolarHBondContact O-N 3.11Å; V157-H159 VanDerWaalsContact C-N 3.25Å; V157-H159 PolarHBondContact O-N 3.33Å; V157-L160 WeakPolarHBondContact O-CB 3.42Å; V157-L160 PolarHBondContact O-N 3.19Å
158	E	57.6	Low	58.4	Low	132 Å²	132	97.8 Å²	97.8	62%	0.617	54%	0.535	S	S	*	.	H	α-helix	trans	-57.7	-39.9	175.5	-67.3	178.1	172.5	0	0	111.3	L160 I161	E158-L160 PolarHBondContact O-N 3.3Å; E158-I161 PolarHBondContact O-N 3.23Å
159	H	54.9	Low	56.7	Low	125 Å²	125	98.4 Å²	98.4	58%	0.579	53%	0.529	S	S	*	.	H	α-helix	trans	-72.3	-5.1	176.8	-68.8	-41.5	0	0	0	116	S155 V157	S155-H159 PolarHBondContact O-CD2 3.05Å; V157-H159 VanDerWaalsContact C-N 3.25Å; V157-H159 PolarHBondContact O-N 3.33Å
160	L	52.6	Low	54.9	Low	69 Å²	69	104.6 Å²	104.6	36%	0.361	56%	0.561	S	S	.	*	H	α-helix	trans	-90.4	-18.1	174.1	-93.1	143.3	0	0	0	112.7	Q83 V86 V157 E158	Q83-L160 HydrophobicContact CB-CD2 4.39Å; Q83-L160 HydrophobicContact CG-CD2 3.93Å; V86-L160 HydrophobicContact CB-CD1 4.2Å; V86-L160 HydrophobicContact CG1-CD1 3.6Å; V86-L160 HydrophobicContact CG2-CD1 4.44Å; V157-L160 WeakPolarHBondContact O-CB 3.42Å; V157-L160 PolarHBondContact O-N 3.19Å; E158-L160 PolarHBondContact O-N 3.3Å
161	I	52	Low	53.4	Low	142 Å²	142	106.2 Å²	106.2	73%	0.728	56%	0.562	S	S	*	*	H	α-helix	trans	-90.5	-18.9	-176.6	-58.5	174.9	0	0	0	111.6	E158	E158-I161 PolarHBondContact O-N 3.23Å
162	D	42.2	Very low	52.5	Low	172 Å²	172	97.7 Å²	97.7	92%	0.92	53%	0.528	S	S	*	.			trans	-93.6	0	175.2	-60.9	-23.7	0	0	0	114.5

Retrieved 162 of 162 residues in 29.3 ms (Link to these results)

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