A0A077ZFC2_TRITR Loading...

Endonuclease III homolog

Bifunctional DNA N-glycosylase with associated apurinic/apyrimidinic (AP) lyase function that catalyzes the first step in base excision repair (BER), the primary repair pathway for the repair of oxidative DNA damage. The DNA N-glycosylase activity releases the damaged DNA base from DNA by cleaving the N-glycosidic bond, leaving an AP site. The AP lyase activity cleaves the phosphodiester bond 3' to the AP site by a beta-elimination. Primarily recognizes and repairs oxidative base damage of pyrimidines.

AlphaFold DB , UniProt , Accession A0A077ZFC2, Species TRITR (Trichuris trichiura, Whipworm), Gene NTH1, Length 277 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.1	Very low	34.3	Very low	239 Å²	239	190.3 Å²	190.3	100%	1.177	90%	0.896	S	S	*	*				0	91.6	0	-160.3	169.7	-172.7	0	0	106.9
2	F	36.3	Very low	33.7	Very low	210 Å²	210	187 Å²	187	92%	0.921	89%	0.886	S	S	*	*	P	Polyproline II helix	trans	-80.2	128.4	-176.2	-80.7	-86.5	0	0	0	110
3	P	43.3	Very low	33.9	Very low	123 Å²	123	181.8 Å²	181.8	80%	0.799	88%	0.882	S	S	*	*	P	Polyproline II helix	trans	-83.1	125.6	176.5	30.4	-29.5	0	0	0	111.1
4	C	24.6	Very low	33.6	Very low	127 Å²	127	175.7 Å²	175.7	86%	0.858	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-87.8	120	168.2	-170.9	0	0	0	0	108.7
5	R	38.7	Very low	33.6	Very low	244 Å²	244	171.1 Å²	171.1	92%	0.921	88%	0.876	S	S	*	*			trans	-146.6	111.2	166.4	-100.3	-172.9	178.7	-169.6	-0.8	113.1
6	A	36.7	Very low	33.2	Very low	90 Å²	90	166.6 Å²	166.6	74%	0.744	87%	0.873	S	S	*	*			trans	58.1	108.1	131.1	0	0	0	0	0	121.9
7	R	30.5	Very low	33.1	Very low	249 Å²	249	171.6 Å²	171.6	94%	0.94	88%	0.878	S	S	*	*			trans	14.9	123.9	131.9	-67.7	-179.6	176.6	-168.1	-2.2	118.2
8	R	36.9	Very low	32.9	Very low	257 Å²	257	167.7 Å²	167.7	97%	0.97	88%	0.875	S	S	*	*			trans	-125.3	159.6	150.1	-84.1	-168.4	-170	-166.7	3.6	111.3
9	R	31	Very low	32.9	Very low	243 Å²	243	167.4 Å²	167.4	92%	0.917	88%	0.875	S	S	*	*			trans	-93.7	155.8	-148.3	-163.9	-177.6	-150.2	168.6	2.4	112
10	V	27.3	Very low	32.8	Very low	114 Å²	114	163.7 Å²	163.7	69%	0.691	86%	0.863	S	S	*	*			trans	-59.2	139.9	171.5	174.5	0	0	0	0	112.2	I12	V10-I12 HydrophobicContact CG1-CD1 4.47Å; V10-I12 HydrophobicContact CG1-CG1 3.84Å
11	E	31	Very low	32.9	Very low	197 Å²	197	163.8 Å²	163.8	92%	0.921	87%	0.865	S	S	*	*			trans	-119.7	133	154.8	-76.9	-172.1	163.2	0	0	109.7
12	I	27.4	Very low	32.3	Very low	151 Å²	151	156.4 Å²	156.4	77%	0.774	85%	0.85	S	S	*	*			trans	-104.8	133.2	-177.6	-64	165.5	0	0	0	106.4	V10	V10-I12 HydrophobicContact CG1-CD1 4.47Å; V10-I12 HydrophobicContact CG1-CG1 3.84Å
13	S	35.9	Very low	32	Very low	120 Å²	120	150.3 Å²	150.3	84%	0.839	85%	0.846	S	S	*	*			trans	-135.3	116.1	156.6	66	0	0	0	0	109.9
14	A	29.6	Very low	31.1	Very low	96 Å²	96	150.8 Å²	150.8	79%	0.793	85%	0.847	S	S	*	*			trans	-79.8	143.9	177.9	0	0	0	0	0	111.6
15	A	33.9	Very low	31.4	Very low	106 Å²	106	151.5 Å²	151.5	88%	0.876	85%	0.847	S	S	*	*			trans	-142	101.8	156	0	0	0	0	0	108.4
16	A	27.7	Very low	30.9	Very low	100 Å²	100	145.7 Å²	145.7	83%	0.826	84%	0.839	S	S	*	*			trans	-76.9	135.9	172.2	0	0	0	0	0	110.3
17	R	31.1	Very low	30.4	Very low	252 Å²	252	148 Å²	148	95%	0.951	84%	0.837	S	S	*	*			trans	-141.9	120.5	150.2	-94.9	-177	-177.7	176.5	0.2	109.5
18	A	29	Very low	30.4	Very low	101 Å²	101	144.9 Å²	144.9	84%	0.835	83%	0.833	S	S	*	*			trans	-70	145	175.7	0	0	0	0	0	111.1
19	N	34.1	Very low	29.9	Very low	162 Å²	162	140.2 Å²	140.2	87%	0.866	83%	0.826	S	S	*	*			trans	-141.9	123.5	144.3	-145.1	9.5	0	0	0	109.7
20	S	29.9	Very low	29.9	Very low	93 Å²	93	137.9 Å²	137.9	65%	0.65	83%	0.825	S	S	*	*			trans	-84.2	136.1	179	48.4	0	0	0	0	110.8
21	N	35.5	Very low	29.9	Very low	166 Å²	166	136.9 Å²	136.9	89%	0.888	82%	0.823	S	S	*	*			trans	178.5	111.9	148.7	-86.1	-16.7	0	0	0	103.8
22	G	27.3	Very low	29.8	Very low	84 Å²	84	134.9 Å²	134.9	87%	0.866	82%	0.818	S	S	*	*				97	92	51.4	0	0	0	0	0	107.7
23	G	29.8	Very low	30.1	Very low	81 Å²	81	131.5 Å²	131.5	84%	0.835	82%	0.821	S	S	*	*			trans	163.2	100.4	176.1	0	0	0	0	0	114
24	T	24.8	Very low	30	Very low	134 Å²	134	135 Å²	135	82%	0.822	82%	0.82	S	S	*	*			trans	-86.3	127.5	176.4	-63.1	0	0	0	0	111.1
25	T	32.4	Very low	30.2	Very low	142 Å²	142	139.3 Å²	139.3	87%	0.871	83%	0.825	S	S	*	*			trans	-165.1	124.7	134.8	9.1	0	0	0	0	112
26	V	26.3	Very low	30.2	Very low	121 Å²	121	142 Å²	142	73%	0.733	82%	0.824	S	S	*	*			trans	-61.4	146.7	155.4	-174	0	0	0	0	106.1
27	I	28.1	Very low	30.4	Very low	139 Å²	139	139.7 Å²	139.7	71%	0.713	81%	0.81	S	S	*	*				-169.9	148.3	69.9	-27	-176.7	0	0	0	110.5
28	E	29.6	Very low	30.9	Very low	184 Å²	184	133.6 Å²	133.6	86%	0.86	80%	0.803	S	S	*	*			trans	88.9	125.5	139.8	-106.3	161.1	-165.2	0	0	122.4
29	I	25.6	Very low	31.5	Very low	159 Å²	159	137.6 Å²	137.6	82%	0.815	80%	0.804	S	S	*	*			trans	-91.2	128.8	-178.8	-63.8	158.7	0	0	0	105.7
30	E	32.4	Very low	31.7	Very low	193 Å²	193	136 Å²	136	90%	0.902	80%	0.801	S	S	*	*			trans	-147.3	138.1	145.3	-117.7	172.1	-162.6	0	0	112.5
31	S	27.5	Very low	32.4	Very low	93 Å²	93	139.9 Å²	139.9	65%	0.65	81%	0.811	S	S	*	*			trans	-65.9	173.6	-164.9	46.6	0	0	0	0	117.5
32	L	28.9	Very low	33.1	Very low	156 Å²	156	140.9 Å²	140.9	82%	0.817	81%	0.81	S	S	*	*			trans	103	58.5	154.9	-52.9	174.7	0	0	0	116.6	K34	L32-K34 PolarHBondContact O-N 3.09Å
33	G	32.5	Very low	35	Very low	80 Å²	80	146.1 Å²	146.1	83%	0.825	81%	0.812	S	S	*	*			trans	-71.8	102.2	148.8	0	0	0	0	0	109.2	E35	G33-E35 PolarHBondContact O-N 3.16Å
34	K	34.7	Very low	37.3	Very low	192 Å²	192	144.7 Å²	144.7	84%	0.835	79%	0.789	S	S	*	*			trans	-52.5	122.7	174.6	-70.3	174.3	177.3	175.9	0	110.2	L32 N36	L32-K34 PolarHBondContact O-N 3.09Å; K34-N36 PolarHBondContact O-N 2.79Å
35	E	32.4	Very low	40.6	Very low	188 Å²	188	143.9 Å²	143.9	88%	0.879	77%	0.771	S	S	*	*			trans	-59.5	120.7	163.1	-66.5	-178.2	156.9	0	0	108	G33 G37	G33-E35 PolarHBondContact O-N 3.16Å; E35-G37 PolarHBondContact O-N 3.05Å
36	N	34.1	Very low	43.6	Very low	162 Å²	162	141.5 Å²	141.5	87%	0.866	75%	0.75	S	S	*	*			trans	-64.1	99.8	171	-72.4	-34.7	0	0	0	107.6	K34	K34-N36 PolarHBondContact O-N 2.79Å
37	G	32.8	Very low	46.8	Very low	52 Å²	52	136.2 Å²	136.2	54%	0.536	72%	0.719	S	S	.	*			trans	-56	158.9	165.4	0	0	0	0	0	110.4	E35 E39	E35-G37 PolarHBondContact O-N 3.05Å; G37-E39 PolarHBondContact O-N 3.13Å
38	P	41.7	Very low	50	Low	124 Å²	124	136.9 Å²	136.9	81%	0.805	72%	0.723	S	S	*	*			trans	-60.6	118.3	-176.1	25.9	-31.4	0	0	0	108.2	T40	P38-T40 PolarHBondContact O-N 3.41Å
39	E	40.7	Very low	53.1	Low	184 Å²	184	131.6 Å²	131.6	86%	0.86	70%	0.7	S	S	*	*			trans	-48.7	107.5	167.8	-72.7	177.8	166.4	0	0	106.7	G37 M41	G37-E39 PolarHBondContact O-N 3.13Å; E39-M41 PolarHBondContact O-N 2.95Å
40	T	37.7	Very low	56.5	Low	129 Å²	129	125.3 Å²	125.3	79%	0.791	67%	0.666	S	S	*	*			trans	-59.7	99.3	167.9	49.2	0	0	0	0	104.6	P38 E42	P38-T40 PolarHBondContact O-N 3.41Å; T40-E42 PolarHBondContact O-N 3.3Å
41	M	45.6	Very low	59.6	Low	175 Å²	175	118.9 Å²	118.9	86%	0.862	64%	0.638	S	S	*	*			trans	-50	110.8	169.5	-69.7	-176.3	70.4	0	0	105.2	E39 E43	E39-M41 PolarHBondContact O-N 2.95Å; M41-E43 PolarHBondContact O-N 3.4Å
42	E	49.2	Very low	63	Low	186 Å²	186	119.9 Å²	119.9	87%	0.869	63%	0.627	S	S	*	*			trans	-48.2	117.7	173.9	-78.2	-178.9	149.1	0	0	106.3	T40 S44	T40-E42 PolarHBondContact O-N 3.3Å; E42-S44 PolarHBondContact O-N 3.06Å
43	E	67.3	Low	66.3	Low	195 Å²	195	112.7 Å²	112.7	91%	0.911	59%	0.59	S	S	*	*			trans	-63.6	89.9	174.1	-83.2	-175.3	161.3	0	0	106.6	M41 W45	M41-E43 PolarHBondContact O-N 3.4Å; E43-W45 PolarHBondContact O-N 3.19Å
44	S	79.4	Confident	69.4	Low	50 Å²	50	109 Å²	109	35%	0.35	55%	0.551	S	S	.	*			trans	-50.4	135.6	174.9	61.7	0	0	0	0	107.7	E42 Q46	E42-S44 PolarHBondContact O-N 3.06Å; S44-Q46 WeakPolarHBondContact O-CG 3.45Å; S44-Q46 PolarHBondContact O-N 3.01Å
45	W	93.3	Very high	72.5	Confident	117 Å²	117	107.3 Å²	107.3	44%	0.443	54%	0.54	S	S	.	.			trans	-48.2	128.3	175.3	172.5	89.6	0	0	0	110.5	E43 P47 V210 P211 W227	E43-W45 PolarHBondContact O-N 3.19Å; W45-P47 HydrophobicContact CH2-CB 4.22Å; W45-P47 HydrophobicContact CH2-CG 3.65Å; W45-P47 HydrophobicContact CZ2-CG 4.42Å; W45-P47 HydrophobicContact CZ3-CG 3.78Å; W45-V210 VanDerWaalsContact CH2-C 3.44Å; W45-P211 HydrophobicContact CD2-CB 4.24Å; W45-P211 HydrophobicContact CD2-CG 4.08Å; W45-P211 HydrophobicContact CE3-CB 4.2Å; W45-P211 HydrophobicContact CE3-CG 3.59Å; W45-P211 HydrophobicContact CH2-CB 4.37Å; W45-P211 HydrophobicContact CH2-CG 4.24Å; W45-P211 HydrophobicContact CZ2-CB 4.42Å; W45-P211 HydrophobicContact CZ3-CB 4.27Å; W45-P211 HydrophobicContact CZ3-CG 3.68Å; W45-W227 AromaticContact CE3-CD1 3.8Å; W45-W227 HydrophobicContact CE3-CG 4.24Å; W45-W227 AromaticContact CZ3-CD1 3.7Å; W45-W227 HydrophobicContact CZ3-CG 4.37Å; W45-W227 AromaticContact CZ3-NE1 3.68Å; W45-W227 WeakPolarHBondContact O-CB 3.24Å
46	Q	95	Very high	75.6	Confident	93 Å²	93	100 Å²	100	44%	0.435	51%	0.506	S	S	.	.			trans	-127.3	141.6	175	-71.5	178.2	15.8	0	0	110.3	S44 W227	S44-Q46 WeakPolarHBondContact O-CG 3.45Å; S44-Q46 PolarHBondContact O-N 3.01Å; Q46-W227 HydrophobicContact CB-CE3 4.4Å; Q46-W227 HydrophobicContact CG-CB 4.14Å; Q46-W227 HydrophobicContact CG-CE3 4.03Å
47	P	95.3	Very high	78.7	Confident	10 Å²	10	92.2 Å²	92.2	7%	0.065	47%	0.465	C	S	.	.			trans	-63.2	139.9	175	-14	24.6	0	0	0	111.3	W45 N49 W50 G208 W209 W227	W45-P47 HydrophobicContact CH2-CB 4.22Å; W45-P47 HydrophobicContact CH2-CG 3.65Å; W45-P47 HydrophobicContact CZ2-CG 4.42Å; W45-P47 HydrophobicContact CZ3-CG 3.78Å; P47-N49 PolarHBondContact O-N 3.2Å; P47-W50 HydrophobicContact CB-CB 4.09Å; P47-W50 HydrophobicContact CG-CB 4.22Å; P47-W50 WeakPolarHBondContact O-CB 3.39Å; P47-W50 VanDerWaalsContact O-CD1 3.25Å; P47-W50 PolarHBondContact O-N 3.34Å; P47-G208 WeakPolarHBondContact CB-O 3.32Å; P47-W209 HydrophobicContact CG-CB 4.4Å; P47-W209 HydrophobicContact CG-CG 4.28Å; P47-W227 HydrophobicContact CG-CD2 4.27Å; P47-W227 HydrophobicContact CG-CE3 4.47Å; P47-W227 HydrophobicContact CG-CH2 3.8Å; P47-W227 HydrophobicContact CG-CZ2 3.52Å; P47-W227 HydrophobicContact CG-CZ3 4.26Å
48	L	93.4	Very high	81.8	Confident	153 Å²	153	93.8 Å²	93.8	80%	0.801	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	135	176.1	-174.9	67.2	0	0	0	110.6	W50	L48-W50 PolarHBondContact O-N 3.13Å; L48-W50 VanDerWaalsContact O-N 3.15Å
49	N	95.5	Very high	84.4	Confident	72 Å²	72	90.2 Å²	90.2	39%	0.385	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	17.1	-180	-58	-50.1	0	0	0	115.3	P47 L51 R52 V53 I263	P47-N49 PolarHBondContact O-N 3.2Å; N49-L51 PolarHBondContact O-N 3.28Å; N49-L51 VanDerWaalsContact O-N 3.1Å; N49-R52 HydrophobicContact CB-CB 4.33Å; N49-R52 PolarHBondContact O-N 3.26Å; N49-V53 WeakPolarHBondContact O-CG2 3.25Å; N49-V53 PolarHBondContact O-N 2.98Å; N49-I263 HydrophobicContact CB-CD1 4.38Å
50	W	97.5	Very high	87.1	Confident	27 Å²	27	82.1 Å²	82.1	10%	0.102	40%	0.402	C	S	.	.	H	α-helix	trans	-52.2	-39.6	-176	73.7	-97.7	0	0	0	112.8	P47 L48 V53 L54 W227 L228 P229 Y232	P47-W50 HydrophobicContact CB-CB 4.09Å; P47-W50 HydrophobicContact CG-CB 4.22Å; P47-W50 WeakPolarHBondContact O-CB 3.39Å; P47-W50 VanDerWaalsContact O-CD1 3.25Å; P47-W50 PolarHBondContact O-N 3.34Å; L48-W50 PolarHBondContact O-N 3.13Å; L48-W50 VanDerWaalsContact O-N 3.15Å; W50-V53 WeakPolarHBondContact O-CB 3.41Å; W50-V53 PolarHBondContact O-N 3.31Å; W50-L54 HydrophobicContact CZ3-CD2 4.06Å; W50-L54 WeakPolarHBondContact O-CB 3.5Å; W50-L54 PolarHBondContact O-N 3.21Å; W50-W227 HydrophobicContact CB-CH2 3.91Å; W50-W227 HydrophobicContact CB-CZ3 3.9Å; W50-W227 HydrophobicContact CD2-CH2 4.25Å; W50-W227 AromaticContact CD2-CZ3 3.54Å; W50-W227 HydrophobicContact CD2-CZ3 3.54Å; W50-W227 HydrophobicContact CE3-CH2 4.3Å; W50-W227 AromaticContact CE3-CZ3 3.82Å; W50-W227 HydrophobicContact CE3-CZ3 3.82Å; W50-W227 HydrophobicContact CG-CE3 4.47Å; W50-W227 HydrophobicContact CG-CH2 4.1Å; W50-W227 AromaticContact CG-CZ3 3.57Å; W50-W227 HydrophobicContact CG-CZ3 3.57Å; W50-L228 HydrophobicContact CE3-CD1 4.28Å; W50-L228 HydrophobicContact CZ3-CD1 4.01Å; W50-P229 HydrophobicContact CH2-CG 3.77Å; W50-P229 HydrophobicContact CZ2-CG 3.93Å; W50-Y232 HydrophobicContact CH2-CD2 4.15Å; W50-Y232 AromaticContact CH2-CE2 3.64Å; W50-Y232 HydrophobicContact CH2-CE2 3.64Å; W50-Y232 HydrophobicContact CZ3-CD2 4.19Å; W50-Y232 AromaticContact CZ3-CE2 3.94Å; W50-Y232 HydrophobicContact CZ3-CE2 3.94Å
51	L	97.9	Very high	89.9	Confident	58 Å²	58	77.3 Å²	77.3	30%	0.304	37%	0.369	S	S	.	.	H	α-helix	trans	-69.3	-40.1	-180	-176.4	61	0	0	0	112.2	N49 V53 L54 R55	N49-L51 PolarHBondContact O-N 3.28Å; N49-L51 VanDerWaalsContact O-N 3.1Å; L51-V53 VanDerWaalsContact C-N 3.32Å; L51-L54 PolarHBondContact O-N 3.16Å; L51-R55 WeakPolarHBondContact O-CG 3.45Å; L51-R55 PolarHBondContact O-N 2.93Å
52	R	98.3	Very high	92.2	Very high	114 Å²	114	73 Å²	73	43%	0.43	36%	0.356	S	S	.	.	H	α-helix	trans	-62.5	-42.7	173	178.5	178.1	169.3	-152	-12.7	110.4	N49 L54 R55 N56 D262 I263	N49-R52 HydrophobicContact CB-CB 4.33Å; N49-R52 PolarHBondContact O-N 3.26Å; R52-L54 VanDerWaalsContact C-N 3.35Å; R52-L54 PolarHBondContact O-N 3.26Å; R52-R55 PolarHBondContact O-N 3.48Å; R52-N56 WeakPolarHBondContact O-CB 3.35Å; R52-N56 VanDerWaalsContact O-CG 3.29Å; R52-N56 PolarHBondContact O-N 3.46Å; R52-D262 IonicContact CZ-OD2 3.66Å; R52-D262 IonicContact NH1-OD2 3.72Å; R52-D262 IonicContact NH2-OD1 2.82Å; R52-D262 IonicContact NH2-OD2 3.32Å; R52-D262 PolarHBondContact NH2-OD2 3.01Å; R52-I263 HydrophobicContact CB-CD1 4.47Å; R52-I263 HydrophobicContact CG-CD1 3.99Å
53	V	98.3	Very high	94	Very high	6 Å²	6	70.9 Å²	70.9	4%	0.036	35%	0.351	C	S	.	.	H	α-helix	trans	-58.4	-48.2	176.1	172.4	0	0	0	0	111	N49 W50 L51 N56 I57 L207 W209 N260 I263	N49-V53 WeakPolarHBondContact O-CG2 3.25Å; N49-V53 PolarHBondContact O-N 2.98Å; W50-V53 WeakPolarHBondContact O-CB 3.41Å; W50-V53 PolarHBondContact O-N 3.31Å; L51-V53 VanDerWaalsContact C-N 3.32Å; V53-N56 PolarHBondContact O-N 3.01Å; V53-I57 HydrophobicContact CG1-CD1 4.04Å; V53-I57 WeakPolarHBondContact O-CG1 3.48Å; V53-I57 PolarHBondContact O-N 2.92Å; V53-L207 HydrophobicContact CG1-CD1 3.82Å; V53-L207 HydrophobicContact CG1-CD2 3.74Å; V53-L207 HydrophobicContact CG1-CG 4.31Å; V53-W209 HydrophobicContact CB-CZ2 4.09Å; V53-W209 HydrophobicContact CG1-CZ2 3.64Å; V53-N260 WeakPolarHBondContact CA-OD1 3.38Å; V53-N260 PolarHBondContact O-ND2 3.46Å; V53-N260 VanDerWaalsContact O-ND2 3.11Å; V53-I263 HydrophobicContact CG2-CD1 3.49Å; V53-I263 VanDerWaalsContact CG2-CD1 3.49Å; V53-I263 HydrophobicContact CG2-CG1 3.97Å
54	L	98.4	Very high	94.9	Very high	1 Å²	1	66.3 Å²	66.3	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-60.6	-51.3	179.7	-178.1	67.1	0	0	0	111.5	W50 L51 R52 N56 I57 E58 W209 Y232 I236 L239	W50-L54 HydrophobicContact CZ3-CD2 4.06Å; W50-L54 WeakPolarHBondContact O-CB 3.5Å; W50-L54 PolarHBondContact O-N 3.21Å; L51-L54 PolarHBondContact O-N 3.16Å; R52-L54 VanDerWaalsContact C-N 3.35Å; R52-L54 PolarHBondContact O-N 3.26Å; L54-N56 VanDerWaalsContact C-N 3.28Å; L54-N56 PolarHBondContact O-N 3.01Å; L54-I57 WeakPolarHBondContact O-CA 3.11Å; L54-I57 WeakPolarHBondContact O-CB 3.38Å; L54-I57 PolarHBondContact O-N 3.02Å; L54-E58 WeakPolarHBondContact O-CG 3.28Å; L54-E58 PolarHBondContact O-N 2.88Å; L54-W209 HydrophobicContact CB-CH2 4.31Å; L54-W209 HydrophobicContact CB-CZ2 4.4Å; L54-W209 HydrophobicContact CD1-CH2 4.04Å; L54-Y232 HydrophobicContact CD2-CD1 3.48Å; L54-Y232 VanDerWaalsContact CD2-CD1 3.48Å; L54-Y232 HydrophobicContact CD2-CE1 3.49Å; L54-Y232 VanDerWaalsContact CD2-CE1 3.49Å; L54-Y232 HydrophobicContact CD2-CG 4.05Å; L54-I236 HydrophobicContact CD1-CD1 3.61Å; L54-L239 HydrophobicContact CD1-CD2 3.48Å; L54-L239 VanDerWaalsContact CD1-CD2 3.48Å
55	R	98.4	Very high	95.5	Very high	158 Å²	158	70.9 Å²	70.9	60%	0.596	34%	0.344	S	S	*	.	H	α-helix	trans	-58.9	-39.2	178.8	-73.6	-174.8	178.7	-173.8	1.1	112.9	L51 R52 I57 E58 A59	L51-R55 WeakPolarHBondContact O-CG 3.45Å; L51-R55 PolarHBondContact O-N 2.93Å; R52-R55 PolarHBondContact O-N 3.48Å; R55-I57 VanDerWaalsContact C-N 3.33Å; R55-I57 PolarHBondContact O-N 3.44Å; R55-E58 WeakPolarHBondContact O-CB 2.73Å; R55-E58 PolarHBondContact O-N 3.32Å; R55-A59 WeakPolarHBondContact O-CB 3.16Å; R55-A59 PolarHBondContact O-N 3.06Å
56	N	98.3	Very high	95.5	Very high	33 Å²	33	65.5 Å²	65.5	18%	0.176	32%	0.324	C	S	.	.	H	α-helix	trans	-64.3	-37.8	174.5	-80.4	-9.3	0	0	0	112.1	R52 V53 L54 M60 L259 N260	R52-N56 WeakPolarHBondContact O-CB 3.35Å; R52-N56 VanDerWaalsContact O-CG 3.29Å; R52-N56 PolarHBondContact O-N 3.46Å; V53-N56 PolarHBondContact O-N 3.01Å; L54-N56 VanDerWaalsContact C-N 3.28Å; L54-N56 PolarHBondContact O-N 3.01Å; N56-M60 VanDerWaalsContact O-CE 3.3Å; N56-M60 WeakPolarHBondContact O-CE 3.3Å; N56-M60 WeakPolarHBondContact O-CG 3.35Å; N56-M60 PolarHBondContact O-N 3.36Å; N56-L259 HydrophobicContact CB-CB 3.89Å; N56-L259 PolarHBondContact ND2-O 2.75Å; N56-L259 VanDerWaalsContact ND2-O 3.13Å; N56-N260 WeakPolarHBondContact CB-OD1 3.39Å; N56-N260 PolarHBondContact ND2-OD1 3.21Å
57	I	98.2	Very high	95.5	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.3	-43.8	174.3	-64.9	166.9	0	0	0	110.2	V53 L54 R55 M60 R61 L207 L239 L240 F243	V53-I57 HydrophobicContact CG1-CD1 4.04Å; V53-I57 WeakPolarHBondContact O-CG1 3.48Å; V53-I57 PolarHBondContact O-N 2.92Å; L54-I57 WeakPolarHBondContact O-CA 3.11Å; L54-I57 WeakPolarHBondContact O-CB 3.38Å; L54-I57 PolarHBondContact O-N 3.02Å; R55-I57 VanDerWaalsContact C-N 3.33Å; R55-I57 PolarHBondContact O-N 3.44Å; I57-M60 HydrophobicContact CG1-CE 4.23Å; I57-M60 PolarHBondContact O-N 3.31Å; I57-R61 HydrophobicContact CG2-CG 4.2Å; I57-R61 VanDerWaalsContact O-CB 3.28Å; I57-R61 WeakPolarHBondContact O-CB 3.06Å; I57-R61 WeakPolarHBondContact O-CG 3.33Å; I57-R61 PolarHBondContact O-N 3.41Å; I57-L207 HydrophobicContact CD1-CD1 4.02Å; I57-L239 HydrophobicContact CG2-CD1 3.97Å; I57-L239 HydrophobicContact CG2-CD2 4.05Å; I57-L239 HydrophobicContact CG2-CG 3.77Å; I57-L240 HydrophobicContact CD1-CD2 3.87Å; I57-F243 HydrophobicContact CD1-CD1 4.21Å; I57-F243 HydrophobicContact CD1-CE1 4.15Å; I57-F243 HydrophobicContact CG1-CD1 4.31Å; I57-F243 HydrophobicContact CG1-CE1 4.19Å; I57-F243 HydrophobicContact CG1-CE2 4.41Å; I57-F243 HydrophobicContact CG1-CG 4.48Å; I57-F243 HydrophobicContact CG1-CZ 4.26Å; I57-F243 HydrophobicContact CG2-CB 3.87Å; I57-F243 HydrophobicContact CG2-CD1 4.29Å; I57-F243 HydrophobicContact CG2-CD2 4.08Å; I57-F243 HydrophobicContact CG2-CG 3.84Å
58	E	97.9	Very high	95.4	Very high	84 Å²	84	64 Å²	64	39%	0.393	32%	0.322	S	S	.	.	H	α-helix	trans	-57.8	-47.9	175.2	-67.9	170.7	158.5	0	0	111.3	L54 R55 M60 R61 S62 L239	L54-E58 WeakPolarHBondContact O-CG 3.28Å; L54-E58 PolarHBondContact O-N 2.88Å; R55-E58 WeakPolarHBondContact O-CB 2.73Å; R55-E58 PolarHBondContact O-N 3.32Å; E58-M60 PolarHBondContact O-N 2.91Å; E58-R61 CarbonylContact O-C 3.49Å; E58-R61 WeakPolarHBondContact O-CA 3.49Å; E58-R61 PolarHBondContact O-N 3.5Å; E58-S62 PolarHBondContact O-N 2.98Å; E58-L239 HydrophobicContact CG-CD1 4.17Å; E58-L239 HydrophobicContact CG-CD2 3.86Å
59	A	97.6	Very high	95.4	Very high	50 Å²	50	58 Å²	58	41%	0.413	29%	0.291	S	S	.	.	H	α-helix	trans	-61.7	-40.7	176.5	0	0	0	0	0	112.8	R55 R61 S62 L259	R55-A59 WeakPolarHBondContact O-CB 3.16Å; R55-A59 PolarHBondContact O-N 3.06Å; A59-R61 PolarHBondContact O-N 2.99Å; A59-S62 PolarHBondContact O-OG 2.84Å; A59-L259 HydrophobicContact CB-CD1 4.31Å
60	M	97.1	Very high	95.2	Very high	14 Å²	14	57.9 Å²	57.9	7%	0.069	29%	0.293	C	S	.	.	H	α-helix	trans	-68.2	-21.5	174.7	-73.1	-177	-70.8	0	0	113.2	N56 I57 E58 F243 I247 C258 L259	N56-M60 VanDerWaalsContact O-CE 3.3Å; N56-M60 WeakPolarHBondContact O-CE 3.3Å; N56-M60 WeakPolarHBondContact O-CG 3.35Å; N56-M60 PolarHBondContact O-N 3.36Å; I57-M60 HydrophobicContact CG1-CE 4.23Å; I57-M60 PolarHBondContact O-N 3.31Å; E58-M60 PolarHBondContact O-N 2.91Å; M60-F243 HydrophobicContact CE-CD2 4.4Å; M60-F243 HydrophobicContact CE-CE2 3.59Å; M60-F243 HydrophobicContact CE-CZ 4.14Å; M60-F243 HydrophobicContact SD-CE2 4.26Å; M60-I247 HydrophobicContact CB-CD1 3.81Å; M60-I247 HydrophobicContact CG-CD1 4.17Å; M60-I247 HydrophobicContact SD-CD1 3.67Å; M60-C258 HydrophobicContact SD-CB 4.5Å; M60-L259 HydrophobicContact CE-CB 4.21Å; M60-L259 HydrophobicContact CG-CB 4.37Å; M60-L259 HydrophobicContact CG-CD1 3.77Å; M60-L259 HydrophobicContact CG-CG 3.76Å; M60-L259 HydrophobicContact SD-CB 4.08Å; M60-L259 HydrophobicContact SD-CG 3.95Å; M60-L259 PolarHBondContact SD-N 3.31Å; M60-L259 VanDerWaalsContact SD-N 3.4Å
61	R	96.4	Very high	94.8	Very high	27 Å²	27	57.5 Å²	57.5	10%	0.102	29%	0.294	C	S	.	.	H	α-helix	trans	-97.2	-13.8	-176.8	-73.2	-71.5	-65.7	146.8	2.4	113.5	I57 E58 A59 D63 K64 D69 L239	I57-R61 HydrophobicContact CG2-CG 4.2Å; I57-R61 VanDerWaalsContact O-CB 3.28Å; I57-R61 WeakPolarHBondContact O-CB 3.06Å; I57-R61 WeakPolarHBondContact O-CG 3.33Å; I57-R61 PolarHBondContact O-N 3.41Å; E58-R61 CarbonylContact O-C 3.49Å; E58-R61 WeakPolarHBondContact O-CA 3.49Å; E58-R61 PolarHBondContact O-N 3.5Å; A59-R61 PolarHBondContact O-N 2.99Å; R61-D63 VanDerWaalsContact C-N 3.27Å; R61-D63 PolarHBondContact O-N 3.11Å; R61-K64 PolarHBondContact NH1-O 2.77Å; R61-D69 IonicContact CZ-OD2 3.36Å; R61-D69 IonicContact NH1-OD2 2.7Å; R61-D69 PolarHBondContact NH1-OD2 3.26Å; R61-D69 VanDerWaalsContact NH1-OD2 3.17Å; R61-D69 IonicContact NH2-OD1 3.86Å; R61-D69 PolarHBondContact NH2-OD1 3.14Å; R61-D69 IonicContact NH2-OD2 3.93Å; R61-D69 PolarHBondContact NH2-OD2 3.19Å; R61-L239 HydrophobicContact CB-CD1 3.99Å; R61-L239 HydrophobicContact CG-CD1 3.94Å
62	S	94.6	Very high	94.3	Very high	85 Å²	85	54.8 Å²	54.8	59%	0.594	28%	0.281	S	S	*	.	H	α-helix	trans	-61.3	-37.6	175.9	63.2	0	0	0	0	112.1	E58 A59	E58-S62 PolarHBondContact O-N 2.98Å; A59-S62 PolarHBondContact O-OG 2.84Å
63	D	85.6	Confident	93.7	Very high	141 Å²	141	50.1 Å²	50.1	75%	0.754	27%	0.265	S	S	*	.	S	Bend	trans	-107.6	-3.6	-170.2	-52.3	-19.4	0	0	0	113.3	R61	R61-D63 VanDerWaalsContact C-N 3.27Å; R61-D63 PolarHBondContact O-N 3.11Å
64	K	87.1	Confident	92.9	Very high	100 Å²	100	52.5 Å²	52.5	44%	0.435	28%	0.281	S	S	.	.			trans	-124	105	-172.9	-69.7	179.9	-177.5	166.9	0	110.7	R61	R61-K64 PolarHBondContact NH1-O 2.77Å
65	E	91.4	Very high	92.3	Very high	146 Å²	146	58.4 Å²	58.4	68%	0.682	31%	0.307	S	S	*	.			trans	-68.6	143	172	-163	174.1	86.7	0	0	111.4	D69 T70	E65-D69 HydrophobicContact CG-CB 3.88Å; E65-T70 HydrophobicContact CG-CG2 4.09Å; E65-T70 WeakPolarHBondContact OE1-CG2 3.41Å
66	A	94	Very high	91.7	Very high	4 Å²	4	51.6 Å²	51.6	3%	0.033	28%	0.283	C	S	.	.			trans	-125.4	161.6	173	0	0	0	0	0	110.6	V68 D69 Q245 T246	A66-V68 HydrophobicContact CB-CG1 4.27Å; A66-V68 PolarHBondContact O-N 3.12Å; A66-V68 VanDerWaalsContact O-N 3.08Å; A66-D69 PolarHBondContact N-OD2 3.36Å; A66-D69 VanDerWaalsContact O-CB 3.31Å; A66-D69 WeakPolarHBondContact O-CB 3.43Å; A66-D69 PolarHBondContact O-N 3.05Å; A66-Q245 HydrophobicContact CB-CB 4.33Å; A66-T246 HydrophobicContact CB-CG2 3.76Å
67	P	93.5	Very high	91.1	Very high	56 Å²	56	50.7 Å²	50.7	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-50.4	-34.9	177.1	-30.6	36	0	0	0	115	D69 T70 S71 D102	P67-D69 PolarHBondContact O-N 3.28Å; P67-T70 PolarHBondContact O-N 3.1Å; P67-T70 PolarHBondContact O-OG1 3.44Å; P67-S71 WeakPolarHBondContact O-CA 3.48Å; P67-S71 WeakPolarHBondContact O-CB 3.46Å; P67-S71 PolarHBondContact O-N 2.68Å; P67-D102 HydrophobicContact CB-CB 4.28Å
68	V	94.1	Very high	90.3	Very high	14 Å²	14	54.1 Å²	54.1	9%	0.085	30%	0.295	C	S	.	.	H	α-helix	trans	-63.8	-22.9	176.3	71.6	0	0	0	0	113.4	A66 G72 D102 K238 V241 Q245	A66-V68 HydrophobicContact CB-CG1 4.27Å; A66-V68 PolarHBondContact O-N 3.12Å; A66-V68 VanDerWaalsContact O-N 3.08Å; V68-G72 VanDerWaalsContact O-CA 3.26Å; V68-G72 WeakPolarHBondContact O-CA 3.49Å; V68-G72 PolarHBondContact O-N 2.79Å; V68-D102 WeakPolarHBondContact CA-OD2 3.39Å; V68-D102 PolarHBondContact N-OD2 3.01Å; V68-K238 HydrophobicContact CG1-CG 4.36Å; V68-K238 HydrophobicContact CG2-CG 4.2Å; V68-V241 HydrophobicContact CB-CG1 3.75Å; V68-V241 HydrophobicContact CG1-CB 4.45Å; V68-V241 HydrophobicContact CG1-CG1 4.07Å; V68-V241 HydrophobicContact CG2-CB 4.29Å; V68-V241 HydrophobicContact CG2-CG1 3.78Å; V68-Q245 VanDerWaalsContact N-OE1 3.1Å
69	D	93.4	Very high	89.1	Confident	27 Å²	27	54.6 Å²	54.6	14%	0.144	31%	0.305	C	S	.	.	H	α-helix	trans	-79.4	-35.3	-179.9	-57.2	-49.2	0	0	0	112	R61 E65 A66 P67 K75 K238	R61-D69 IonicContact CZ-OD2 3.36Å; R61-D69 IonicContact NH1-OD2 2.7Å; R61-D69 PolarHBondContact NH1-OD2 3.26Å; R61-D69 VanDerWaalsContact NH1-OD2 3.17Å; R61-D69 IonicContact NH2-OD1 3.86Å; R61-D69 PolarHBondContact NH2-OD1 3.14Å; R61-D69 IonicContact NH2-OD2 3.93Å; R61-D69 PolarHBondContact NH2-OD2 3.19Å; E65-D69 HydrophobicContact CG-CB 3.88Å; A66-D69 PolarHBondContact N-OD2 3.36Å; A66-D69 VanDerWaalsContact O-CB 3.31Å; A66-D69 WeakPolarHBondContact O-CB 3.43Å; A66-D69 PolarHBondContact O-N 3.05Å; P67-D69 PolarHBondContact O-N 3.28Å; D69-K75 WeakPolarHBondContact O-CD 3.47Å; D69-K75 WeakPolarHBondContact O-CE 3.38Å; D69-K75 PolarHBondContact O-NZ 3.1Å; D69-K238 WeakPolarHBondContact OD1-CE 3.18Å; D69-K238 IonicContact OD1-NZ 2.79Å
70	T	91.2	Very high	87.9	Confident	70 Å²	70	60 Å²	60	43%	0.429	33%	0.327	S	S	.	.	H	α-helix	trans	-95	-39.2	-179.4	53.9	0	0	0	0	112.7	E65 P67	E65-T70 HydrophobicContact CG-CG2 4.09Å; E65-T70 WeakPolarHBondContact OE1-CG2 3.41Å; P67-T70 PolarHBondContact O-N 3.1Å; P67-T70 PolarHBondContact O-OG1 3.44Å
71	S	89.4	Confident	87.2	Confident	19 Å²	19	61.5 Å²	61.5	13%	0.133	34%	0.337	C	S	.	.	H	α-helix	trans	-118	11.5	-170.4	-55.6	0	0	0	0	113.2	P67	P67-S71 WeakPolarHBondContact O-CA 3.48Å; P67-S71 WeakPolarHBondContact O-CB 3.46Å; P67-S71 PolarHBondContact O-N 2.68Å
72	G	86.7	Confident	87	Confident	2 Å²	2	64 Å²	64	2%	0.021	35%	0.353	C	S	.	.			trans	-64.1	147.5	178.6	0	0	0	0	0	112.8	V68 C74 K75	V68-G72 VanDerWaalsContact O-CA 3.26Å; V68-G72 WeakPolarHBondContact O-CA 3.49Å; V68-G72 PolarHBondContact O-N 2.79Å; G72-C74 PolarHBondContact O-N 3.41Å; G72-K75 PolarHBondContact O-N 3.38Å
73	C	86	Confident	87	Confident	15 Å²	15	63.7 Å²	63.7	10%	0.101	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-57	-29.5	-172.9	-52.3	0	0	0	0	114.1	K75 L76 A93 L94 S97	C73-K75 PolarHBondContact O-N 3.28Å; C73-K75 VanDerWaalsContact O-N 3.16Å; C73-L76 PolarHBondContact O-N 2.92Å; C73-A93 HydrophobicContact CB-CB 4.12Å; C73-L94 HydrophobicContact CB-CD2 3.9Å; C73-L94 HydrophobicContact CB-CG 4.19Å; C73-S97 WeakPolarHBondContact SG-CB 3.42Å
74	C	82.7	Confident	87.4	Confident	56 Å²	56	60.4 Å²	60.4	38%	0.378	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-65	-12.6	176.9	59.1	0	0	0	0	114.5	G72 I186	G72-C74 PolarHBondContact O-N 3.41Å; C74-I186 HydrophobicContact CB-CD1 3.72Å; C74-I186 HydrophobicContact CB-CG1 4.39Å
75	K	84.2	Confident	87.9	Confident	126 Å²	126	56.5 Å²	56.5	55%	0.548	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-105.4	0	178.2	-66.5	-171.1	169.3	-170.9	0	113.6	D69 G72 C73	D69-K75 WeakPolarHBondContact O-CD 3.47Å; D69-K75 WeakPolarHBondContact O-CE 3.38Å; D69-K75 PolarHBondContact O-NZ 3.1Å; G72-K75 PolarHBondContact O-N 3.38Å; C73-K75 PolarHBondContact O-N 3.28Å; C73-K75 VanDerWaalsContact O-N 3.16Å
76	L	87	Confident	88.1	Confident	15 Å²	15	52.8 Å²	52.8	8%	0.079	30%	0.295	C	S	.	.	S	Bend	trans	-91.8	-19.8	-170.6	-60.4	-176.2	0	0	0	113.6	C73 A93 T105 A106 M109 K113	C73-L76 PolarHBondContact O-N 2.92Å; L76-A93 HydrophobicContact CB-CB 4.08Å; L76-A93 HydrophobicContact CD1-CB 4.06Å; L76-T105 HydrophobicContact CD1-CG2 3.98Å; L76-A106 HydrophobicContact CD1-CB 4.35Å; L76-A106 HydrophobicContact CD2-CB 3.7Å; L76-M109 HydrophobicContact CB-CB 4.3Å; L76-M109 HydrophobicContact CB-CG 4.22Å; L76-M109 HydrophobicContact CD1-CB 4.26Å; L76-M109 HydrophobicContact CD1-CG 3.88Å; L76-K113 PolarHBondContact O-NZ 3.42Å
77	S	85.1	Confident	88.2	Confident	14 Å²	14	54.5 Å²	54.5	10%	0.098	30%	0.3	C	S	.	.	S	Bend	trans	-75.1	150.1	172.9	56.4	0	0	0	0	111.9	P79 E86	S77-P79 WeakPolarHBondContact O-CD 3.31Å; S77-E86 WeakPolarHBondContact CB-O 3.27Å
78	E	81.7	Confident	88.4	Confident	71 Å²	71	51.9 Å²	51.9	33%	0.332	28%	0.283	S	S	.	.			trans	-95.8	111.9	177.5	-76.1	170.2	161.8	0	0	111.3	N80 T81 K113	E78-N80 PolarHBondContact O-N 3.15Å; E78-N80 VanDerWaalsContact O-N 3.16Å; E78-T81 HydrophobicContact CB-CG2 3.79Å; E78-T81 PolarHBondContact O-N 3.19Å; E78-T81 PolarHBondContact O-OG1 3.36Å; E78-K113 HydrophobicContact CG-CD 3.86Å; E78-K113 WeakPolarHBondContact OE1-CE 3.33Å; E78-K113 IonicContact OE1-NZ 2.98Å; E78-K113 PolarHBondContact OE1-NZ 2.97Å
79	P	72.3	Confident	88.5	Confident	95 Å²	95	51.4 Å²	51.4	62%	0.617	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-12.6	-176.6	28.3	-35.6	0	0	0	114	S77 T81	S77-P79 WeakPolarHBondContact O-CD 3.31Å; P79-T81 VanDerWaalsContact C-N 3.32Å
80	N	73.1	Confident	88.7	Confident	163 Å²	163	50.3 Å²	50.3	87%	0.872	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	7.8	179.3	-63.1	-24.2	0	0	0	113.1	E78	E78-N80 PolarHBondContact O-N 3.15Å; E78-N80 VanDerWaalsContact O-N 3.16Å
81	T	81.7	Confident	89	Confident	45 Å²	45	47 Å²	47	28%	0.276	25%	0.254	S	S	.	.	S	Bend	trans	-94.6	172.3	174.9	60.4	0	0	0	0	110.6	E78 P79 T85	E78-T81 HydrophobicContact CB-CG2 3.79Å; E78-T81 PolarHBondContact O-N 3.19Å; E78-T81 PolarHBondContact O-OG1 3.36Å; P79-T81 VanDerWaalsContact C-N 3.32Å; T81-T85 HydrophobicContact CG2-CG2 4.38Å
82	D	92	Very high	89.4	Confident	80 Å²	80	46.1 Å²	46.1	43%	0.428	25%	0.248	S	C	.	.			trans	-62.2	151.3	172.3	73	87.9	0	0	0	110.6	K84 T85 E86	D82-K84 VanDerWaalsContact C-N 3.26Å; D82-K84 PolarHBondContact O-N 3.39Å; D82-K84 VanDerWaalsContact O-N 3.16Å; D82-K84 WeakPolarHBondContact OD1-CA 3.48Å; D82-K84 WeakPolarHBondContact OD1-CB 3.42Å; D82-K84 PolarHBondContact OD1-N 2.98Å; D82-T85 PolarHBondContact O-N 3.48Å; D82-T85 VanDerWaalsContact O-N 3.16Å; D82-T85 PolarHBondContact OD1-N 3.41Å; D82-T85 PolarHBondContact OD1-OG1 3.24Å; D82-T85 WeakPolarHBondContact OD2-CB 3.27Å; D82-T85 PolarHBondContact OD2-OG1 2.78Å; D82-E86 PolarHBondContact O-N 2.97Å
83	P	93.8	Very high	90	Very high	79 Å²	79	46 Å²	46	51%	0.513	25%	0.247	S	C	.	.	H	α-helix	trans	-60.4	-29.4	-174.1	-26.6	35.1	0	0	0	114.9	R87	P83-R87 VanDerWaalsContact CB-NH1 3.33Å; P83-R87 WeakPolarHBondContact O-CG 3.43Å; P83-R87 PolarHBondContact O-N 3.17Å; P83-R87 PolarHBondContact O-NE 2.88Å; P83-R87 PolarHBondContact O-NH1 2.81Å; P83-R87 VanDerWaalsContact O-NH1 3.11Å
84	K	95.7	Very high	90.5	Very high	71 Å²	71	45.5 Å²	45.5	31%	0.309	24%	0.243	S	C	.	.	H	α-helix	trans	-71.7	-44.4	178.4	-68.1	-171.3	174.6	-175.9	0	109.6	D82 R87 Y88 D159 D161	D82-K84 VanDerWaalsContact C-N 3.26Å; D82-K84 PolarHBondContact O-N 3.39Å; D82-K84 VanDerWaalsContact O-N 3.16Å; D82-K84 WeakPolarHBondContact OD1-CA 3.48Å; D82-K84 WeakPolarHBondContact OD1-CB 3.42Å; D82-K84 PolarHBondContact OD1-N 2.98Å; K84-R87 PolarHBondContact O-N 2.91Å; K84-Y88 WeakPolarHBondContact O-CB 3Å; K84-Y88 PolarHBondContact O-N 2.84Å; K84-D159 PolarHBondContact NZ-O 3.08Å; K84-D159 IonicContact NZ-OD2 2.71Å; K84-D159 PolarHBondContact NZ-OD2 3.24Å; K84-D161 HydrophobicContact CD-CB 4.05Å; K84-D161 HydrophobicContact CG-CB 4.09Å
85	T	96	Very high	91.2	Very high	19 Å²	19	43.2 Å²	43.2	12%	0.117	23%	0.227	C	C	.	.	H	α-helix	trans	-61	-44.8	174.9	-66.3	0	0	0	0	111.9	T81 D82 R87 Y88 Q89 C117	T81-T85 HydrophobicContact CG2-CG2 4.38Å; D82-T85 PolarHBondContact O-N 3.48Å; D82-T85 VanDerWaalsContact O-N 3.16Å; D82-T85 PolarHBondContact OD1-N 3.41Å; D82-T85 PolarHBondContact OD1-OG1 3.24Å; D82-T85 WeakPolarHBondContact OD2-CB 3.27Å; D82-T85 PolarHBondContact OD2-OG1 2.78Å; T85-R87 VanDerWaalsContact C-N 3.33Å; T85-R87 PolarHBondContact O-N 3.46Å; T85-Y88 PolarHBondContact O-N 2.91Å; T85-Q89 HydrophobicContact CG2-CG 4.26Å; T85-Q89 WeakPolarHBondContact O-CB 3.4Å; T85-Q89 VanDerWaalsContact O-CG 3.27Å; T85-Q89 WeakPolarHBondContact O-CG 3.5Å; T85-Q89 PolarHBondContact O-N 3.21Å; T85-C117 WeakPolarHBondContact CG2-O 3.46Å
86	E	95.6	Very high	91.9	Very high	67 Å²	67	37.2 Å²	37.2	31%	0.313	20%	0.201	S	C	.	.	H	α-helix	trans	-57.6	-46.4	177.5	-170.7	-170.6	178.4	0	0	111.5	S77 D82 Q89 L90	S77-E86 WeakPolarHBondContact CB-O 3.27Å; D82-E86 PolarHBondContact O-N 2.97Å; E86-Q89 PolarHBondContact O-N 2.8Å; E86-L90 PolarHBondContact O-N 2.67Å
87	R	96.9	Very high	92.3	Very high	40 Å²	40	37.2 Å²	37.2	15%	0.151	20%	0.202	C	C	.	.	H	α-helix	trans	-64.8	-40.8	177.6	-76.3	-168.6	-67.7	-83.9	6.1	112.6	P83 K84 T85 L90 L91 D161 I162 A187 W188	P83-R87 VanDerWaalsContact CB-NH1 3.33Å; P83-R87 WeakPolarHBondContact O-CG 3.43Å; P83-R87 PolarHBondContact O-N 3.17Å; P83-R87 PolarHBondContact O-NE 2.88Å; P83-R87 PolarHBondContact O-NH1 2.81Å; P83-R87 VanDerWaalsContact O-NH1 3.11Å; K84-R87 PolarHBondContact O-N 2.91Å; T85-R87 VanDerWaalsContact C-N 3.33Å; T85-R87 PolarHBondContact O-N 3.46Å; R87-L90 WeakPolarHBondContact O-CB 3.17Å; R87-L90 PolarHBondContact O-N 2.76Å; R87-L91 PolarHBondContact O-N 3.25Å; R87-D161 IonicContact CZ-OD1 3.74Å; R87-D161 IonicContact CZ-OD2 2.66Å; R87-D161 IonicContact NE-OD1 3.78Å; R87-D161 PolarHBondContact NE-OD1 3.44Å; R87-D161 IonicContact NE-OD2 2.73Å; R87-D161 PolarHBondContact NE-OD2 3.07Å; R87-D161 IonicContact NH2-OD1 3.38Å; R87-D161 PolarHBondContact NH2-OD1 3.4Å; R87-D161 IonicContact NH2-OD2 2.72Å; R87-D161 PolarHBondContact NH2-OD2 3.17Å; R87-I162 HydrophobicContact CB-CD1 3.73Å; R87-I162 HydrophobicContact CB-CG1 3.91Å; R87-I162 HydrophobicContact CG-CD1 4.24Å; R87-A187 HydrophobicContact CB-CB 4.47Å; R87-A187 HydrophobicContact CG-CB 3.74Å; R87-W188 VanDerWaalsContact CD-CZ2 3.46Å
88	Y	97.6	Very high	92.7	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.008	21%	0.209	C	C	.	.	H	α-helix	trans	-62.3	-46.7	175.3	178.2	-107.7	0	0	0	111.6	K84 T85 L90 L91 L92 L119 V122 S151 L154	K84-Y88 WeakPolarHBondContact O-CB 3Å; K84-Y88 PolarHBondContact O-N 2.84Å; T85-Y88 PolarHBondContact O-N 2.91Å; Y88-L90 VanDerWaalsContact C-N 3.3Å; Y88-L90 PolarHBondContact O-N 2.94Å; Y88-L91 WeakPolarHBondContact O-CB 3.36Å; Y88-L91 PolarHBondContact O-N 2.89Å; Y88-L91 VanDerWaalsContact O-N 3.1Å; Y88-L92 HydrophobicContact CD1-CD1 4.13Å; Y88-L92 HydrophobicContact CD1-CG 4.37Å; Y88-L92 HydrophobicContact CE1-CD1 3.44Å; Y88-L92 VanDerWaalsContact CE1-CD1 3.44Å; Y88-L92 HydrophobicContact CE1-CD2 4.47Å; Y88-L92 HydrophobicContact CE1-CG 3.96Å; Y88-L92 HydrophobicContact CE2-CD2 4.09Å; Y88-L92 HydrophobicContact CE2-CG 4.26Å; Y88-L92 WeakPolarHBondContact O-CG 3.48Å; Y88-L92 PolarHBondContact O-N 3.4Å; Y88-L119 HydrophobicContact CD1-CB 4.46Å; Y88-L119 HydrophobicContact CD2-CB 4.43Å; Y88-L119 HydrophobicContact CE1-CB 4.38Å; Y88-L119 HydrophobicContact CE2-CB 4.35Å; Y88-L119 HydrophobicContact CG-CB 4.48Å; Y88-V122 HydrophobicContact CE1-CG2 4.09Å; Y88-V122 VanDerWaalsContact OH-CB 3.24Å; Y88-V122 WeakPolarHBondContact OH-CB 3.31Å; Y88-V122 VanDerWaalsContact OH-CG1 3.27Å; Y88-V122 WeakPolarHBondContact OH-CG1 3.48Å; Y88-V122 WeakPolarHBondContact OH-CG2 3.14Å; Y88-S151 PolarHBondContact OH-OG 3.41Å; Y88-L154 HydrophobicContact CD2-CD1 3.84Å; Y88-L154 HydrophobicContact CE2-CD1 4.12Å
89	Q	97.3	Very high	93.1	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.019	23%	0.229	C	C	.	.	H	α-helix	trans	-59.1	-40.8	176	-70.9	-179.9	5	0	0	112.3	T85 E86 L92 A93 M109 C117	T85-Q89 HydrophobicContact CG2-CG 4.26Å; T85-Q89 WeakPolarHBondContact O-CB 3.4Å; T85-Q89 VanDerWaalsContact O-CG 3.27Å; T85-Q89 WeakPolarHBondContact O-CG 3.5Å; T85-Q89 PolarHBondContact O-N 3.21Å; E86-Q89 PolarHBondContact O-N 2.8Å; Q89-L92 PolarHBondContact O-N 3.48Å; Q89-A93 WeakPolarHBondContact O-CB 3.43Å; Q89-A93 PolarHBondContact O-N 3.46Å; Q89-M109 HydrophobicContact CB-CE 4.14Å; Q89-M109 VanDerWaalsContact O-CE 3.23Å; Q89-M109 WeakPolarHBondContact O-CE 3.49Å; Q89-C117 HydrophobicContact CG-CB 4.08Å; Q89-C117 WeakPolarHBondContact CG-O 3.42Å; Q89-C117 PolarHBondContact NE2-O 3.03Å; Q89-C117 VanDerWaalsContact NE2-O 3.11Å
90	L	97	Very high	94.2	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-60.9	-45	174	172.5	71.3	0	0	0	111.8	E86 R87 Y88 A93 L94 I186 A187	E86-L90 PolarHBondContact O-N 2.67Å; R87-L90 WeakPolarHBondContact O-CB 3.17Å; R87-L90 PolarHBondContact O-N 2.76Å; Y88-L90 VanDerWaalsContact C-N 3.3Å; Y88-L90 PolarHBondContact O-N 2.94Å; L90-A93 WeakPolarHBondContact O-CB 3.21Å; L90-A93 PolarHBondContact O-N 3.41Å; L90-L94 HydrophobicContact CD1-CD1 4.37Å; L90-L94 HydrophobicContact CG-CD1 4.31Å; L90-L94 PolarHBondContact O-N 3.25Å; L90-I186 HydrophobicContact CD1-CB 4.37Å; L90-I186 HydrophobicContact CD1-CD1 3.99Å; L90-I186 HydrophobicContact CD1-CG2 3.99Å; L90-I186 HydrophobicContact CD2-CB 3.71Å; L90-I186 HydrophobicContact CD2-CG2 3.64Å; L90-I186 HydrophobicContact CG-CG2 4.46Å; L90-A187 HydrophobicContact CD2-CB 3.88Å
91	L	97.9	Very high	95.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.1	-46.4	177.9	-180	61.2	0	0	0	110.9	R87 Y88 A93 L94 M95 T150 L154 I162 L169 L172 V175	R87-L91 PolarHBondContact O-N 3.25Å; Y88-L91 WeakPolarHBondContact O-CB 3.36Å; Y88-L91 PolarHBondContact O-N 2.89Å; Y88-L91 VanDerWaalsContact O-N 3.1Å; L91-A93 VanDerWaalsContact C-N 3.33Å; L91-A93 PolarHBondContact O-N 3.09Å; L91-L94 PolarHBondContact O-N 3Å; L91-M95 HydrophobicContact CD1-CG 4.43Å; L91-M95 HydrophobicContact CD1-SD 4.49Å; L91-M95 HydrophobicContact CG-SD 4.09Å; L91-M95 WeakPolarHBondContact O-CG 3.32Å; L91-M95 PolarHBondContact O-N 3.28Å; L91-T150 HydrophobicContact CD2-CG2 4.09Å; L91-L154 HydrophobicContact CD2-CD1 4.17Å; L91-I162 HydrophobicContact CB-CG2 4.12Å; L91-I162 HydrophobicContact CD2-CB 4.37Å; L91-I162 HydrophobicContact CD2-CG2 3.66Å; L91-L169 HydrophobicContact CD1-CD2 4.38Å; L91-L172 HydrophobicContact CD2-CD1 3.96Å; L91-V175 HydrophobicContact CD1-CG2 4.11Å
92	L	97.8	Very high	95.8	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-59.8	-43.4	176.2	-66.1	-167.1	0	0	0	112	Y88 Q89 L94 M95 L96 M109 V122 I147	Y88-L92 HydrophobicContact CD1-CD1 4.13Å; Y88-L92 HydrophobicContact CD1-CG 4.37Å; Y88-L92 HydrophobicContact CE1-CD1 3.44Å; Y88-L92 VanDerWaalsContact CE1-CD1 3.44Å; Y88-L92 HydrophobicContact CE1-CD2 4.47Å; Y88-L92 HydrophobicContact CE1-CG 3.96Å; Y88-L92 HydrophobicContact CE2-CD2 4.09Å; Y88-L92 HydrophobicContact CE2-CG 4.26Å; Y88-L92 WeakPolarHBondContact O-CG 3.48Å; Y88-L92 PolarHBondContact O-N 3.4Å; Q89-L92 PolarHBondContact O-N 3.48Å; L92-L94 VanDerWaalsContact C-N 3.29Å; L92-L94 PolarHBondContact O-N 3.11Å; L92-M95 HydrophobicContact CD2-SD 4.3Å; L92-M95 PolarHBondContact O-N 3.48Å; L92-L96 WeakPolarHBondContact O-CB 3.35Å; L92-L96 VanDerWaalsContact O-CG 3.28Å; L92-L96 WeakPolarHBondContact O-CG 3.32Å; L92-L96 PolarHBondContact O-N 2.89Å; L92-M109 HydrophobicContact CB-CE 4.4Å; L92-M109 HydrophobicContact CB-SD 4.14Å; L92-V122 HydrophobicContact CD1-CG2 4.35Å; L92-I147 HydrophobicContact CD2-CB 4.33Å; L92-I147 HydrophobicContact CD2-CD1 4.36Å; L92-I147 HydrophobicContact CD2-CG1 3.92Å; L92-I147 HydrophobicContact CD2-CG2 3.67Å
93	A	97.8	Very high	95.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-56.8	-44.4	176.1	0	0	0	0	0	111.5	C73 L76 Q89 L90 L91 S97 T105 M109	C73-A93 HydrophobicContact CB-CB 4.12Å; L76-A93 HydrophobicContact CB-CB 4.08Å; L76-A93 HydrophobicContact CD1-CB 4.06Å; Q89-A93 WeakPolarHBondContact O-CB 3.43Å; Q89-A93 PolarHBondContact O-N 3.46Å; L90-A93 WeakPolarHBondContact O-CB 3.21Å; L90-A93 PolarHBondContact O-N 3.41Å; L91-A93 VanDerWaalsContact C-N 3.33Å; L91-A93 PolarHBondContact O-N 3.09Å; A93-S97 WeakPolarHBondContact O-CB 3.45Å; A93-S97 PolarHBondContact O-N 3.21Å; A93-T105 WeakPolarHBondContact O-CG2 3.21Å; A93-M109 HydrophobicContact CB-CE 4.21Å; A93-M109 HydrophobicContact CB-CG 3.94Å; A93-M109 HydrophobicContact CB-SD 3.98Å
94	L	97.6	Very high	96.1	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-67.9	-40.9	177.9	-73.9	167.4	0	0	0	112.8	C73 L90 L91 L92 S97 M179 L182 T183	C73-L94 HydrophobicContact CB-CD2 3.9Å; C73-L94 HydrophobicContact CB-CG 4.19Å; L90-L94 HydrophobicContact CD1-CD1 4.37Å; L90-L94 HydrophobicContact CG-CD1 4.31Å; L90-L94 PolarHBondContact O-N 3.25Å; L91-L94 PolarHBondContact O-N 3Å; L92-L94 VanDerWaalsContact C-N 3.29Å; L92-L94 PolarHBondContact O-N 3.11Å; L94-S97 PolarHBondContact O-N 3.17Å; L94-S97 PolarHBondContact O-OG 3.36Å; L94-M179 HydrophobicContact CB-CB 4.47Å; L94-M179 HydrophobicContact CB-CG 4.42Å; L94-M179 WeakPolarHBondContact O-CE 3.4Å; L94-L182 HydrophobicContact CD1-CB 4.24Å; L94-L182 HydrophobicContact CD2-CB 4.19Å; L94-L182 HydrophobicContact CD2-CD1 4.04Å; L94-T183 WeakPolarHBondContact CD1-OG1 3.33Å
95	M	98	Very high	96.2	Very high	8 Å²	8	32.3 Å²	32.3	4%	0.039	16%	0.164	C	C	.	.	H	α-helix	trans	-61.5	-45	175.7	-69.3	174.4	74.7	0	0	111.2	L91 L92 S97 S98 A146 I147 T150 P173 V175	L91-M95 HydrophobicContact CD1-CG 4.43Å; L91-M95 HydrophobicContact CD1-SD 4.49Å; L91-M95 HydrophobicContact CG-SD 4.09Å; L91-M95 WeakPolarHBondContact O-CG 3.32Å; L91-M95 PolarHBondContact O-N 3.28Å; L92-M95 HydrophobicContact CD2-SD 4.3Å; L92-M95 PolarHBondContact O-N 3.48Å; M95-S97 VanDerWaalsContact C-N 3.32Å; M95-S97 PolarHBondContact O-N 3.42Å; M95-S98 PolarHBondContact O-OG 2.89Å; M95-A146 HydrophobicContact CE-CB 4.2Å; M95-I147 HydrophobicContact CE-CG1 3.85Å; M95-I147 HydrophobicContact SD-CG1 4.29Å; M95-T150 HydrophobicContact CE-CG2 4.46Å; M95-T150 WeakPolarHBondContact CE-OG1 3.48Å; M95-T150 HydrophobicContact SD-CG2 4.26Å; M95-P173 WeakPolarHBondContact CE-O 3.11Å; M95-V175 HydrophobicContact CG-CG2 3.98Å; M95-V175 HydrophobicContact SD-CG2 4.23Å
96	L	97.8	Very high	96.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.9	-31.3	177	-68	176.6	0	0	0	112.6	L92 S98 T100 T105 A108 M109 L112 I134 V137 K143 I147	L92-L96 WeakPolarHBondContact O-CB 3.35Å; L92-L96 VanDerWaalsContact O-CG 3.28Å; L92-L96 WeakPolarHBondContact O-CG 3.32Å; L92-L96 PolarHBondContact O-N 2.89Å; L96-S98 VanDerWaalsContact C-N 3.27Å; L96-S98 PolarHBondContact O-N 3.07Å; L96-T100 WeakPolarHBondContact O-CB 3.26Å; L96-T100 PolarHBondContact O-OG1 3.44Å; L96-T105 HydrophobicContact CB-CG2 4.03Å; L96-A108 HydrophobicContact CD1-CB 4.27Å; L96-M109 HydrophobicContact CD1-CG 4.37Å; L96-M109 HydrophobicContact CD1-SD 3.81Å; L96-L112 HydrophobicContact CD1-CD1 3.9Å; L96-I134 HydrophobicContact CD1-CG2 4.28Å; L96-I134 HydrophobicContact CD2-CB 4.26Å; L96-I134 HydrophobicContact CD2-CD1 3.76Å; L96-I134 HydrophobicContact CD2-CG2 4.24Å; L96-V137 HydrophobicContact CD2-CG1 4.18Å; L96-V137 HydrophobicContact CD2-CG2 4.39Å; L96-V137 WeakPolarHBondContact O-CG1 3.42Å; L96-K143 HydrophobicContact CD2-CB 4.49Å; L96-K143 HydrophobicContact CD2-CD 4.34Å; L96-K143 PolarHBondContact O-NZ 3.21Å; L96-I147 HydrophobicContact CD2-CD1 3.72Å; L96-I147 HydrophobicContact CG-CD1 4.16Å
97	S	96	Very high	96.3	Very high	16 Å²	16	31 Å²	31	11%	0.112	17%	0.167	C	C	.	.	H	α-helix	trans	-67.7	-21.9	-175.8	102.7	0	0	0	0	114.1	C73 A93 L94 M95 Q99 T100 T105	C73-S97 WeakPolarHBondContact SG-CB 3.42Å; A93-S97 WeakPolarHBondContact O-CB 3.45Å; A93-S97 PolarHBondContact O-N 3.21Å; L94-S97 PolarHBondContact O-N 3.17Å; L94-S97 PolarHBondContact O-OG 3.36Å; M95-S97 VanDerWaalsContact C-N 3.32Å; M95-S97 PolarHBondContact O-N 3.42Å; S97-Q99 PolarHBondContact O-N 3.21Å; S97-T100 PolarHBondContact O-N 3.3Å; S97-T105 WeakPolarHBondContact CA-OG1 3.43Å
98	S	92.2	Very high	96.3	Very high	36 Å²	36	29.1 Å²	29.1	25%	0.252	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	125.9	-179.8	53.6	0	0	0	0	111.1	M95 L96 T100 K143 M179	M95-S98 PolarHBondContact O-OG 2.89Å; L96-S98 VanDerWaalsContact C-N 3.27Å; L96-S98 PolarHBondContact O-N 3.07Å; S98-T100 PolarHBondContact O-N 2.86Å; S98-T100 PolarHBondContact O-OG1 3.24Å; S98-K143 PolarHBondContact O-NZ 3.03Å; S98-K143 WeakPolarHBondContact OG-CE 3.47Å; S98-M179 VanDerWaalsContact CB-CE 3.47Å
99	Q	92.1	Very high	96.3	Very high	157 Å²	157	29 Å²	29	73%	0.734	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	32.9	178.3	-55.6	-178	73.1	0	0	113.6	S97 S138	S97-Q99 PolarHBondContact O-N 3.21Å; Q99-S138 WeakPolarHBondContact O-CB 3.43Å; Q99-S138 PolarHBondContact O-OG 2.92Å
100	T	95.1	Very high	96.3	Very high	16 Å²	16	33.9 Å²	33.9	10%	0.098	18%	0.182	C	C	.	.	S	Bend	trans	-135.3	140.8	-177.5	-56.2	0	0	0	0	108.7	L96 S97 S98 V104 T105 V137 K143	L96-T100 WeakPolarHBondContact O-CB 3.26Å; L96-T100 PolarHBondContact O-OG1 3.44Å; S97-T100 PolarHBondContact O-N 3.3Å; S98-T100 PolarHBondContact O-N 2.86Å; S98-T100 PolarHBondContact O-OG1 3.24Å; T100-V104 HydrophobicContact CG2-CB 3.87Å; T100-V104 HydrophobicContact CG2-CG1 3.81Å; T100-T105 WeakPolarHBondContact CG2-OG1 3.45Å; T100-V137 HydrophobicContact CG2-CB 4.33Å; T100-V137 HydrophobicContact CG2-CG1 3.97Å; T100-V137 HydrophobicContact CG2-CG2 4.27Å; T100-V137 WeakPolarHBondContact OG1-CG1 3.25Å; T100-K143 PolarHBondContact OG1-NZ 3.38Å
101	K	93.8	Very high	96.3	Very high	161 Å²	161	37.3 Å²	37.3	70%	0.7	19%	0.194	S	C	*	.			trans	-66.4	141.1	176.3	-65.6	-179.4	179.7	177.6	0	110.1	T103 V104 T105	K101-T103 VanDerWaalsContact C-N 3.25Å; K101-T103 PolarHBondContact O-N 2.9Å; K101-T103 VanDerWaalsContact O-N 3.17Å; K101-V104 HydrophobicContact CB-CG2 4.15Å; K101-V104 WeakPolarHBondContact O-CB 3.08Å; K101-V104 PolarHBondContact O-N 3.43Å; K101-T105 PolarHBondContact O-N 3.47Å; K101-T105 PolarHBondContact O-OG1 2.89Å
102	D	93.9	Very high	96.3	Very high	26 Å²	26	37.4 Å²	37.4	14%	0.139	20%	0.195	C	C	.	.	H	α-helix	trans	-51.1	-43.4	-179.1	-60.5	-20.4	0	0	0	112.7	P67 V68 V104 T105 A106 Q245	P67-D102 HydrophobicContact CB-CB 4.28Å; V68-D102 WeakPolarHBondContact CA-OD2 3.39Å; V68-D102 PolarHBondContact N-OD2 3.01Å; D102-V104 VanDerWaalsContact C-N 3.33Å; D102-V104 PolarHBondContact O-N 3.16Å; D102-T105 PolarHBondContact O-N 3.03Å; D102-A106 WeakPolarHBondContact O-CB 3.41Å; D102-A106 PolarHBondContact O-N 3.48Å; D102-Q245 PolarHBondContact OD2-NE2 2.71Å
103	T	94.9	Very high	96.1	Very high	78 Å²	78	39.3 Å²	39.3	48%	0.479	20%	0.203	S	C	.	.	H	α-helix	trans	-64.8	-34.4	179.2	54.4	0	0	0	0	113.3	K101 A107	K101-T103 VanDerWaalsContact C-N 3.25Å; K101-T103 PolarHBondContact O-N 2.9Å; K101-T103 VanDerWaalsContact O-N 3.17Å; T103-A107 WeakPolarHBondContact O-CB 3.5Å; T103-A107 PolarHBondContact O-N 3.33Å
104	V	97.1	Very high	96	Very high	40 Å²	40	46.2 Å²	46.2	24%	0.242	24%	0.236	C	C	.	.	H	α-helix	trans	-72.9	-40.6	176.9	177.5	0	0	0	0	110.2	T100 K101 D102 A107 A108 P136 V137	T100-V104 HydrophobicContact CG2-CB 3.87Å; T100-V104 HydrophobicContact CG2-CG1 3.81Å; K101-V104 HydrophobicContact CB-CG2 4.15Å; K101-V104 WeakPolarHBondContact O-CB 3.08Å; K101-V104 PolarHBondContact O-N 3.43Å; D102-V104 VanDerWaalsContact C-N 3.33Å; D102-V104 PolarHBondContact O-N 3.16Å; V104-A107 PolarHBondContact O-N 3.24Å; V104-A108 WeakPolarHBondContact O-CB 3.33Å; V104-A108 PolarHBondContact O-N 3.42Å; V104-P136 HydrophobicContact CG1-CB 4.05Å; V104-P136 WeakPolarHBondContact CG1-O 3.5Å; V104-V137 HydrophobicContact CG1-CG2 4.27Å
105	T	97.7	Very high	95.9	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-44.8	172.9	-60.7	0	0	0	0	111.3	L76 A93 L96 S97 T100 K101 D102 A107 A108 M109	L76-T105 HydrophobicContact CD1-CG2 3.98Å; A93-T105 WeakPolarHBondContact O-CG2 3.21Å; L96-T105 HydrophobicContact CB-CG2 4.03Å; S97-T105 WeakPolarHBondContact CA-OG1 3.43Å; T100-T105 WeakPolarHBondContact CG2-OG1 3.45Å; K101-T105 PolarHBondContact O-N 3.47Å; K101-T105 PolarHBondContact O-OG1 2.89Å; D102-T105 PolarHBondContact O-N 3.03Å; T105-A107 PolarHBondContact O-N 3.25Å; T105-A108 PolarHBondContact O-N 3.29Å; T105-M109 WeakPolarHBondContact O-CG 2.89Å; T105-M109 PolarHBondContact O-N 3.34Å
106	A	96.6	Very high	95.7	Very high	19 Å²	19	51.5 Å²	51.5	16%	0.157	27%	0.269	C	S	.	.	H	α-helix	trans	-60.1	-45.3	176.7	0	0	0	0	0	112	L76 D102 A108 M109 H110	L76-A106 HydrophobicContact CD1-CB 4.35Å; L76-A106 HydrophobicContact CD2-CB 3.7Å; D102-A106 WeakPolarHBondContact O-CB 3.41Å; D102-A106 PolarHBondContact O-N 3.48Å; A106-A108 VanDerWaalsContact C-N 3.33Å; A106-A108 PolarHBondContact O-N 3.48Å; A106-M109 PolarHBondContact O-N 2.68Å; A106-H110 WeakPolarHBondContact O-CB 3.12Å; A106-H110 PolarHBondContact O-N 3.23Å
107	A	96.9	Very high	95.6	Very high	40 Å²	40	51.8 Å²	51.8	33%	0.331	27%	0.271	S	S	.	.	H	α-helix	trans	-63.8	-37.2	176.5	0	0	0	0	0	112.7	T103 V104 T105 H110 R111	T103-A107 WeakPolarHBondContact O-CB 3.5Å; T103-A107 PolarHBondContact O-N 3.33Å; V104-A107 PolarHBondContact O-N 3.24Å; T105-A107 PolarHBondContact O-N 3.25Å; A107-H110 PolarHBondContact O-N 2.8Å; A107-R111 PolarHBondContact O-N 2.78Å; A107-R111 VanDerWaalsContact O-N 3.14Å; A107-R111 PolarHBondContact O-NH1 3.46Å
108	A	97.9	Very high	95.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.3	-45.4	174.9	0	0	0	0	0	112.3	L96 V104 T105 A106 H110 R111 L112 I134 V137	L96-A108 HydrophobicContact CD1-CB 4.27Å; V104-A108 WeakPolarHBondContact O-CB 3.33Å; V104-A108 PolarHBondContact O-N 3.42Å; T105-A108 PolarHBondContact O-N 3.29Å; A106-A108 VanDerWaalsContact C-N 3.33Å; A106-A108 PolarHBondContact O-N 3.48Å; A108-H110 VanDerWaalsContact C-N 3.28Å; A108-H110 PolarHBondContact O-N 2.82Å; A108-R111 VanDerWaalsContact CA-NH2 3.34Å; A108-R111 PolarHBondContact O-N 2.79Å; A108-L112 PolarHBondContact O-N 2.95Å; A108-I134 HydrophobicContact CB-CG2 4.37Å; A108-V137 HydrophobicContact CB-CG2 3.58Å
109	M	97.5	Very high	95.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.6	-39.5	173.8	-74.5	-56.8	-60.8	0	0	111.5	L76 Q89 L92 A93 L96 T105 A106 R111 L112 K113	L76-M109 HydrophobicContact CB-CB 4.3Å; L76-M109 HydrophobicContact CB-CG 4.22Å; L76-M109 HydrophobicContact CD1-CB 4.26Å; L76-M109 HydrophobicContact CD1-CG 3.88Å; Q89-M109 HydrophobicContact CB-CE 4.14Å; Q89-M109 VanDerWaalsContact O-CE 3.23Å; Q89-M109 WeakPolarHBondContact O-CE 3.49Å; L92-M109 HydrophobicContact CB-CE 4.4Å; L92-M109 HydrophobicContact CB-SD 4.14Å; A93-M109 HydrophobicContact CB-CE 4.21Å; A93-M109 HydrophobicContact CB-CG 3.94Å; A93-M109 HydrophobicContact CB-SD 3.98Å; L96-M109 HydrophobicContact CD1-CG 4.37Å; L96-M109 HydrophobicContact CD1-SD 3.81Å; T105-M109 WeakPolarHBondContact O-CG 2.89Å; T105-M109 PolarHBondContact O-N 3.34Å; A106-M109 PolarHBondContact O-N 2.68Å; M109-R111 PolarHBondContact O-N 2.85Å; M109-L112 PolarHBondContact O-N 2.86Å; M109-L112 HydrophobicContact SD-CD1 4.05Å; M109-K113 VanDerWaalsContact O-CG 3.26Å; M109-K113 WeakPolarHBondContact O-CG 3.37Å; M109-K113 PolarHBondContact O-N 3.35Å
110	H	96.5	Very high	95.9	Very high	105 Å²	105	48.9 Å²	48.9	49%	0.486	26%	0.255	S	S	.	.	H	α-helix	trans	-59.3	-47.9	175.4	-177.9	70.1	0	0	0	112	A106 A107 A108 L112 K113 Q114	A106-H110 WeakPolarHBondContact O-CB 3.12Å; A106-H110 PolarHBondContact O-N 3.23Å; A107-H110 PolarHBondContact O-N 2.8Å; A108-H110 VanDerWaalsContact C-N 3.28Å; A108-H110 PolarHBondContact O-N 2.82Å; H110-L112 PolarHBondContact O-N 2.7Å; H110-K113 PolarHBondContact O-N 3.04Å; H110-Q114 WeakPolarHBondContact O-CG 3.42Å; H110-Q114 PolarHBondContact O-N 2.79Å
111	R	97.7	Very high	96	Very high	76 Å²	76	50.3 Å²	50.3	29%	0.287	26%	0.261	S	S	.	.	H	α-helix	trans	-62.4	-39.9	176.6	-71.1	-173.3	-61.1	-83.5	-4.5	112.9	A107 A108 M109 K113 Q114 H115 L133	A107-R111 PolarHBondContact O-N 2.78Å; A107-R111 VanDerWaalsContact O-N 3.14Å; A107-R111 PolarHBondContact O-NH1 3.46Å; A108-R111 VanDerWaalsContact CA-NH2 3.34Å; A108-R111 PolarHBondContact O-N 2.79Å; M109-R111 PolarHBondContact O-N 2.85Å; R111-K113 VanDerWaalsContact C-N 3.35Å; R111-Q114 PolarHBondContact O-N 2.86Å; R111-H115 PolarHBondContact O-N 2.82Å; R111-H115 VanDerWaalsContact O-N 3.16Å; R111-L133 HydrophobicContact CB-CD2 4.39Å; R111-L133 VanDerWaalsContact CZ-O 3.3Å; R111-L133 PolarHBondContact NE-O 3.36Å; R111-L133 PolarHBondContact NH2-O 3.44Å
112	L	96.9	Very high	96.2	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-61.1	-43.8	174.4	-76.3	170.1	0	0	0	111.8	L96 A108 M109 H110 H115 G116 C117 L130 L133 I134	L96-L112 HydrophobicContact CD1-CD1 3.9Å; A108-L112 PolarHBondContact O-N 2.95Å; M109-L112 PolarHBondContact O-N 2.86Å; M109-L112 HydrophobicContact SD-CD1 4.05Å; H110-L112 PolarHBondContact O-N 2.7Å; L112-H115 CarbonylContact O-C 3.59Å; L112-H115 PolarHBondContact O-N 3.29Å; L112-G116 CarbonylContact O-C 3.58Å; L112-G116 PolarHBondContact O-N 3.27Å; L112-G116 VanDerWaalsContact O-N 3.11Å; L112-C117 HydrophobicContact CB-CB 4.19Å; L112-C117 PolarHBondContact O-N 2.97Å; L112-L130 HydrophobicContact CD2-CD1 3.6Å; L112-L133 HydrophobicContact CD2-CB 4.13Å; L112-L133 HydrophobicContact CD2-CD1 3.85Å; L112-I134 HydrophobicContact CD1-CG2 3.87Å; L112-I134 HydrophobicContact CD2-CG2 4.23Å; L112-I134 HydrophobicContact CG-CG2 4.05Å
113	K	95	Very high	96.3	Very high	41 Å²	41	43.8 Å²	43.8	18%	0.178	23%	0.234	C	C	.	.	H	α-helix	trans	-67.6	-41	179.9	-68.1	-174.6	-45.4	169.2	0	112.3	L76 E78 M109 H110 R111 H115 G116 C117	L76-K113 PolarHBondContact O-NZ 3.42Å; E78-K113 HydrophobicContact CG-CD 3.86Å; E78-K113 WeakPolarHBondContact OE1-CE 3.33Å; E78-K113 IonicContact OE1-NZ 2.98Å; E78-K113 PolarHBondContact OE1-NZ 2.97Å; M109-K113 VanDerWaalsContact O-CG 3.26Å; M109-K113 WeakPolarHBondContact O-CG 3.37Å; M109-K113 PolarHBondContact O-N 3.35Å; H110-K113 PolarHBondContact O-N 3.04Å; R111-K113 VanDerWaalsContact C-N 3.35Å; K113-H115 PolarHBondContact O-N 3.05Å; K113-G116 PolarHBondContact O-N 3.06Å; K113-C117 HydrophobicContact CB-CB 4.38Å; K113-C117 HydrophobicContact CG-CB 3.75Å
114	Q	95	Very high	96.5	Very high	146 Å²	146	44 Å²	44	68%	0.682	24%	0.243	S	C	*	.	H	α-helix	trans	-59.5	-30.5	172.6	-69.2	-62.3	-55.1	0	0	112.6	H110 R111	H110-Q114 WeakPolarHBondContact O-CG 3.42Å; H110-Q114 PolarHBondContact O-N 2.79Å; R111-Q114 PolarHBondContact O-N 2.86Å
115	H	94.9	Very high	96.5	Very high	88 Å²	88	42.4 Å²	42.4	41%	0.407	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-9.4	175	-169.1	-92.9	0	0	0	113.8	R111 L112 K113 N121 M125 L133	R111-H115 PolarHBondContact O-N 2.82Å; R111-H115 VanDerWaalsContact O-N 3.16Å; L112-H115 CarbonylContact O-C 3.59Å; L112-H115 PolarHBondContact O-N 3.29Å; K113-H115 PolarHBondContact O-N 3.05Å; H115-N121 PolarHBondContact ND1-ND2 2.82Å; H115-N121 PolarHBondContact O-ND2 3.3Å; H115-M125 PolarHBondContact CE1-SD 2.97Å; H115-M125 PolarHBondContact ND1-SD 2.84Å; H115-L133 HydrophobicContact CB-CD1 3.91Å; H115-L133 HydrophobicContact CB-CD2 4.39Å
116	G	94	Very high	96.4	Very high	34 Å²	34	45.7 Å²	45.7	35%	0.351	25%	0.254	S	S	.	.			trans	96.2	83.2	-172.6	0	0	0	0	0	112.5	L112 K113 S118 N121	L112-G116 CarbonylContact O-C 3.58Å; L112-G116 PolarHBondContact O-N 3.27Å; L112-G116 VanDerWaalsContact O-N 3.11Å; K113-G116 PolarHBondContact O-N 3.06Å; G116-S118 PolarHBondContact O-N 3.21Å; G116-N121 VanDerWaalsContact O-CB 3.27Å; G116-N121 WeakPolarHBondContact O-CB 3.25Å; G116-N121 PolarHBondContact O-ND2 2.89Å
117	C	94.9	Very high	96.4	Very high	6 Å²	6	49.4 Å²	49.4	4%	0.041	27%	0.268	C	S	.	.			trans	-83.2	79.5	-176.7	-163.9	0	0	0	0	111.5	T85 Q89 L112 K113	T85-C117 WeakPolarHBondContact CG2-O 3.46Å; Q89-C117 HydrophobicContact CG-CB 4.08Å; Q89-C117 WeakPolarHBondContact CG-O 3.42Å; Q89-C117 PolarHBondContact NE2-O 3.03Å; Q89-C117 VanDerWaalsContact NE2-O 3.11Å; L112-C117 HydrophobicContact CB-CB 4.19Å; L112-C117 PolarHBondContact O-N 2.97Å; K113-C117 HydrophobicContact CB-CB 4.38Å; K113-C117 HydrophobicContact CG-CB 3.75Å
118	S	95.8	Very high	96.3	Very high	26 Å²	26	53.5 Å²	53.5	18%	0.182	28%	0.28	C	S	.	.	S	Bend	trans	-125.6	163.7	171.5	88.1	0	0	0	0	111.2	G116 E120 N121 V122	G116-S118 PolarHBondContact O-N 3.21Å; S118-E120 VanDerWaalsContact C-N 3.31Å; S118-E120 WeakPolarHBondContact CB-OE2 3.38Å; S118-E120 PolarHBondContact O-N 2.72Å; S118-E120 PolarHBondContact OG-N 2.68Å; S118-E120 PolarHBondContact OG-OE2 2.7Å; S118-N121 PolarHBondContact O-N 2.86Å; S118-N121 PolarHBondContact OG-N 3.41Å; S118-V122 WeakPolarHBondContact O-CG2 3.49Å; S118-V122 PolarHBondContact O-N 2.82Å
119	L	96.6	Very high	96.3	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.026	30%	0.3	C	S	.	.	H	α-helix	trans	-59.5	-43.7	178.6	176	147.9	0	0	0	111.4	Y88 V122 L123 L154 L155	Y88-L119 HydrophobicContact CD1-CB 4.46Å; Y88-L119 HydrophobicContact CD2-CB 4.43Å; Y88-L119 HydrophobicContact CE1-CB 4.38Å; Y88-L119 HydrophobicContact CE2-CB 4.35Å; Y88-L119 HydrophobicContact CG-CB 4.48Å; L119-V122 PolarHBondContact O-N 2.92Å; L119-L123 HydrophobicContact CD2-CD1 3.65Å; L119-L123 HydrophobicContact CG-CD1 4.29Å; L119-L123 WeakPolarHBondContact O-CG 3.15Å; L119-L123 PolarHBondContact O-N 3.42Å; L119-L154 HydrophobicContact CD1-CB 3.71Å; L119-L154 HydrophobicContact CD1-CD1 4.38Å; L119-L155 HydrophobicContact CD2-CB 4.16Å; L119-L155 HydrophobicContact CD2-CD1 4.03Å; L119-L155 HydrophobicContact CD2-CG 4.48Å
120	E	95.9	Very high	96.3	Very high	117 Å²	117	57.9 Å²	57.9	55%	0.547	30%	0.3	S	S	.	.	H	α-helix	trans	-65.3	-45	-178.3	-57	70.6	-151.2	0	0	110.7	S118 V122 L123 A124	S118-E120 VanDerWaalsContact C-N 3.31Å; S118-E120 WeakPolarHBondContact CB-OE2 3.38Å; S118-E120 PolarHBondContact O-N 2.72Å; S118-E120 PolarHBondContact OG-N 2.68Å; S118-E120 PolarHBondContact OG-OE2 2.7Å; E120-V122 PolarHBondContact O-N 3.41Å; E120-L123 PolarHBondContact O-N 3.31Å; E120-A124 WeakPolarHBondContact O-CB 3.15Å; E120-A124 PolarHBondContact O-N 3.22Å
121	N	96.5	Very high	96.4	Very high	45 Å²	45	52.9 Å²	52.9	24%	0.241	28%	0.278	C	S	.	.	H	α-helix	trans	-67.3	-38.9	179.9	-166.3	42.6	0	0	0	111.7	H115 G116 S118 L123 A124 M125	H115-N121 PolarHBondContact ND1-ND2 2.82Å; H115-N121 PolarHBondContact O-ND2 3.3Å; G116-N121 VanDerWaalsContact O-CB 3.27Å; G116-N121 WeakPolarHBondContact O-CB 3.25Å; G116-N121 PolarHBondContact O-ND2 2.89Å; S118-N121 PolarHBondContact O-N 2.86Å; S118-N121 PolarHBondContact OG-N 3.41Å; N121-L123 VanDerWaalsContact C-N 3.34Å; N121-A124 PolarHBondContact O-N 3.4Å; N121-M125 WeakPolarHBondContact O-CG 3.22Å; N121-M125 PolarHBondContact O-N 2.89Å; N121-M125 VanDerWaalsContact O-N 3.09Å
122	V	97.6	Very high	96.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.9	-37.7	176.3	172.1	0	0	0	0	112	Y88 L92 S118 L119 E120 M125 L130 I147	Y88-V122 HydrophobicContact CE1-CG2 4.09Å; Y88-V122 VanDerWaalsContact OH-CB 3.24Å; Y88-V122 WeakPolarHBondContact OH-CB 3.31Å; Y88-V122 VanDerWaalsContact OH-CG1 3.27Å; Y88-V122 WeakPolarHBondContact OH-CG1 3.48Å; Y88-V122 WeakPolarHBondContact OH-CG2 3.14Å; L92-V122 HydrophobicContact CD1-CG2 4.35Å; S118-V122 WeakPolarHBondContact O-CG2 3.49Å; S118-V122 PolarHBondContact O-N 2.82Å; L119-V122 PolarHBondContact O-N 2.92Å; E120-V122 PolarHBondContact O-N 3.41Å; V122-M125 HydrophobicContact CB-CE 4.25Å; V122-M125 HydrophobicContact CG2-CE 3.82Å; V122-M125 PolarHBondContact O-N 3.2Å; V122-L130 HydrophobicContact CG1-CD2 4.45Å; V122-I147 HydrophobicContact CG1-CG2 3.69Å
123	L	97.4	Very high	96.5	Very high	51 Å²	51	56.6 Å²	56.6	27%	0.267	30%	0.297	S	S	.	.	H	α-helix	trans	-67.2	-37.2	174.5	-75.8	175.7	0	0	0	112.6	L119 E120 N121 M125 L155	L119-L123 HydrophobicContact CD2-CD1 3.65Å; L119-L123 HydrophobicContact CG-CD1 4.29Å; L119-L123 WeakPolarHBondContact O-CG 3.15Å; L119-L123 PolarHBondContact O-N 3.42Å; E120-L123 PolarHBondContact O-N 3.31Å; N121-L123 VanDerWaalsContact C-N 3.34Å; L123-M125 VanDerWaalsContact C-N 3.35Å; L123-L155 HydrophobicContact CD1-CB 4.17Å; L123-L155 HydrophobicContact CD1-CD2 3.61Å; L123-L155 HydrophobicContact CD1-CG 4.49Å
124	A	97.5	Very high	96.6	Very high	81 Å²	81	54.7 Å²	54.7	67%	0.669	29%	0.289	S	S	*	.	H	α-helix	trans	-68.5	-29.4	177.4	0	0	0	0	0	113.5	E120 N121	E120-A124 WeakPolarHBondContact O-CB 3.15Å; E120-A124 PolarHBondContact O-N 3.22Å; N121-A124 PolarHBondContact O-N 3.4Å
125	M	96.9	Very high	96.7	Very high	7 Å²	7	54.6 Å²	54.6	3%	0.034	28%	0.283	C	S	.	.	S	Bend	trans	-71.2	144.6	176.9	-75.4	-172.3	-73.6	0	0	112.8	H115 N121 V122 L123 Q129 L130 L133 K148	H115-M125 PolarHBondContact CE1-SD 2.97Å; H115-M125 PolarHBondContact ND1-SD 2.84Å; N121-M125 WeakPolarHBondContact O-CG 3.22Å; N121-M125 PolarHBondContact O-N 2.89Å; N121-M125 VanDerWaalsContact O-N 3.09Å; V122-M125 HydrophobicContact CB-CE 4.25Å; V122-M125 HydrophobicContact CG2-CE 3.82Å; V122-M125 PolarHBondContact O-N 3.2Å; L123-M125 VanDerWaalsContact C-N 3.35Å; M125-Q129 HydrophobicContact CB-CB 4.22Å; M125-Q129 HydrophobicContact CG-CB 4.36Å; M125-L130 HydrophobicContact CE-CD1 4.12Å; M125-L133 HydrophobicContact CE-CD1 4.31Å; M125-L133 HydrophobicContact SD-CD1 3.71Å; M125-K148 WeakPolarHBondContact O-CE 3.4Å; M125-K148 PolarHBondContact O-NZ 2.91Å
126	T	96.6	Very high	96.8	Very high	70 Å²	70	53 Å²	53	43%	0.429	28%	0.281	S	S	.	.			trans	-71	160.3	164.2	69.8	0	0	0	0	111.2	E128 Q129 L130	T126-E128 PolarHBondContact O-N 3.2Å; T126-Q129 PolarHBondContact O-N 3.16Å; T126-Q129 WeakPolarHBondContact OG1-CG 3.41Å; T126-Q129 PolarHBondContact OG1-N 2.94Å; T126-Q129 VanDerWaalsContact OG1-N 3.13Å; T126-Q129 PolarHBondContact OG1-OE1 3.05Å; T126-L130 PolarHBondContact O-N 2.88Å
127	E	95.5	Very high	97	Very high	98 Å²	98	51.5 Å²	51.5	46%	0.458	27%	0.265	S	S	.	.	H	α-helix	trans	-58.6	-31.9	173.2	-69	-174.5	-166	0	0	112.2	G131 K148	E127-G131 WeakPolarHBondContact O-CA 3.47Å; E127-G131 PolarHBondContact O-N 3.32Å; E127-K148 HydrophobicContact CG-CD 3.65Å; E127-K148 HydrophobicContact CG-CG 4.35Å
128	E	96.4	Very high	97.1	Very high	125 Å²	125	53.7 Å²	53.7	58%	0.584	28%	0.28	S	S	*	.	H	α-helix	trans	-69.2	-45.2	176.9	-166.3	-163.2	142.7	0	0	111.8	T126 G131 K132	T126-E128 PolarHBondContact O-N 3.2Å; E128-G131 PolarHBondContact O-N 3.16Å; E128-K132 WeakPolarHBondContact O-CG 3.35Å; E128-K132 PolarHBondContact O-N 2.83Å; E128-K132 WeakPolarHBondContact OE1-CE 3.39Å; E128-K132 IonicContact OE1-NZ 3.55Å; E128-K132 PolarHBondContact OE1-NZ 3.48Å
129	Q	97.7	Very high	97.1	Very high	92 Å²	92	58.8 Å²	58.8	43%	0.43	30%	0.299	S	S	.	.	H	α-helix	trans	-61.1	-48.2	175.7	-74.9	170.2	-43.2	0	0	111	M125 T126 G131 K132 L133	M125-Q129 HydrophobicContact CB-CB 4.22Å; M125-Q129 HydrophobicContact CG-CB 4.36Å; T126-Q129 PolarHBondContact O-N 3.16Å; T126-Q129 WeakPolarHBondContact OG1-CG 3.41Å; T126-Q129 PolarHBondContact OG1-N 2.94Å; T126-Q129 VanDerWaalsContact OG1-N 3.13Å; T126-Q129 PolarHBondContact OG1-OE1 3.05Å; Q129-G131 VanDerWaalsContact C-N 3.29Å; Q129-G131 PolarHBondContact O-N 3.03Å; Q129-K132 PolarHBondContact O-N 3.27Å; Q129-L133 PolarHBondContact O-N 3.43Å
130	L	98	Very high	97.2	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59	-44.2	174.8	178.8	58	0	0	0	110.9	L112 V122 M125 T126 K132 L133 I134 A144 I147 K148	L112-L130 HydrophobicContact CD2-CD1 3.6Å; V122-L130 HydrophobicContact CG1-CD2 4.45Å; M125-L130 HydrophobicContact CE-CD1 4.12Å; T126-L130 PolarHBondContact O-N 2.88Å; L130-K132 VanDerWaalsContact C-N 3.34Å; L130-K132 PolarHBondContact O-N 3.39Å; L130-L133 WeakPolarHBondContact O-CB 3.11Å; L130-L133 PolarHBondContact O-N 3.04Å; L130-I134 HydrophobicContact CD1-CG2 4.43Å; L130-I134 WeakPolarHBondContact O-CG1 3.42Å; L130-I134 PolarHBondContact O-N 3.04Å; L130-I134 VanDerWaalsContact O-N 3.16Å; L130-A144 HydrophobicContact CD2-CB 4.05Å; L130-A144 HydrophobicContact CG-CB 4.22Å; L130-I147 HydrophobicContact CD2-CB 4.18Å; L130-I147 HydrophobicContact CD2-CG2 3.83Å; L130-K148 HydrophobicContact CD2-CG 4.03Å
131	G	97.7	Very high	97.3	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-54.2	-44.9	175.6	0	0	0	0	0	113.3	E127 E128 Q129 L133 I134 Y135 W140	E127-G131 WeakPolarHBondContact O-CA 3.47Å; E127-G131 PolarHBondContact O-N 3.32Å; E128-G131 PolarHBondContact O-N 3.16Å; Q129-G131 VanDerWaalsContact C-N 3.29Å; Q129-G131 PolarHBondContact O-N 3.03Å; G131-L133 PolarHBondContact O-N 2.86Å; G131-I134 CarbonylContact O-C 3.51Å; G131-I134 PolarHBondContact O-N 3Å; G131-I134 VanDerWaalsContact O-N 3.11Å; G131-Y135 WeakPolarHBondContact O-CA 3.48Å; G131-Y135 WeakPolarHBondContact O-CB 3.45Å; G131-Y135 PolarHBondContact O-N 3.34Å; G131-W140 VanDerWaalsContact CA-CZ3 3.41Å
132	K	97.8	Very high	97.3	Very high	127 Å²	127	66.5 Å²	66.5	55%	0.552	34%	0.335	S	S	*	.	H	α-helix	trans	-59.5	-29.8	176.2	-71.8	169.6	-175.3	166.2	0	112.8	E128 Q129 L130 Y135	E128-K132 WeakPolarHBondContact O-CG 3.35Å; E128-K132 PolarHBondContact O-N 2.83Å; E128-K132 WeakPolarHBondContact OE1-CE 3.39Å; E128-K132 IonicContact OE1-NZ 3.55Å; E128-K132 PolarHBondContact OE1-NZ 3.48Å; Q129-K132 PolarHBondContact O-N 3.27Å; L130-K132 VanDerWaalsContact C-N 3.34Å; L130-K132 PolarHBondContact O-N 3.39Å; K132-Y135 WeakPolarHBondContact O-CD1 3.16Å
133	L	97.9	Very high	97.3	Very high	29 Å²	29	67.3 Å²	67.3	15%	0.152	34%	0.339	C	S	.	.	H	α-helix	trans	-79.4	-33	176.8	-59.2	174	0	0	0	112.3	R111 L112 H115 M125 Q129 L130 G131	R111-L133 HydrophobicContact CB-CD2 4.39Å; R111-L133 VanDerWaalsContact CZ-O 3.3Å; R111-L133 PolarHBondContact NE-O 3.36Å; R111-L133 PolarHBondContact NH2-O 3.44Å; L112-L133 HydrophobicContact CD2-CB 4.13Å; L112-L133 HydrophobicContact CD2-CD1 3.85Å; H115-L133 HydrophobicContact CB-CD1 3.91Å; H115-L133 HydrophobicContact CB-CD2 4.39Å; M125-L133 HydrophobicContact CE-CD1 4.31Å; M125-L133 HydrophobicContact SD-CD1 3.71Å; Q129-L133 PolarHBondContact O-N 3.43Å; L130-L133 WeakPolarHBondContact O-CB 3.11Å; L130-L133 PolarHBondContact O-N 3.04Å; G131-L133 PolarHBondContact O-N 2.86Å
134	I	98.1	Very high	97.3	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-112.6	1.2	-171.8	70.4	163.9	0	0	0	115.1	L96 A108 L112 L130 G131 P136 V137 W140 K143 A144 I147	L96-I134 HydrophobicContact CD1-CG2 4.28Å; L96-I134 HydrophobicContact CD2-CB 4.26Å; L96-I134 HydrophobicContact CD2-CD1 3.76Å; L96-I134 HydrophobicContact CD2-CG2 4.24Å; A108-I134 HydrophobicContact CB-CG2 4.37Å; L112-I134 HydrophobicContact CD1-CG2 3.87Å; L112-I134 HydrophobicContact CD2-CG2 4.23Å; L112-I134 HydrophobicContact CG-CG2 4.05Å; L130-I134 HydrophobicContact CD1-CG2 4.43Å; L130-I134 WeakPolarHBondContact O-CG1 3.42Å; L130-I134 PolarHBondContact O-N 3.04Å; L130-I134 VanDerWaalsContact O-N 3.16Å; G131-I134 CarbonylContact O-C 3.51Å; G131-I134 PolarHBondContact O-N 3Å; G131-I134 VanDerWaalsContact O-N 3.11Å; I134-P136 VanDerWaalsContact C-N 3.29Å; I134-P136 WeakPolarHBondContact O-CD 3.32Å; I134-V137 WeakPolarHBondContact O-CB 3.45Å; I134-V137 WeakPolarHBondContact O-CG2 3.27Å; I134-V137 PolarHBondContact O-N 2.94Å; I134-W140 HydrophobicContact CD1-CB 4.39Å; I134-W140 HydrophobicContact CG1-CB 4.2Å; I134-K143 HydrophobicContact CD1-CB 4.41Å; I134-A144 HydrophobicContact CD1-CB 4.15Å; I134-I147 HydrophobicContact CD1-CD1 4.31Å
135	Y	97.6	Very high	97.4	Very high	144 Å²	144	66.1 Å²	66.1	57%	0.565	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-29.6	-171.9	82	-89.1	0	0	0	117	G131 K132 V137	G131-Y135 WeakPolarHBondContact O-CA 3.48Å; G131-Y135 WeakPolarHBondContact O-CB 3.45Å; G131-Y135 PolarHBondContact O-N 3.34Å; K132-Y135 WeakPolarHBondContact O-CD1 3.16Å; Y135-V137 PolarHBondContact O-N 3.17Å
136	P	97.6	Very high	97.4	Very high	56 Å²	56	66.4 Å²	66.4	36%	0.364	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-16.5	176.8	-22.2	37.1	0	0	0	113.4	V104 I134	V104-P136 HydrophobicContact CG1-CB 4.05Å; V104-P136 WeakPolarHBondContact CG1-O 3.5Å; I134-P136 VanDerWaalsContact C-N 3.29Å; I134-P136 WeakPolarHBondContact O-CD 3.32Å
137	V	97.8	Very high	97.5	Very high	2 Å²	2	63.1 Å²	63.1	1%	0.012	30%	0.3	C	S	.	.	S	Bend	trans	-70.6	137.7	177	174.5	0	0	0	0	109.8	L96 T100 V104 A108 I134 Y135 F139 W140 K143	L96-V137 HydrophobicContact CD2-CG1 4.18Å; L96-V137 HydrophobicContact CD2-CG2 4.39Å; L96-V137 WeakPolarHBondContact O-CG1 3.42Å; T100-V137 HydrophobicContact CG2-CB 4.33Å; T100-V137 HydrophobicContact CG2-CG1 3.97Å; T100-V137 HydrophobicContact CG2-CG2 4.27Å; T100-V137 WeakPolarHBondContact OG1-CG1 3.25Å; V104-V137 HydrophobicContact CG1-CG2 4.27Å; A108-V137 HydrophobicContact CB-CG2 3.58Å; I134-V137 WeakPolarHBondContact O-CB 3.45Å; I134-V137 WeakPolarHBondContact O-CG2 3.27Å; I134-V137 PolarHBondContact O-N 2.94Å; Y135-V137 PolarHBondContact O-N 3.17Å; V137-F139 PolarHBondContact O-N 3.04Å; V137-W140 WeakPolarHBondContact O-CB 3.46Å; V137-W140 PolarHBondContact O-N 2.98Å; V137-K143 HydrophobicContact CG1-CD 3.59Å
138	S	95.8	Very high	97.6	Very high	51 Å²	51	60.8 Å²	60.8	36%	0.357	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	135.7	175.6	-51.8	0	0	0	0	110.9	Q99 W140 K143	Q99-S138 WeakPolarHBondContact O-CB 3.43Å; Q99-S138 PolarHBondContact O-OG 2.92Å; S138-W140 VanDerWaalsContact C-N 3.25Å; S138-W140 PolarHBondContact O-N 3.26Å; S138-K143 WeakPolarHBondContact O-CD 3.3Å; S138-K143 VanDerWaalsContact O-CE 3.32Å; S138-K143 WeakPolarHBondContact O-CE 3.33Å; S138-K143 PolarHBondContact O-NZ 3.5Å
139	F	96.9	Very high	97.7	Very high	133 Å²	133	59 Å²	59	58%	0.583	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	35.8	-179	-49.2	-78.1	0	0	0	113.6	V137 K141 T142 K143	V137-F139 PolarHBondContact O-N 3.04Å; F139-K141 PolarHBondContact O-N 3.29Å; F139-K141 VanDerWaalsContact O-N 3.14Å; F139-T142 PolarHBondContact O-N 3.27Å; F139-K143 PolarHBondContact O-N 3.38Å
140	W	97.6	Very high	97.7	Very high	81 Å²	81	54.6 Å²	54.6	31%	0.307	26%	0.259	S	S	.	.	H	α-helix	trans	-54.9	-34.1	-175.4	69.3	-98.9	0	0	0	114	G131 I134 V137 S138 K143 A144	G131-W140 VanDerWaalsContact CA-CZ3 3.41Å; I134-W140 HydrophobicContact CD1-CB 4.39Å; I134-W140 HydrophobicContact CG1-CB 4.2Å; V137-W140 WeakPolarHBondContact O-CB 3.46Å; V137-W140 PolarHBondContact O-N 2.98Å; S138-W140 VanDerWaalsContact C-N 3.25Å; S138-W140 PolarHBondContact O-N 3.26Å; W140-K143 PolarHBondContact O-N 2.66Å; W140-A144 VanDerWaalsContact O-CB 3.32Å; W140-A144 WeakPolarHBondContact O-CB 3.37Å; W140-A144 PolarHBondContact O-N 2.97Å
141	K	97.8	Very high	97.7	Very high	144 Å²	144	54.6 Å²	54.6	63%	0.626	26%	0.259	S	S	*	.	H	α-helix	trans	-61.5	-51.6	178.6	-67.3	-175.6	178.9	-176.1	0	111.5	F139 K143 A144 K145	F139-K141 PolarHBondContact O-N 3.29Å; F139-K141 VanDerWaalsContact O-N 3.14Å; K141-K143 VanDerWaalsContact C-N 3.29Å; K141-K143 PolarHBondContact O-N 2.73Å; K141-A144 PolarHBondContact O-N 3.18Å; K141-K145 PolarHBondContact O-N 2.86Å
142	T	97.5	Very high	97.8	Very high	104 Å²	104	55.8 Å²	55.8	64%	0.638	27%	0.271	S	S	*	.	H	α-helix	trans	-62.1	-39.2	176.9	-51.3	0	0	0	0	111.3	F139 A146	F139-T142 PolarHBondContact O-N 3.27Å; T142-A146 WeakPolarHBondContact O-CB 3.4Å; T142-A146 PolarHBondContact O-N 3.35Å
143	K	97.7	Very high	97.8	Very high	17 Å²	17	51.8 Å²	51.8	7%	0.074	26%	0.256	C	S	.	.	H	α-helix	trans	-68.7	-40	177.4	-73.3	173.9	173.2	171	0	113.1	L96 S98 T100 I134 V137 S138 F139 W140 K141 K145 A146 I147	L96-K143 HydrophobicContact CD2-CB 4.49Å; L96-K143 HydrophobicContact CD2-CD 4.34Å; L96-K143 PolarHBondContact O-NZ 3.21Å; S98-K143 PolarHBondContact O-NZ 3.03Å; S98-K143 WeakPolarHBondContact OG-CE 3.47Å; T100-K143 PolarHBondContact OG1-NZ 3.38Å; I134-K143 HydrophobicContact CD1-CB 4.41Å; V137-K143 HydrophobicContact CG1-CD 3.59Å; S138-K143 WeakPolarHBondContact O-CD 3.3Å; S138-K143 VanDerWaalsContact O-CE 3.32Å; S138-K143 WeakPolarHBondContact O-CE 3.33Å; S138-K143 PolarHBondContact O-NZ 3.5Å; F139-K143 PolarHBondContact O-N 3.38Å; W140-K143 PolarHBondContact O-N 2.66Å; K141-K143 VanDerWaalsContact C-N 3.29Å; K141-K143 PolarHBondContact O-N 2.73Å; K143-K145 VanDerWaalsContact C-N 3.34Å; K143-K145 PolarHBondContact O-N 2.85Å; K143-A146 PolarHBondContact O-N 3.13Å; K143-I147 WeakPolarHBondContact O-CB 3.28Å; K143-I147 WeakPolarHBondContact O-CG1 3.11Å; K143-I147 PolarHBondContact O-N 3.03Å
144	A	97.9	Very high	97.8	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.008	25%	0.249	C	C	.	.	H	α-helix	trans	-59.5	-47.5	176.8	0	0	0	0	0	110.4	L130 I134 W140 K141 I147 K148	L130-A144 HydrophobicContact CD2-CB 4.05Å; L130-A144 HydrophobicContact CG-CB 4.22Å; I134-A144 HydrophobicContact CD1-CB 4.15Å; W140-A144 VanDerWaalsContact O-CB 3.32Å; W140-A144 WeakPolarHBondContact O-CB 3.37Å; W140-A144 PolarHBondContact O-N 2.97Å; K141-A144 PolarHBondContact O-N 3.18Å; A144-I147 PolarHBondContact O-N 3.36Å; A144-K148 PolarHBondContact O-N 3.32Å
145	K	97.9	Very high	97.8	Very high	106 Å²	106	55 Å²	55	46%	0.461	27%	0.273	S	S	.	.	H	α-helix	trans	-57.8	-52	173.6	179.6	173	174.4	174.6	0	112	K141 K143 I147 K148 E149	K141-K145 PolarHBondContact O-N 2.86Å; K143-K145 VanDerWaalsContact C-N 3.34Å; K143-K145 PolarHBondContact O-N 2.85Å; K145-I147 VanDerWaalsContact C-N 3.31Å; K145-I147 PolarHBondContact O-N 3.3Å; K145-K148 PolarHBondContact O-N 3.24Å; K145-E149 WeakPolarHBondContact CE-OE1 3.38Å; K145-E149 HydrophobicContact CG-CG 4.46Å; K145-E149 WeakPolarHBondContact CG-OE1 3.47Å; K145-E149 IonicContact NZ-OE1 3.84Å; K145-E149 WeakPolarHBondContact O-CG 3.32Å; K145-E149 PolarHBondContact O-N 3.36Å
146	A	98	Very high	97.8	Very high	13 Å²	13	55.4 Å²	55.4	11%	0.107	28%	0.279	C	S	.	.	H	α-helix	trans	-60.7	-37.6	179.6	0	0	0	0	0	113.1	M95 T142 K143 T150 P173	M95-A146 HydrophobicContact CE-CB 4.2Å; T142-A146 WeakPolarHBondContact O-CB 3.4Å; T142-A146 PolarHBondContact O-N 3.35Å; K143-A146 PolarHBondContact O-N 3.13Å; A146-T150 WeakPolarHBondContact O-CB 3.36Å; A146-T150 PolarHBondContact O-N 3.41Å; A146-T150 PolarHBondContact O-OG1 3.38Å; A146-P173 HydrophobicContact CB-CB 4.12Å
147	I	98.4	Very high	97.9	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-64.1	-46.6	175.4	-75	167.8	0	0	0	110.6	L92 M95 L96 V122 L130 I134 K143 A144 K145 T150 S151	L92-I147 HydrophobicContact CD2-CB 4.33Å; L92-I147 HydrophobicContact CD2-CD1 4.36Å; L92-I147 HydrophobicContact CD2-CG1 3.92Å; L92-I147 HydrophobicContact CD2-CG2 3.67Å; M95-I147 HydrophobicContact CE-CG1 3.85Å; M95-I147 HydrophobicContact SD-CG1 4.29Å; L96-I147 HydrophobicContact CD2-CD1 3.72Å; L96-I147 HydrophobicContact CG-CD1 4.16Å; V122-I147 HydrophobicContact CG1-CG2 3.69Å; L130-I147 HydrophobicContact CD2-CB 4.18Å; L130-I147 HydrophobicContact CD2-CG2 3.83Å; I134-I147 HydrophobicContact CD1-CD1 4.31Å; K143-I147 WeakPolarHBondContact O-CB 3.28Å; K143-I147 WeakPolarHBondContact O-CG1 3.11Å; K143-I147 PolarHBondContact O-N 3.03Å; A144-I147 PolarHBondContact O-N 3.36Å; K145-I147 VanDerWaalsContact C-N 3.31Å; K145-I147 PolarHBondContact O-N 3.3Å; I147-T150 PolarHBondContact O-N 2.8Å; I147-S151 WeakPolarHBondContact O-CB 3.47Å; I147-S151 PolarHBondContact O-N 3.11Å; I147-S151 PolarHBondContact O-OG 3.34Å
148	K	97.8	Very high	97.9	Very high	50 Å²	50	62 Å²	62	22%	0.217	30%	0.301	C	S	.	.	H	α-helix	trans	-62.7	-48.2	177.7	-74.3	-149.7	70.4	171.6	0	112	M125 E127 L130 A144 K145 T150 S151 G152	M125-K148 WeakPolarHBondContact O-CE 3.4Å; M125-K148 PolarHBondContact O-NZ 2.91Å; E127-K148 HydrophobicContact CG-CD 3.65Å; E127-K148 HydrophobicContact CG-CG 4.35Å; L130-K148 HydrophobicContact CD2-CG 4.03Å; A144-K148 PolarHBondContact O-N 3.32Å; K145-K148 PolarHBondContact O-N 3.24Å; K148-T150 PolarHBondContact O-N 3.07Å; K148-S151 PolarHBondContact O-N 3.18Å; K148-G152 PolarHBondContact O-N 2.88Å
149	E	98.2	Very high	97.9	Very high	86 Å²	86	65.7 Å²	65.7	40%	0.402	32%	0.317	S	S	.	.	H	α-helix	trans	-60.1	-45.7	177.3	-70.4	175.7	179.7	0	0	111.5	K145 S151 G152 I153 P173	K145-E149 WeakPolarHBondContact CE-OE1 3.38Å; K145-E149 HydrophobicContact CG-CG 4.46Å; K145-E149 WeakPolarHBondContact CG-OE1 3.47Å; K145-E149 IonicContact NZ-OE1 3.84Å; K145-E149 WeakPolarHBondContact O-CG 3.32Å; K145-E149 PolarHBondContact O-N 3.36Å; E149-S151 VanDerWaalsContact C-N 3.34Å; E149-S151 PolarHBondContact O-N 3.48Å; E149-G152 PolarHBondContact O-N 3.49Å; E149-I153 WeakPolarHBondContact O-CG1 3.43Å; E149-I153 PolarHBondContact O-N 3.13Å; E149-P173 HydrophobicContact CB-CB 4.44Å; E149-P173 HydrophobicContact CB-CG 3.91Å
150	T	98.5	Very high	97.9	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-57.3	-49.1	175.1	-65.4	0	0	0	0	110.7	L91 M95 A146 I147 K148 G152 I153 L154 L172 P173	L91-T150 HydrophobicContact CD2-CG2 4.09Å; M95-T150 HydrophobicContact CE-CG2 4.46Å; M95-T150 WeakPolarHBondContact CE-OG1 3.48Å; M95-T150 HydrophobicContact SD-CG2 4.26Å; A146-T150 WeakPolarHBondContact O-CB 3.36Å; A146-T150 PolarHBondContact O-N 3.41Å; A146-T150 PolarHBondContact O-OG1 3.38Å; I147-T150 PolarHBondContact O-N 2.8Å; K148-T150 PolarHBondContact O-N 3.07Å; T150-G152 VanDerWaalsContact C-N 3.27Å; T150-G152 PolarHBondContact O-N 2.95Å; T150-I153 WeakPolarHBondContact O-CB 3.39Å; T150-I153 PolarHBondContact O-N 3.1Å; T150-I153 VanDerWaalsContact O-N 3.11Å; T150-L154 HydrophobicContact CG2-CD1 4.32Å; T150-L154 HydrophobicContact CG2-CG 4.26Å; T150-L154 VanDerWaalsContact O-CG 3.32Å; T150-L154 WeakPolarHBondContact O-CG 3.5Å; T150-L154 PolarHBondContact O-N 3.16Å; T150-L172 HydrophobicContact CG2-CB 4.23Å; T150-L172 HydrophobicContact CG2-CD1 3.99Å; T150-L172 HydrophobicContact CG2-CD2 4.26Å; T150-L172 HydrophobicContact CG2-CG 4.39Å; T150-P173 WeakPolarHBondContact OG1-CD 3.43Å; T150-P173 PolarHBondContact OG1-O 3.46Å
151	S	98.2	Very high	97.9	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.3	-37.8	-179.1	-52.5	0	0	0	0	112.1	Y88 I147 K148 E149 L154 L155	Y88-S151 PolarHBondContact OH-OG 3.41Å; I147-S151 WeakPolarHBondContact O-CB 3.47Å; I147-S151 PolarHBondContact O-N 3.11Å; I147-S151 PolarHBondContact O-OG 3.34Å; K148-S151 PolarHBondContact O-N 3.18Å; E149-S151 VanDerWaalsContact C-N 3.34Å; E149-S151 PolarHBondContact O-N 3.48Å; S151-L154 PolarHBondContact O-N 2.81Å; S151-L155 PolarHBondContact O-N 3.37Å; S151-L155 VanDerWaalsContact O-N 3.12Å
152	G	98.3	Very high	97.9	Very high	26 Å²	26	50.4 Å²	50.4	27%	0.268	26%	0.257	S	S	.	.	H	α-helix	trans	-64.7	-44.8	174.5	0	0	0	0	0	112.3	K148 E149 T150 L154 L155 E156	K148-G152 PolarHBondContact O-N 2.88Å; E149-G152 PolarHBondContact O-N 3.49Å; T150-G152 VanDerWaalsContact C-N 3.27Å; T150-G152 PolarHBondContact O-N 2.95Å; G152-L154 VanDerWaalsContact C-N 3.33Å; G152-L154 PolarHBondContact O-N 3.23Å; G152-L155 PolarHBondContact O-N 2.72Å; G152-E156 WeakPolarHBondContact O-CB 3.26Å; G152-E156 PolarHBondContact O-N 2.74Å
153	I	98.5	Very high	97.9	Very high	44 Å²	44	45.6 Å²	45.6	23%	0.226	23%	0.227	C	C	.	.	H	α-helix	trans	-61.3	-41.3	176.3	-68.3	164.4	0	0	0	111.3	E149 T150 E156 K157 Y158 L172 P173	E149-I153 WeakPolarHBondContact O-CG1 3.43Å; E149-I153 PolarHBondContact O-N 3.13Å; T150-I153 WeakPolarHBondContact O-CB 3.39Å; T150-I153 PolarHBondContact O-N 3.1Å; T150-I153 VanDerWaalsContact O-N 3.11Å; I153-E156 PolarHBondContact O-N 3.3Å; I153-K157 HydrophobicContact CG2-CD 4.34Å; I153-K157 WeakPolarHBondContact O-CB 3.48Å; I153-K157 PolarHBondContact O-N 3.44Å; I153-Y158 HydrophobicContact CG2-CD2 4.26Å; I153-Y158 HydrophobicContact CG2-CE2 3.92Å; I153-L172 HydrophobicContact CB-CD2 4.29Å; I153-L172 HydrophobicContact CG2-CD2 3.7Å; I153-P173 HydrophobicContact CD1-CG 4.04Å
154	L	98.6	Very high	97.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.7	-44.1	178.3	-63.8	-171.3	0	0	0	111.4	Y88 L91 L119 T150 S151 G152 Y158 D159 G160 D161 I162 P163 L172	Y88-L154 HydrophobicContact CD2-CD1 3.84Å; Y88-L154 HydrophobicContact CE2-CD1 4.12Å; L91-L154 HydrophobicContact CD2-CD1 4.17Å; L119-L154 HydrophobicContact CD1-CB 3.71Å; L119-L154 HydrophobicContact CD1-CD1 4.38Å; T150-L154 HydrophobicContact CG2-CD1 4.32Å; T150-L154 HydrophobicContact CG2-CG 4.26Å; T150-L154 VanDerWaalsContact O-CG 3.32Å; T150-L154 WeakPolarHBondContact O-CG 3.5Å; T150-L154 PolarHBondContact O-N 3.16Å; S151-L154 PolarHBondContact O-N 2.81Å; G152-L154 VanDerWaalsContact C-N 3.33Å; G152-L154 PolarHBondContact O-N 3.23Å; L154-Y158 HydrophobicContact CD2-CD2 3.98Å; L154-Y158 CarbonylContact O-C 3.32Å; L154-Y158 WeakPolarHBondContact O-CA 3.38Å; L154-Y158 PolarHBondContact O-N 3.18Å; L154-D159 PolarHBondContact O-N 3.18Å; L154-G160 PolarHBondContact O-N 3.24Å; L154-D161 WeakPolarHBondContact CD2-O 3.48Å; L154-I162 HydrophobicContact CD1-CG2 3.95Å; L154-P163 HydrophobicContact CD2-CG 4.42Å; L154-L172 HydrophobicContact CD2-CD1 4.06Å; L154-L172 HydrophobicContact CD2-CD2 4.04Å
155	L	97.8	Very high	98	Very high	97 Å²	97	52.5 Å²	52.5	51%	0.508	26%	0.263	S	S	.	.	H	α-helix	trans	-62.8	-46.4	177.1	-172.8	59.7	0	0	0	111.8	L119 L123 S151 G152	L119-L155 HydrophobicContact CD2-CB 4.16Å; L119-L155 HydrophobicContact CD2-CD1 4.03Å; L119-L155 HydrophobicContact CD2-CG 4.48Å; L123-L155 HydrophobicContact CD1-CB 4.17Å; L123-L155 HydrophobicContact CD1-CD2 3.61Å; L123-L155 HydrophobicContact CD1-CG 4.49Å; S151-L155 PolarHBondContact O-N 3.37Å; S151-L155 VanDerWaalsContact O-N 3.12Å; G152-L155 PolarHBondContact O-N 2.72Å
156	E	98	Very high	98	Very high	151 Å²	151	49 Å²	49	71%	0.706	25%	0.25	S	S	*	.	H	α-helix	trans	-72.1	-41.2	-174.8	-172.7	-164.7	158.3	0	0	113	G152 I153	G152-E156 WeakPolarHBondContact O-CB 3.26Å; G152-E156 PolarHBondContact O-N 2.74Å; I153-E156 PolarHBondContact O-N 3.3Å
157	K	98	Very high	98	Very high	135 Å²	135	52 Å²	52	59%	0.587	27%	0.271	S	S	*	.	H	α-helix	trans	-114.4	-17.7	-165.5	-60.4	-173.7	-177.3	176.9	0	114.9	I153	I153-K157 HydrophobicContact CG2-CD 4.34Å; I153-K157 WeakPolarHBondContact O-CB 3.48Å; I153-K157 PolarHBondContact O-N 3.44Å
158	Y	97.9	Very high	98	Very high	61 Å²	61	53.9 Å²	53.9	24%	0.239	28%	0.281	C	S	.	.	S	Bend	trans	-129.2	22.2	-171.3	-59.6	-80	0	0	0	112.7	I153 L154 G160 D161 P163 D168	I153-Y158 HydrophobicContact CG2-CD2 4.26Å; I153-Y158 HydrophobicContact CG2-CE2 3.92Å; L154-Y158 HydrophobicContact CD2-CD2 3.98Å; L154-Y158 CarbonylContact O-C 3.32Å; L154-Y158 WeakPolarHBondContact O-CA 3.38Å; L154-Y158 PolarHBondContact O-N 3.18Å; Y158-G160 PolarHBondContact O-N 2.76Å; Y158-G160 VanDerWaalsContact O-N 3.17Å; Y158-D161 WeakPolarHBondContact CB-O 3.45Å; Y158-D161 PolarHBondContact O-N 3.26Å; Y158-P163 HydrophobicContact CD1-CB 4.12Å; Y158-P163 HydrophobicContact CD1-CG 3.96Å; Y158-P163 HydrophobicContact CD2-CG 4.14Å; Y158-P163 HydrophobicContact CE1-CB 3.76Å; Y158-P163 HydrophobicContact CE1-CG 3.69Å; Y158-P163 HydrophobicContact CE2-CG 3.86Å; Y158-P163 HydrophobicContact CG-CG 4.18Å; Y158-D168 HydrophobicContact CE1-CB 4.44Å
159	D	96.5	Very high	98	Very high	129 Å²	129	51.5 Å²	51.5	69%	0.69	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	37.8	178	-175.4	51.2	0	0	0	112.5	K84 L154 D161	K84-D159 PolarHBondContact NZ-O 3.08Å; K84-D159 IonicContact NZ-OD2 2.71Å; K84-D159 PolarHBondContact NZ-OD2 3.24Å; L154-D159 PolarHBondContact O-N 3.18Å; D159-D161 PolarHBondContact O-N 3.07Å
160	G	96.8	Very high	98	Very high	11 Å²	11	49.8 Å²	49.8	11%	0.113	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	9.8	-178.2	0	0	0	0	0	115.4	L154 Y158	L154-G160 PolarHBondContact O-N 3.24Å; Y158-G160 PolarHBondContact O-N 2.76Å; Y158-G160 VanDerWaalsContact O-N 3.17Å
161	D	98	Very high	98	Very high	22 Å²	22	56.1 Å²	56.1	12%	0.118	30%	0.295	C	S	.	.	S	Bend	trans	-106.1	166.9	173.7	-156.6	-6.4	0	0	0	111.3	K84 R87 L154 Y158 D159	K84-D161 HydrophobicContact CD-CB 4.05Å; K84-D161 HydrophobicContact CG-CB 4.09Å; R87-D161 IonicContact CZ-OD1 3.74Å; R87-D161 IonicContact CZ-OD2 2.66Å; R87-D161 IonicContact NE-OD1 3.78Å; R87-D161 PolarHBondContact NE-OD1 3.44Å; R87-D161 IonicContact NE-OD2 2.73Å; R87-D161 PolarHBondContact NE-OD2 3.07Å; R87-D161 IonicContact NH2-OD1 3.38Å; R87-D161 PolarHBondContact NH2-OD1 3.4Å; R87-D161 IonicContact NH2-OD2 2.72Å; R87-D161 PolarHBondContact NH2-OD2 3.17Å; L154-D161 WeakPolarHBondContact CD2-O 3.48Å; Y158-D161 WeakPolarHBondContact CB-O 3.45Å; Y158-D161 PolarHBondContact O-N 3.26Å; D159-D161 PolarHBondContact O-N 3.07Å
162	I	98	Very high	98	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.021	30%	0.296	C	S	.	.			trans	-80.6	151.8	174.9	68.8	170	0	0	0	111	R87 L91 L154 T183 A187 W188	R87-I162 HydrophobicContact CB-CD1 3.73Å; R87-I162 HydrophobicContact CB-CG1 3.91Å; R87-I162 HydrophobicContact CG-CD1 4.24Å; L91-I162 HydrophobicContact CB-CG2 4.12Å; L91-I162 HydrophobicContact CD2-CB 4.37Å; L91-I162 HydrophobicContact CD2-CG2 3.66Å; L154-I162 HydrophobicContact CD1-CG2 3.95Å; I162-T183 HydrophobicContact CD1-CG2 3.44Å; I162-T183 VanDerWaalsContact CD1-CG2 3.44Å; I162-A187 HydrophobicContact CD1-CB 3.76Å; I162-W188 HydrophobicContact CG1-CZ2 3.83Å; I162-W188 WeakPolarHBondContact O-CZ2 3.43Å
163	P	98.2	Very high	98	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.019	29%	0.293	C	S	.	.			trans	-63.4	151	176.3	-16.5	26	0	0	0	113.2	L154 Y158 D168 L169 L172 W188	L154-P163 HydrophobicContact CD2-CG 4.42Å; Y158-P163 HydrophobicContact CD1-CB 4.12Å; Y158-P163 HydrophobicContact CD1-CG 3.96Å; Y158-P163 HydrophobicContact CD2-CG 4.14Å; Y158-P163 HydrophobicContact CE1-CB 3.76Å; Y158-P163 HydrophobicContact CE1-CG 3.69Å; Y158-P163 HydrophobicContact CE2-CG 3.86Å; Y158-P163 HydrophobicContact CG-CG 4.18Å; P163-D168 HydrophobicContact CB-CB 3.51Å; P163-D168 HydrophobicContact CG-CB 4.18Å; P163-L169 HydrophobicContact CB-CD2 4.39Å; P163-L169 HydrophobicContact CB-CG 4.13Å; P163-L169 HydrophobicContact CG-CD2 4.22Å; P163-L169 HydrophobicContact CG-CG 4.38Å; P163-L172 HydrophobicContact CG-CD1 4.13Å; P163-W188 PolarHBondContact O-NE1 2.73Å
164	Q	97.5	Very high	97.9	Very high	112 Å²	112	57.4 Å²	57.4	52%	0.523	31%	0.312	S	S	.	.	S	Bend	trans	-91.8	-11.3	-177.5	-64.1	-172.2	27.1	0	0	114.4	W188 R190	Q164-W188 HydrophobicContact CG-CD2 4.02Å; Q164-W188 HydrophobicContact CG-CE3 4.29Å; Q164-W188 HydrophobicContact CG-CH2 3.86Å; Q164-W188 HydrophobicContact CG-CZ2 3.57Å; Q164-W188 HydrophobicContact CG-CZ3 4.22Å; Q164-R190 PolarHBondContact O-NH2 3.37Å
165	T	98.1	Very high	97.8	Very high	52 Å²	52	57.8 Å²	57.8	32%	0.319	32%	0.315	S	S	.	.	S	Bend	trans	-112.3	148.1	-177.5	80.9	0	0	0	0	111	S167 D168 L169	T165-S167 PolarHBondContact O-N 3.36Å; T165-D168 PolarHBondContact O-N 3.31Å; T165-D168 WeakPolarHBondContact OG1-CB 3.36Å; T165-D168 PolarHBondContact OG1-N 3.3Å; T165-D168 PolarHBondContact OG1-OD2 3.19Å; T165-L169 WeakPolarHBondContact O-CB 3.42Å; T165-L169 WeakPolarHBondContact O-CG 3.35Å; T165-L169 PolarHBondContact O-N 3.48Å
166	V	97.9	Very high	97.8	Very high	31 Å²	31	54.5 Å²	54.5	19%	0.188	30%	0.304	C	S	.	.	H	α-helix	trans	-59.3	-38.4	174.2	175.1	0	0	0	0	111	C170 A180 V184 D192	V166-C170 WeakPolarHBondContact O-CB 3.48Å; V166-C170 PolarHBondContact O-N 2.98Å; V166-C170 PolarHBondContact O-SG 2.73Å; V166-A180 HydrophobicContact CB-CB 4.44Å; V166-A180 HydrophobicContact CG1-CB 3.82Å; V166-V184 HydrophobicContact CG2-CG2 3.92Å; V166-D192 HydrophobicContact CG2-CB 4.09Å
167	S	98.2	Very high	97.7	Very high	77 Å²	77	50 Å²	50	54%	0.538	29%	0.288	S	S	.	.	H	α-helix	trans	-61.5	-46.9	179.1	-174.2	0	0	0	0	111.8	T165 C170 K171	T165-S167 PolarHBondContact O-N 3.36Å; S167-C170 PolarHBondContact O-N 2.96Å; S167-K171 PolarHBondContact O-N 3.01Å
168	D	98.5	Very high	97.7	Very high	41 Å²	41	45.7 Å²	45.7	22%	0.219	27%	0.269	C	S	.	.	H	α-helix	trans	-72.5	-37.5	-178.4	-64.5	-38.9	0	0	0	112.3	Y158 P163 T165 C170 K171	Y158-D168 HydrophobicContact CE1-CB 4.44Å; P163-D168 HydrophobicContact CB-CB 3.51Å; P163-D168 HydrophobicContact CG-CB 4.18Å; T165-D168 PolarHBondContact O-N 3.31Å; T165-D168 WeakPolarHBondContact OG1-CB 3.36Å; T165-D168 PolarHBondContact OG1-N 3.3Å; T165-D168 PolarHBondContact OG1-OD2 3.19Å; D168-C170 VanDerWaalsContact C-N 3.29Å; D168-C170 PolarHBondContact O-N 3.17Å; D168-K171 WeakPolarHBondContact O-CB 3.47Å; D168-K171 PolarHBondContact O-N 3.49Å; D168-K171 VanDerWaalsContact O-N 3.08Å; D168-K171 IonicContact OD1-NZ 2.72Å; D168-K171 PolarHBondContact OD1-NZ 3.2Å
169	L	98.6	Very high	97.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.3	-41.2	172.7	-77.5	162.6	0	0	0	111.7	L91 P163 T165 K171 L172 V175 A180 T183 V184	L91-L169 HydrophobicContact CD1-CD2 4.38Å; P163-L169 HydrophobicContact CB-CD2 4.39Å; P163-L169 HydrophobicContact CB-CG 4.13Å; P163-L169 HydrophobicContact CG-CD2 4.22Å; P163-L169 HydrophobicContact CG-CG 4.38Å; T165-L169 WeakPolarHBondContact O-CB 3.42Å; T165-L169 WeakPolarHBondContact O-CG 3.35Å; T165-L169 PolarHBondContact O-N 3.48Å; L169-K171 PolarHBondContact O-N 3.45Å; L169-L172 HydrophobicContact CD2-CD1 4.1Å; L169-L172 WeakPolarHBondContact O-CB 3.34Å; L169-L172 PolarHBondContact O-N 2.9Å; L169-L172 VanDerWaalsContact O-N 3.08Å; L169-V175 HydrophobicContact CB-CG1 4.36Å; L169-V175 VanDerWaalsContact O-CB 3.31Å; L169-V175 WeakPolarHBondContact O-CB 3.38Å; L169-V175 VanDerWaalsContact O-CG1 3.22Å; L169-V175 WeakPolarHBondContact O-CG1 3.21Å; L169-A180 HydrophobicContact CB-CB 3.62Å; L169-A180 HydrophobicContact CD1-CB 4.32Å; L169-T183 HydrophobicContact CD1-CG2 3.84Å; L169-T183 HydrophobicContact CD2-CG2 3.92Å; L169-V184 HydrophobicContact CD1-CG2 3.52Å
170	C	98.2	Very high	97.7	Very high	49 Å²	49	37.4 Å²	37.4	33%	0.331	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-12	176.9	-74.9	0	0	0	0	114.4	V166 S167 D168 L172 V175 A180	V166-C170 WeakPolarHBondContact O-CB 3.48Å; V166-C170 PolarHBondContact O-N 2.98Å; V166-C170 PolarHBondContact O-SG 2.73Å; S167-C170 PolarHBondContact O-N 2.96Å; D168-C170 VanDerWaalsContact C-N 3.29Å; D168-C170 PolarHBondContact O-N 3.17Å; C170-L172 VanDerWaalsContact C-N 3.32Å; C170-V175 WeakPolarHBondContact CA-O 3.19Å; C170-A180 VanDerWaalsContact SG-CB 3.59Å
171	K	98.3	Very high	97.8	Very high	133 Å²	133	37.2 Å²	37.2	58%	0.578	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-13.1	173	-62.3	169.7	-169.7	163.2	0	112.2	S167 D168 L169	S167-K171 PolarHBondContact O-N 3.01Å; D168-K171 WeakPolarHBondContact O-CB 3.47Å; D168-K171 PolarHBondContact O-N 3.49Å; D168-K171 VanDerWaalsContact O-N 3.08Å; D168-K171 IonicContact OD1-NZ 2.72Å; D168-K171 PolarHBondContact OD1-NZ 3.2Å; L169-K171 PolarHBondContact O-N 3.45Å
172	L	98.5	Very high	97.8	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	22%	0.222	C	C	.	.	S	Bend	trans	-76.6	139.9	179.3	-58.9	175.2	0	0	0	111.1	L91 T150 I153 L154 P163 L169 C170 G174 V175	L91-L172 HydrophobicContact CD2-CD1 3.96Å; T150-L172 HydrophobicContact CG2-CB 4.23Å; T150-L172 HydrophobicContact CG2-CD1 3.99Å; T150-L172 HydrophobicContact CG2-CD2 4.26Å; T150-L172 HydrophobicContact CG2-CG 4.39Å; I153-L172 HydrophobicContact CB-CD2 4.29Å; I153-L172 HydrophobicContact CG2-CD2 3.7Å; L154-L172 HydrophobicContact CD2-CD1 4.06Å; L154-L172 HydrophobicContact CD2-CD2 4.04Å; P163-L172 HydrophobicContact CG-CD1 4.13Å; L169-L172 HydrophobicContact CD2-CD1 4.1Å; L169-L172 WeakPolarHBondContact O-CB 3.34Å; L169-L172 PolarHBondContact O-N 2.9Å; L169-L172 VanDerWaalsContact O-N 3.08Å; C170-L172 VanDerWaalsContact C-N 3.32Å; L172-G174 PolarHBondContact O-N 2.95Å; L172-V175 HydrophobicContact CB-CB 4.06Å; L172-V175 HydrophobicContact CB-CG2 3.75Å; L172-V175 HydrophobicContact CD1-CG2 4.49Å; L172-V175 PolarHBondContact O-N 2.96Å; L172-V175 VanDerWaalsContact O-N 3.08Å
173	P	97.8	Very high	97.7	Very high	33 Å²	33	36.6 Å²	36.6	21%	0.214	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	122.9	178.6	-28.5	34.9	0	0	0	113.1	M95 A146 E149 T150 I153 V175	M95-P173 WeakPolarHBondContact CE-O 3.11Å; A146-P173 HydrophobicContact CB-CB 4.12Å; E149-P173 HydrophobicContact CB-CB 4.44Å; E149-P173 HydrophobicContact CB-CG 3.91Å; T150-P173 WeakPolarHBondContact OG1-CD 3.43Å; T150-P173 PolarHBondContact OG1-O 3.46Å; I153-P173 HydrophobicContact CD1-CG 4.04Å; P173-V175 VanDerWaalsContact C-N 3.27Å; P173-V175 PolarHBondContact O-N 3.25Å
174	G	96	Very high	97.7	Very high	60 Å²	60	36.4 Å²	36.4	62%	0.619	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.7	1.3	177.7	0	0	0	0	0	115.7	L172	L172-G174 PolarHBondContact O-N 2.95Å
175	V	97.8	Very high	97.6	Very high	9 Å²	9	32 Å²	32	6%	0.055	20%	0.2	C	C	.	.			trans	-95.3	108.9	178.4	-177.8	0	0	0	0	110.2	L91 M95 L169 C170 L172 P173 M179 A180	L91-V175 HydrophobicContact CD1-CG2 4.11Å; M95-V175 HydrophobicContact CG-CG2 3.98Å; M95-V175 HydrophobicContact SD-CG2 4.23Å; L169-V175 HydrophobicContact CB-CG1 4.36Å; L169-V175 VanDerWaalsContact O-CB 3.31Å; L169-V175 WeakPolarHBondContact O-CB 3.38Å; L169-V175 VanDerWaalsContact O-CG1 3.22Å; L169-V175 WeakPolarHBondContact O-CG1 3.21Å; C170-V175 WeakPolarHBondContact CA-O 3.19Å; L172-V175 HydrophobicContact CB-CB 4.06Å; L172-V175 HydrophobicContact CB-CG2 3.75Å; L172-V175 HydrophobicContact CD1-CG2 4.49Å; L172-V175 PolarHBondContact O-N 2.96Å; L172-V175 VanDerWaalsContact O-N 3.08Å; P173-V175 VanDerWaalsContact C-N 3.27Å; P173-V175 PolarHBondContact O-N 3.25Å; V175-M179 HydrophobicContact CG1-CB 3.95Å; V175-A180 HydrophobicContact CG1-CB 4.41Å
176	G	96.4	Very high	97.5	Very high	28 Å²	28	32 Å²	32	29%	0.289	20%	0.198	S	C	.	.			trans	-96.2	174	176.5	0	0	0	0	0	114.1	K178 M179 A180	G176-K178 VanDerWaalsContact C-N 3.28Å; G176-K178 PolarHBondContact O-N 3.22Å; G176-K178 VanDerWaalsContact O-N 3.14Å; G176-M179 WeakPolarHBondContact O-CB 3.32Å; G176-M179 PolarHBondContact O-N 2.94Å; G176-A180 PolarHBondContact O-N 3.32Å
177	P	97.2	Very high	97.4	Very high	55 Å²	55	31.6 Å²	31.6	36%	0.357	20%	0.197	S	C	.	.	H	α-helix	trans	-53.1	-39.1	-176.9	-29	35.1	0	0	0	114.7	M179 A180 N181	P177-M179 PolarHBondContact O-N 3.45Å; P177-A180 PolarHBondContact O-N 3Å; P177-N181 WeakPolarHBondContact O-CB 3.25Å; P177-N181 PolarHBondContact O-N 3.49Å; P177-N181 PolarHBondContact O-ND2 3.47Å
178	K	97	Very high	97.3	Very high	45 Å²	45	30.7 Å²	30.7	20%	0.196	18%	0.182	C	C	.	.	H	α-helix	trans	-58.6	-47.4	175	177	-88.5	-171.5	-169.2	0	111.9	G176 L182 V196 D197	G176-K178 VanDerWaalsContact C-N 3.28Å; G176-K178 PolarHBondContact O-N 3.22Å; G176-K178 VanDerWaalsContact O-N 3.14Å; K178-L182 HydrophobicContact CD-CD1 3.73Å; K178-L182 HydrophobicContact CG-CD1 4.32Å; K178-L182 VanDerWaalsContact NZ-CD1 3.29Å; K178-L182 WeakPolarHBondContact O-CG 3.18Å; K178-L182 PolarHBondContact O-N 2.88Å; K178-V196 WeakPolarHBondContact CB-O 3.45Å; K178-V196 WeakPolarHBondContact CG-O 3.23Å; K178-D197 HydrophobicContact CD-CB 4.43Å; K178-D197 HydrophobicContact CG-CB 4.11Å
179	M	97.3	Very high	97.1	Very high	17 Å²	17	39 Å²	39	8%	0.084	21%	0.21	C	C	.	.	H	α-helix	trans	-67.8	-48.3	-178	-64.2	177.1	-174.3	0	0	109.5	L94 S98 V175 G176 P177 N181 L182 T183	L94-M179 HydrophobicContact CB-CB 4.47Å; L94-M179 HydrophobicContact CB-CG 4.42Å; L94-M179 WeakPolarHBondContact O-CE 3.4Å; S98-M179 VanDerWaalsContact CB-CE 3.47Å; V175-M179 HydrophobicContact CG1-CB 3.95Å; G176-M179 WeakPolarHBondContact O-CB 3.32Å; G176-M179 PolarHBondContact O-N 2.94Å; P177-M179 PolarHBondContact O-N 3.45Å; M179-N181 PolarHBondContact O-N 3.25Å; M179-L182 PolarHBondContact O-N 3.23Å; M179-T183 WeakPolarHBondContact O-CB 3.42Å; M179-T183 PolarHBondContact O-N 3.29Å; M179-T183 PolarHBondContact O-OG1 2.93Å
180	A	98.1	Very high	97	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-55.7	-47.5	179.9	0	0	0	0	0	112.5	V166 L169 C170 V175 G176 P177 T183 V184	V166-A180 HydrophobicContact CB-CB 4.44Å; V166-A180 HydrophobicContact CG1-CB 3.82Å; L169-A180 HydrophobicContact CB-CB 3.62Å; L169-A180 HydrophobicContact CD1-CB 4.32Å; C170-A180 VanDerWaalsContact SG-CB 3.59Å; V175-A180 HydrophobicContact CG1-CB 4.41Å; G176-A180 PolarHBondContact O-N 3.32Å; P177-A180 PolarHBondContact O-N 3Å; A180-T183 WeakPolarHBondContact O-CB 3.29Å; A180-T183 PolarHBondContact O-N 3.16Å; A180-V184 WeakPolarHBondContact O-CG2 3.3Å; A180-V184 PolarHBondContact O-N 2.84Å
181	N	98.1	Very high	96.9	Very high	6 Å²	6	43.6 Å²	43.6	3%	0.032	23%	0.226	C	C	.	.	H	α-helix	trans	-61.9	-45.8	177	-80	-73.2	0	0	0	112.5	P177 M179 T183 V184 Q185 G193	P177-N181 WeakPolarHBondContact O-CB 3.25Å; P177-N181 PolarHBondContact O-N 3.49Å; P177-N181 PolarHBondContact O-ND2 3.47Å; M179-N181 PolarHBondContact O-N 3.25Å; N181-T183 VanDerWaalsContact C-N 3.33Å; N181-T183 PolarHBondContact O-N 3.14Å; N181-V184 PolarHBondContact O-N 3.41Å; N181-Q185 VanDerWaalsContact O-CB 3.27Å; N181-Q185 WeakPolarHBondContact O-CB 3.4Å; N181-Q185 PolarHBondContact O-N 2.75Å; N181-G193 VanDerWaalsContact OD1-CA 3.25Å; N181-G193 WeakPolarHBondContact OD1-CA 3.27Å; N181-G193 PolarHBondContact OD1-N 3.33Å
182	L	97.3	Very high	96.8	Very high	13 Å²	13	40.5 Å²	40.5	7%	0.068	22%	0.216	C	C	.	.	H	α-helix	trans	-65.2	-37.7	177.8	-69.2	175.1	0	0	0	112.2	L94 K178 M179 Q185 I186 N237	L94-L182 HydrophobicContact CD1-CB 4.24Å; L94-L182 HydrophobicContact CD2-CB 4.19Å; L94-L182 HydrophobicContact CD2-CD1 4.04Å; K178-L182 HydrophobicContact CD-CD1 3.73Å; K178-L182 HydrophobicContact CG-CD1 4.32Å; K178-L182 VanDerWaalsContact NZ-CD1 3.29Å; K178-L182 WeakPolarHBondContact O-CG 3.18Å; K178-L182 PolarHBondContact O-N 2.88Å; M179-L182 PolarHBondContact O-N 3.23Å; L182-Q185 PolarHBondContact O-N 3.28Å; L182-I186 WeakPolarHBondContact O-CD1 3.33Å; L182-I186 VanDerWaalsContact O-CG1 3.28Å; L182-I186 WeakPolarHBondContact O-CG1 3.49Å; L182-I186 PolarHBondContact O-N 3.3Å; L182-N237 HydrophobicContact CD2-CB 4.27Å
183	T	97.3	Very high	96.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-53.5	174.7	-62.6	0	0	0	0	110	L94 I162 L169 M179 A180 N181 Q185 I186 A187	L94-T183 WeakPolarHBondContact CD1-OG1 3.33Å; I162-T183 HydrophobicContact CD1-CG2 3.44Å; I162-T183 VanDerWaalsContact CD1-CG2 3.44Å; L169-T183 HydrophobicContact CD1-CG2 3.84Å; L169-T183 HydrophobicContact CD2-CG2 3.92Å; M179-T183 WeakPolarHBondContact O-CB 3.42Å; M179-T183 PolarHBondContact O-N 3.29Å; M179-T183 PolarHBondContact O-OG1 2.93Å; A180-T183 WeakPolarHBondContact O-CB 3.29Å; A180-T183 PolarHBondContact O-N 3.16Å; N181-T183 VanDerWaalsContact C-N 3.33Å; N181-T183 PolarHBondContact O-N 3.14Å; T183-Q185 VanDerWaalsContact C-N 3.3Å; T183-Q185 PolarHBondContact O-N 2.9Å; T183-I186 PolarHBondContact O-N 2.82Å; T183-A187 HydrophobicContact CG2-CB 4.41Å; T183-A187 WeakPolarHBondContact O-CB 3.36Å; T183-A187 PolarHBondContact O-N 3.09Å
184	V	97.8	Very high	96.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.6	-41.3	179.1	178.4	0	0	0	0	111.9	V166 L169 A180 N181 I186 W188 R189 R190	V166-V184 HydrophobicContact CG2-CG2 3.92Å; L169-V184 HydrophobicContact CD1-CG2 3.52Å; A180-V184 WeakPolarHBondContact O-CG2 3.3Å; A180-V184 PolarHBondContact O-N 2.84Å; N181-V184 PolarHBondContact O-N 3.41Å; V184-I186 VanDerWaalsContact C-N 3.3Å; V184-I186 PolarHBondContact O-N 2.72Å; V184-W188 HydrophobicContact CG1-CB 4.3Å; V184-W188 CarbonylContact O-C 3.49Å; V184-W188 WeakPolarHBondContact O-CA 3.49Å; V184-W188 WeakPolarHBondContact O-CB 3.5Å; V184-W188 PolarHBondContact O-N 2.98Å; V184-W188 VanDerWaalsContact O-N 3.1Å; V184-R189 PolarHBondContact O-N 3.11Å; V184-R190 CarbonylContact C-O 3.49Å; V184-R190 HydrophobicContact CG1-CB 4.06Å; V184-R190 PolarHBondContact O-N 3.32Å
185	Q	96.2	Very high	96.8	Very high	18 Å²	18	35.9 Å²	35.9	8%	0.084	18%	0.176	C	C	.	.	H	α-helix	trans	-57.2	-41.2	178	-172.1	-173.5	-37.9	0	0	113.6	N181 L182 T183 R189 R190 R234	N181-Q185 VanDerWaalsContact O-CB 3.27Å; N181-Q185 WeakPolarHBondContact O-CB 3.4Å; N181-Q185 PolarHBondContact O-N 2.75Å; L182-Q185 PolarHBondContact O-N 3.28Å; T183-Q185 VanDerWaalsContact C-N 3.3Å; T183-Q185 PolarHBondContact O-N 2.9Å; Q185-R189 WeakPolarHBondContact O-CA 3.47Å; Q185-R190 WeakPolarHBondContact CA-O 3.34Å; Q185-R190 PolarHBondContact N-O 3.48Å; Q185-R234 HydrophobicContact CG-CG 3.93Å; Q185-R234 PolarHBondContact NE2-O 3.26Å; Q185-R234 PolarHBondContact O-NH1 3.5Å
186	I	94.7	Very high	96.8	Very high	54 Å²	54	35.7 Å²	35.7	28%	0.277	18%	0.175	S	C	.	.	H	α-helix	trans	-93.9	-55.3	-173.5	-59.1	161.6	0	0	0	110.3	C74 L90 L182 T183 V184	C74-I186 HydrophobicContact CB-CD1 3.72Å; C74-I186 HydrophobicContact CB-CG1 4.39Å; L90-I186 HydrophobicContact CD1-CB 4.37Å; L90-I186 HydrophobicContact CD1-CD1 3.99Å; L90-I186 HydrophobicContact CD1-CG2 3.99Å; L90-I186 HydrophobicContact CD2-CB 3.71Å; L90-I186 HydrophobicContact CD2-CG2 3.64Å; L90-I186 HydrophobicContact CG-CG2 4.46Å; L182-I186 WeakPolarHBondContact O-CD1 3.33Å; L182-I186 VanDerWaalsContact O-CG1 3.28Å; L182-I186 WeakPolarHBondContact O-CG1 3.49Å; L182-I186 PolarHBondContact O-N 3.3Å; T183-I186 PolarHBondContact O-N 2.82Å; V184-I186 VanDerWaalsContact C-N 3.3Å; V184-I186 PolarHBondContact O-N 2.72Å
187	A	95.4	Very high	96.8	Very high	21 Å²	21	35.7 Å²	35.7	17%	0.174	17%	0.168	C	C	.	.	H	α-helix	trans	-64.6	-46.3	-176.6	0	0	0	0	0	112.9	R87 L90 I162 T183	R87-A187 HydrophobicContact CB-CB 4.47Å; R87-A187 HydrophobicContact CG-CB 3.74Å; L90-A187 HydrophobicContact CD2-CB 3.88Å; I162-A187 HydrophobicContact CD1-CB 3.76Å; T183-A187 HydrophobicContact CG2-CB 4.41Å; T183-A187 WeakPolarHBondContact O-CB 3.36Å; T183-A187 PolarHBondContact O-N 3.09Å
188	W	96.4	Very high	96.7	Very high	58 Å²	58	37.5 Å²	37.5	22%	0.22	18%	0.178	C	C	.	.	S	Bend	trans	-103.4	3	-172.8	-56.6	120.1	0	0	0	112.7	R87 I162 P163 Q164 V184 R190	R87-W188 VanDerWaalsContact CD-CZ2 3.46Å; I162-W188 HydrophobicContact CG1-CZ2 3.83Å; I162-W188 WeakPolarHBondContact O-CZ2 3.43Å; P163-W188 PolarHBondContact O-NE1 2.73Å; Q164-W188 HydrophobicContact CG-CD2 4.02Å; Q164-W188 HydrophobicContact CG-CE3 4.29Å; Q164-W188 HydrophobicContact CG-CH2 3.86Å; Q164-W188 HydrophobicContact CG-CZ2 3.57Å; Q164-W188 HydrophobicContact CG-CZ3 4.22Å; V184-W188 HydrophobicContact CG1-CB 4.3Å; V184-W188 CarbonylContact O-C 3.49Å; V184-W188 WeakPolarHBondContact O-CA 3.49Å; V184-W188 WeakPolarHBondContact O-CB 3.5Å; V184-W188 PolarHBondContact O-N 2.98Å; V184-W188 VanDerWaalsContact O-N 3.1Å; W188-R190 PolarHBondContact O-N 2.82Å
189	R	94.9	Very high	96.7	Very high	215 Å²	215	37.1 Å²	37.1	81%	0.811	18%	0.177	S	C	*	.			trans	52.5	23.5	-179.4	-56.7	-177.4	-179.8	-166.5	0.5	113.4	V184 Q185 R234	V184-R189 PolarHBondContact O-N 3.11Å; Q185-R189 WeakPolarHBondContact O-CA 3.47Å; R189-R234 PolarHBondContact O-NH2 3.44Å
190	R	96.4	Very high	96.8	Very high	104 Å²	104	36.3 Å²	36.3	39%	0.392	17%	0.173	S	C	.	.			trans	-115.3	139.3	-177.4	-165.8	179.2	67.7	-151.1	-7	110.9	Q164 V184 Q185 W188 D192	Q164-R190 PolarHBondContact O-NH2 3.37Å; V184-R190 CarbonylContact C-O 3.49Å; V184-R190 HydrophobicContact CG1-CB 4.06Å; V184-R190 PolarHBondContact O-N 3.32Å; Q185-R190 WeakPolarHBondContact CA-O 3.34Å; Q185-R190 PolarHBondContact N-O 3.48Å; W188-R190 PolarHBondContact O-N 2.82Å; R190-D192 VanDerWaalsContact CD-OD1 3.29Å; R190-D192 WeakPolarHBondContact CD-OD1 3.08Å; R190-D192 VanDerWaalsContact CG-OD1 3.25Å; R190-D192 WeakPolarHBondContact CG-OD1 3.42Å; R190-D192 IonicContact CZ-OD1 2.67Å; R190-D192 IonicContact CZ-OD2 3.35Å; R190-D192 VanDerWaalsContact CZ-OD2 3.29Å; R190-D192 VanDerWaalsContact NE-CG 3.31Å; R190-D192 IonicContact NE-OD1 3.34Å; R190-D192 PolarHBondContact NE-OD1 3.06Å; R190-D192 IonicContact NE-OD2 3.72Å; R190-D192 PolarHBondContact NE-OD2 3Å; R190-D192 VanDerWaalsContact NE-OD2 3.09Å; R190-D192 IonicContact NH2-OD1 3.76Å; R190-D192 IonicContact NH2-OD2 3.17Å; R190-D192 PolarHBondContact NH2-OD2 3.01Å
191	C	95.7	Very high	96.8	Very high	42 Å²	42	38 Å²	38	28%	0.284	18%	0.181	S	C	.	.			trans	-109.3	90.8	-177.5	-164.1	0	0	0	0	110.3	W233	C191-W233 VanDerWaalsContact SG-CB 3.6Å
192	D	95.6	Very high	96.8	Very high	68 Å²	68	39.7 Å²	39.7	36%	0.364	19%	0.187	S	C	.	.			trans	-87.8	-17.4	-178.2	-62.3	-6.7	0	0	0	112.7	V166 R190	V166-D192 HydrophobicContact CG2-CB 4.09Å; R190-D192 VanDerWaalsContact CD-OD1 3.29Å; R190-D192 WeakPolarHBondContact CD-OD1 3.08Å; R190-D192 VanDerWaalsContact CG-OD1 3.25Å; R190-D192 WeakPolarHBondContact CG-OD1 3.42Å; R190-D192 IonicContact CZ-OD1 2.67Å; R190-D192 IonicContact CZ-OD2 3.35Å; R190-D192 VanDerWaalsContact CZ-OD2 3.29Å; R190-D192 VanDerWaalsContact NE-CG 3.31Å; R190-D192 IonicContact NE-OD1 3.34Å; R190-D192 PolarHBondContact NE-OD1 3.06Å; R190-D192 IonicContact NE-OD2 3.72Å; R190-D192 PolarHBondContact NE-OD2 3Å; R190-D192 VanDerWaalsContact NE-OD2 3.09Å; R190-D192 IonicContact NH2-OD1 3.76Å; R190-D192 IonicContact NH2-OD2 3.17Å; R190-D192 PolarHBondContact NH2-OD2 3.01Å
193	G	97.3	Very high	96.9	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.184	C	C	.	.	S	Bend	trans	-178.9	177.6	-178	0	0	0	0	0	112.3	N181 E225	N181-G193 VanDerWaalsContact OD1-CA 3.25Å; N181-G193 WeakPolarHBondContact OD1-CA 3.27Å; N181-G193 PolarHBondContact OD1-N 3.33Å; G193-E225 WeakPolarHBondContact CA-OE1 3.34Å
194	I	98.1	Very high	97	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.184	C	C	.	.			trans	-91.9	127.6	-175.5	-57.5	173.2	0	0	0	110.2	V196 R221 L224 E225 L228 W233 I236	I194-V196 HydrophobicContact CB-CG2 4.36Å; I194-V196 HydrophobicContact CG2-CG2 3.84Å; I194-V196 PolarHBondContact O-N 2.83Å; I194-V196 VanDerWaalsContact O-N 3.11Å; I194-R221 HydrophobicContact CB-CG 4.34Å; I194-R221 VanDerWaalsContact O-CD 3.3Å; I194-R221 WeakPolarHBondContact O-CD 3.49Å; I194-R221 WeakPolarHBondContact O-CG 3.49Å; I194-L224 HydrophobicContact CD1-CB 3.7Å; I194-E225 HydrophobicContact CB-CG 4.44Å; I194-E225 HydrophobicContact CD1-CG 3.74Å; I194-E225 HydrophobicContact CG1-CG 3.84Å; I194-E225 PolarHBondContact N-OE1 2.67Å; I194-L228 HydrophobicContact CD1-CD2 3.98Å; I194-W233 HydrophobicContact CD1-CD2 4.25Å; I194-W233 HydrophobicContact CD1-CG 3.96Å; I194-W233 HydrophobicContact CG1-CB 3.87Å; I194-W233 HydrophobicContact CG1-CD2 3.88Å; I194-W233 HydrophobicContact CG1-CE3 4.39Å; I194-W233 HydrophobicContact CG1-CG 3.63Å; I194-I236 HydrophobicContact CG2-CG2 3.56Å
195	G	97	Very high	97	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.01	19%	0.192	C	C	.	.			trans	-70.1	102	166.7	0	0	0	0	0	111	N237	G195-N237 VanDerWaalsContact O-CB 3.31Å; G195-N237 WeakPolarHBondContact O-CB 3.42Å; G195-N237 PolarHBondContact O-ND2 3.41Å
196	V	98.1	Very high	97.1	Very high	5 Å²	5	41.1 Å²	41.1	3%	0.03	19%	0.193	C	C	.	.			trans	-102.9	113.3	177.3	179.5	0	0	0	0	111	K178 I194 V200 H201 P217 T220 R221 L224	K178-V196 WeakPolarHBondContact CB-O 3.45Å; K178-V196 WeakPolarHBondContact CG-O 3.23Å; I194-V196 HydrophobicContact CB-CG2 4.36Å; I194-V196 HydrophobicContact CG2-CG2 3.84Å; I194-V196 PolarHBondContact O-N 2.83Å; I194-V196 VanDerWaalsContact O-N 3.11Å; V196-V200 HydrophobicContact CB-CB 4.47Å; V196-V200 HydrophobicContact CB-CG1 4.24Å; V196-V200 HydrophobicContact CG1-CB 3.95Å; V196-V200 HydrophobicContact CG1-CG1 3.86Å; V196-V200 HydrophobicContact CG2-CG1 3.92Å; V196-H201 HydrophobicContact CG1-CB 4.06Å; V196-P217 HydrophobicContact CG1-CB 3.98Å; V196-P217 WeakPolarHBondContact CG1-O 3.46Å; V196-T220 HydrophobicContact CG1-CG2 4.19Å; V196-R221 HydrophobicContact CB-CB 4.15Å; V196-R221 HydrophobicContact CG2-CB 3.63Å; V196-R221 HydrophobicContact CG2-CG 4.04Å; V196-L224 HydrophobicContact CG2-CD1 4.17Å
197	D	96.2	Very high	97.3	Very high	28 Å²	28	39.3 Å²	39.3	15%	0.15	18%	0.184	C	C	.	.			trans	-102.9	-171.3	171.5	77.5	-4.7	0	0	0	111.8	K178 H199 V200 H201 V241	K178-D197 HydrophobicContact CD-CB 4.43Å; K178-D197 HydrophobicContact CG-CB 4.11Å; D197-H199 PolarHBondContact O-N 3.19Å; D197-H199 WeakPolarHBondContact OD1-CA 3.47Å; D197-H199 WeakPolarHBondContact OD1-CB 3.44Å; D197-H199 PolarHBondContact OD1-N 2.7Å; D197-H199 IonicContact OD2-CD2 3.67Å; D197-V200 PolarHBondContact O-N 3.42Å; D197-V200 WeakPolarHBondContact OD1-CG2 3.27Å; D197-V200 PolarHBondContact OD1-N 2.88Å; D197-H201 WeakPolarHBondContact O-CB 3.28Å; D197-H201 PolarHBondContact O-N 3Å; D197-V241 WeakPolarHBondContact OD2-CG2 3.32Å
198	T	96.3	Very high	97.3	Very high	92 Å²	92	39.5 Å²	39.5	56%	0.564	19%	0.188	S	C	*	.	H	α-helix	trans	-65.4	-25.5	-179.9	57.2	0	0	0	0	113.5	R202	T198-R202 WeakPolarHBondContact O-CB 3.34Å; T198-R202 PolarHBondContact O-N 2.92Å; T198-R202 VanDerWaalsContact O-N 3.16Å
199	H	97.6	Very high	97.4	Very high	38 Å²	38	36.9 Å²	36.9	18%	0.176	18%	0.178	C	C	.	.	H	α-helix	trans	-73.9	-53.2	174.4	-66.9	-99.4	0	0	0	110.2	D197 H201 R202 I203 V241	D197-H199 PolarHBondContact O-N 3.19Å; D197-H199 WeakPolarHBondContact OD1-CA 3.47Å; D197-H199 WeakPolarHBondContact OD1-CB 3.44Å; D197-H199 PolarHBondContact OD1-N 2.7Å; D197-H199 IonicContact OD2-CD2 3.67Å; H199-H201 VanDerWaalsContact C-N 3.31Å; H199-H201 PolarHBondContact O-N 3.16Å; H199-R202 PolarHBondContact ND1-NH2 3.16Å; H199-R202 PolarHBondContact O-N 3.02Å; H199-I203 WeakPolarHBondContact O-CB 3.32Å; H199-I203 WeakPolarHBondContact O-CD1 3.43Å; H199-I203 WeakPolarHBondContact O-CG1 3.41Å; H199-I203 PolarHBondContact O-N 2.89Å; H199-V241 HydrophobicContact CB-CG2 4.14Å
200	V	98.4	Very high	97.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-58.2	-46.1	178.5	179.9	0	0	0	0	110.3	V196 D197 I203 S204 L224 N237 L240	V196-V200 HydrophobicContact CB-CB 4.47Å; V196-V200 HydrophobicContact CB-CG1 4.24Å; V196-V200 HydrophobicContact CG1-CB 3.95Å; V196-V200 HydrophobicContact CG1-CG1 3.86Å; V196-V200 HydrophobicContact CG2-CG1 3.92Å; D197-V200 PolarHBondContact O-N 3.42Å; D197-V200 WeakPolarHBondContact OD1-CG2 3.27Å; D197-V200 PolarHBondContact OD1-N 2.88Å; V200-I203 PolarHBondContact O-N 3.04Å; V200-S204 VanDerWaalsContact O-CB 3.25Å; V200-S204 WeakPolarHBondContact O-CB 3.33Å; V200-S204 PolarHBondContact O-N 3Å; V200-S204 PolarHBondContact O-OG 3.14Å; V200-L224 HydrophobicContact CG1-CD1 3.92Å; V200-N237 HydrophobicContact CG2-CB 4.39Å; V200-L240 HydrophobicContact CG1-CD1 4.04Å; V200-L240 HydrophobicContact CG2-CB 4.1Å
201	H	98.6	Very high	97.5	Very high	36 Å²	36	26 Å²	26	17%	0.167	15%	0.148	C	C	.	.	H	α-helix	trans	-56.1	-56.5	176.6	173.1	62.6	0	0	0	112	V196 D197 H199 I203 S204 N205 T214 T216 P217 T220	V196-H201 HydrophobicContact CG1-CB 4.06Å; D197-H201 WeakPolarHBondContact O-CB 3.28Å; D197-H201 PolarHBondContact O-N 3Å; H199-H201 VanDerWaalsContact C-N 3.31Å; H199-H201 PolarHBondContact O-N 3.16Å; H201-I203 PolarHBondContact O-N 3.37Å; H201-S204 PolarHBondContact O-N 3.49Å; H201-N205 PolarHBondContact CE1-ND2 3.4Å; H201-N205 PolarHBondContact ND1-ND2 3.11Å; H201-N205 PolarHBondContact O-N 3.19Å; H201-N205 PolarHBondContact O-ND2 2.59Å; H201-T214 PolarHBondContact CE1-O 3.33Å; H201-T214 VanDerWaalsContact CE1-O 3.24Å; H201-T216 PolarHBondContact ND1-O 3.25Å; H201-P217 HydrophobicContact CB-CB 4.39Å; H201-P217 HydrophobicContact CB-CG 4.29Å; H201-T220 PolarHBondContact ND1-OG1 2.89Å
202	R	98.5	Very high	97.4	Very high	40 Å²	40	32.2 Å²	32.2	15%	0.151	17%	0.17	C	C	.	.	H	α-helix	trans	-59.1	-47.7	-179.6	179.1	-175.4	72.1	-112.4	6.1	111.8	T198 H199 N205 R206 G244 C248	T198-R202 WeakPolarHBondContact O-CB 3.34Å; T198-R202 PolarHBondContact O-N 2.92Å; T198-R202 VanDerWaalsContact O-N 3.16Å; H199-R202 PolarHBondContact ND1-NH2 3.16Å; H199-R202 PolarHBondContact O-N 3.02Å; R202-N205 PolarHBondContact O-N 3.23Å; R202-R206 WeakPolarHBondContact O-CG 3.13Å; R202-R206 PolarHBondContact O-N 3.43Å; R202-G244 PolarHBondContact NH2-O 3.37Å; R202-C248 PolarHBondContact NE-O 2.74Å; R202-C248 PolarHBondContact NH2-O 3.21Å
203	I	98.6	Very high	97.5	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-69.4	-40.7	-173.7	-66.2	167.8	0	0	0	110.5	H199 V200 H201 N205 R206 L207 L240 F243 C248	H199-I203 WeakPolarHBondContact O-CB 3.32Å; H199-I203 WeakPolarHBondContact O-CD1 3.43Å; H199-I203 WeakPolarHBondContact O-CG1 3.41Å; H199-I203 PolarHBondContact O-N 2.89Å; V200-I203 PolarHBondContact O-N 3.04Å; H201-I203 PolarHBondContact O-N 3.37Å; I203-N205 VanDerWaalsContact C-N 3.34Å; I203-N205 PolarHBondContact O-N 2.97Å; I203-R206 PolarHBondContact O-N 2.95Å; I203-R206 VanDerWaalsContact O-N 3.16Å; I203-L207 HydrophobicContact CG2-CD1 3.57Å; I203-L207 HydrophobicContact CG2-CG 4Å; I203-L207 WeakPolarHBondContact O-CB 3.42Å; I203-L207 VanDerWaalsContact O-CG 3.27Å; I203-L207 WeakPolarHBondContact O-CG 3.38Å; I203-L207 PolarHBondContact O-N 3.36Å; I203-L240 HydrophobicContact CD1-CB 4.32Å; I203-L240 WeakPolarHBondContact CD1-O 3.14Å; I203-L240 HydrophobicContact CG2-CD2 4Å; I203-F243 HydrophobicContact CD1-CD1 3.94Å; I203-F243 HydrophobicContact CG2-CD1 4.14Å; I203-F243 HydrophobicContact CG2-CE1 4.24Å; I203-C248 HydrophobicContact CD1-CB 4.25Å; I203-C248 HydrophobicContact CG1-CB 4.15Å
204	S	98.7	Very high	97.5	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.9	-41.9	177.8	-55	0	0	0	0	111.7	V200 H201 L207 G208 W209	V200-S204 VanDerWaalsContact O-CB 3.25Å; V200-S204 WeakPolarHBondContact O-CB 3.33Å; V200-S204 PolarHBondContact O-N 3Å; V200-S204 PolarHBondContact O-OG 3.14Å; H201-S204 PolarHBondContact O-N 3.49Å; S204-L207 PolarHBondContact O-N 2.92Å; S204-G208 PolarHBondContact O-N 3.48Å; S204-W209 WeakPolarHBondContact O-CB 3.43Å; S204-W209 PolarHBondContact O-N 3.42Å
205	N	98.6	Very high	97.5	Very high	34 Å²	34	44.1 Å²	44.1	18%	0.182	23%	0.227	C	C	.	.	H	α-helix	trans	-63.2	-44	173.2	-75.3	-78.2	0	0	0	111.9	H201 R202 I203 L207 G208 V210 T214	H201-N205 PolarHBondContact CE1-ND2 3.4Å; H201-N205 PolarHBondContact ND1-ND2 3.11Å; H201-N205 PolarHBondContact O-N 3.19Å; H201-N205 PolarHBondContact O-ND2 2.59Å; R202-N205 PolarHBondContact O-N 3.23Å; I203-N205 VanDerWaalsContact C-N 3.34Å; I203-N205 PolarHBondContact O-N 2.97Å; N205-L207 VanDerWaalsContact C-N 3.33Å; N205-L207 PolarHBondContact O-N 2.94Å; N205-G208 PolarHBondContact O-N 2.93Å; N205-V210 WeakPolarHBondContact OD1-CG2 3.42Å; N205-T214 PolarHBondContact ND2-OG1 2.86Å; N205-T214 PolarHBondContact OD1-N 3.22Å; N205-T214 PolarHBondContact OD1-OG1 3.04Å
206	R	98.1	Very high	97.5	Very high	28 Å²	28	46.9 Å²	46.9	11%	0.106	24%	0.244	C	C	.	.	H	α-helix	trans	-62.7	-36.1	177.9	-73.8	-179.2	177.1	178.3	-3.4	113.9	R202 I203 G208 C248 V249 P250 Y266	R202-R206 WeakPolarHBondContact O-CG 3.13Å; R202-R206 PolarHBondContact O-N 3.43Å; I203-R206 PolarHBondContact O-N 2.95Å; I203-R206 VanDerWaalsContact O-N 3.16Å; R206-G208 VanDerWaalsContact C-N 3.3Å; R206-C248 PolarHBondContact NH1-SG 2.94Å; R206-C248 VanDerWaalsContact NH1-SG 3.41Å; R206-V249 PolarHBondContact NH1-O 3.1Å; R206-P250 PolarHBondContact NH2-O 2.97Å; R206-Y266 HydrophobicContact CB-CD2 4.38Å; R206-Y266 HydrophobicContact CB-CG 4.04Å; R206-Y266 HydrophobicContact CG-CD1 4.34Å; R206-Y266 HydrophobicContact CG-CD2 3.68Å; R206-Y266 HydrophobicContact CG-CE2 4.25Å; R206-Y266 HydrophobicContact CG-CG 3.72Å; R206-Y266 WeakPolarHBondContact O-CB 3.44Å; R206-Y266 PolarHBondContact O-N 3.48Å
207	L	98	Very high	97.5	Very high	16 Å²	16	49 Å²	49	8%	0.084	26%	0.258	C	S	.	.	H	α-helix	trans	-80.2	-10.1	179.9	-67.9	176.5	0	0	0	113	V53 I57 I203 S204 N205 W209 C264 P265	V53-L207 HydrophobicContact CG1-CD1 3.82Å; V53-L207 HydrophobicContact CG1-CD2 3.74Å; V53-L207 HydrophobicContact CG1-CG 4.31Å; I57-L207 HydrophobicContact CD1-CD1 4.02Å; I203-L207 HydrophobicContact CG2-CD1 3.57Å; I203-L207 HydrophobicContact CG2-CG 4Å; I203-L207 WeakPolarHBondContact O-CB 3.42Å; I203-L207 VanDerWaalsContact O-CG 3.27Å; I203-L207 WeakPolarHBondContact O-CG 3.38Å; I203-L207 PolarHBondContact O-N 3.36Å; S204-L207 PolarHBondContact O-N 2.92Å; N205-L207 VanDerWaalsContact C-N 3.33Å; N205-L207 PolarHBondContact O-N 2.94Å; L207-W209 VanDerWaalsContact C-N 3.31Å; L207-W209 HydrophobicContact CB-CB 4.48Å; L207-W209 HydrophobicContact CB-CD2 4.22Å; L207-W209 HydrophobicContact CB-CG 3.89Å; L207-W209 HydrophobicContact CD1-CD2 3.98Å; L207-W209 HydrophobicContact CD1-CE3 4.25Å; L207-W209 HydrophobicContact CD1-CH2 4.24Å; L207-W209 HydrophobicContact CD1-CZ2 3.98Å; L207-W209 HydrophobicContact CD1-CZ3 4.37Å; L207-C264 HydrophobicContact CD2-CB 4.32Å; L207-P265 WeakPolarHBondContact O-CD 3.46Å
208	G	97.3	Very high	97.6	Very high	25 Å²	25	50.5 Å²	50.5	26%	0.258	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	30.1	-171.8	0	0	0	0	0	112.5	P47 S204 N205 R206 V210	P47-G208 WeakPolarHBondContact CB-O 3.32Å; S204-G208 PolarHBondContact O-N 3.48Å; N205-G208 PolarHBondContact O-N 2.93Å; R206-G208 VanDerWaalsContact C-N 3.3Å; G208-V210 PolarHBondContact O-N 3.26Å
209	W	98.2	Very high	97.7	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.008	26%	0.257	C	S	.	.			trans	-83.7	6.1	179.1	-80.6	13.3	0	0	0	113.9	P47 V53 L54 S204 L207 L224 W227 I236 L240	P47-W209 HydrophobicContact CG-CB 4.4Å; P47-W209 HydrophobicContact CG-CG 4.28Å; V53-W209 HydrophobicContact CB-CZ2 4.09Å; V53-W209 HydrophobicContact CG1-CZ2 3.64Å; L54-W209 HydrophobicContact CB-CH2 4.31Å; L54-W209 HydrophobicContact CB-CZ2 4.4Å; L54-W209 HydrophobicContact CD1-CH2 4.04Å; S204-W209 WeakPolarHBondContact O-CB 3.43Å; S204-W209 PolarHBondContact O-N 3.42Å; L207-W209 VanDerWaalsContact C-N 3.31Å; L207-W209 HydrophobicContact CB-CB 4.48Å; L207-W209 HydrophobicContact CB-CD2 4.22Å; L207-W209 HydrophobicContact CB-CG 3.89Å; L207-W209 HydrophobicContact CD1-CD2 3.98Å; L207-W209 HydrophobicContact CD1-CE3 4.25Å; L207-W209 HydrophobicContact CD1-CH2 4.24Å; L207-W209 HydrophobicContact CD1-CZ2 3.98Å; L207-W209 HydrophobicContact CD1-CZ3 4.37Å; W209-L224 HydrophobicContact CB-CD2 4.12Å; W209-L224 HydrophobicContact CE3-CD2 4.14Å; W209-W227 HydrophobicContact CB-CZ2 3.84Å; W209-W227 HydrophobicContact CD2-CH2 4.14Å; W209-W227 HydrophobicContact CD2-CZ2 4.18Å; W209-W227 HydrophobicContact CG-CH2 4.19Å; W209-W227 AromaticContact CG-CZ2 3.9Å; W209-W227 HydrophobicContact CG-CZ2 3.9Å; W209-W227 PolarHBondContact O-NE1 3.29Å; W209-I236 HydrophobicContact CH2-CD1 4.27Å; W209-I236 HydrophobicContact CZ3-CD1 3.92Å; W209-I236 HydrophobicContact CZ3-CG1 4.4Å; W209-L240 HydrophobicContact CZ3-CD1 4.06Å; W209-L240 HydrophobicContact CZ3-CD2 4.47Å
210	V	97.9	Very high	97.7	Very high	11 Å²	11	48.7 Å²	48.7	7%	0.067	25%	0.249	C	C	.	.	S	Bend	trans	-121.2	138	174.1	-65.8	0	0	0	0	108.1	W45 N205 G208 K212 T214 T220 A223	W45-V210 VanDerWaalsContact CH2-C 3.44Å; N205-V210 WeakPolarHBondContact OD1-CG2 3.42Å; G208-V210 PolarHBondContact O-N 3.26Å; V210-K212 WeakPolarHBondContact CB-O 3.42Å; V210-K212 WeakPolarHBondContact CG2-O 3.5Å; V210-K212 PolarHBondContact O-N 3.26Å; V210-T214 HydrophobicContact CB-CG2 4.09Å; V210-T214 HydrophobicContact CG1-CG2 4.07Å; V210-T214 HydrophobicContact CG2-CG2 4.35Å; V210-T220 HydrophobicContact CG1-CG2 3.95Å; V210-A223 HydrophobicContact CB-CB 4.13Å; V210-A223 HydrophobicContact CG1-CB 3.79Å
211	P	94.3	Very high	97.7	Very high	79 Å²	79	50.4 Å²	50.4	51%	0.513	26%	0.255	S	S	.	.	S	Bend	trans	-59.1	-33.2	-177.9	-20.5	27.3	0	0	0	113	W45	W45-P211 HydrophobicContact CD2-CB 4.24Å; W45-P211 HydrophobicContact CD2-CG 4.08Å; W45-P211 HydrophobicContact CE3-CB 4.2Å; W45-P211 HydrophobicContact CE3-CG 3.59Å; W45-P211 HydrophobicContact CH2-CB 4.37Å; W45-P211 HydrophobicContact CH2-CG 4.24Å; W45-P211 HydrophobicContact CZ2-CB 4.42Å; W45-P211 HydrophobicContact CZ3-CB 4.27Å; W45-P211 HydrophobicContact CZ3-CG 3.68Å
212	K	94.8	Very high	97.7	Very high	173 Å²	173	54.7 Å²	54.7	75%	0.752	27%	0.274	S	S	*	.	S	Bend	trans	-136.3	149.9	174	-177	175.3	178.5	177.6	0	108.5	V210 T214	V210-K212 WeakPolarHBondContact CB-O 3.42Å; V210-K212 WeakPolarHBondContact CG2-O 3.5Å; V210-K212 PolarHBondContact O-N 3.26Å; K212-T214 PolarHBondContact O-N 3.26Å
213	E	96.3	Very high	97.6	Very high	154 Å²	154	53.5 Å²	53.5	72%	0.72	27%	0.272	S	S	*	.			trans	-51	131.2	173.3	-173.8	168.1	-162	0	0	110.8
214	T	97.7	Very high	97.6	Very high	15 Å²	15	53.5 Å²	53.5	9%	0.092	27%	0.272	C	S	.	.			trans	-108.9	140.9	-176.2	50.9	0	0	0	0	109.2	H201 N205 V210 K212 Q219 T220	H201-T214 PolarHBondContact CE1-O 3.33Å; H201-T214 VanDerWaalsContact CE1-O 3.24Å; N205-T214 PolarHBondContact ND2-OG1 2.86Å; N205-T214 PolarHBondContact OD1-N 3.22Å; N205-T214 PolarHBondContact OD1-OG1 3.04Å; V210-T214 HydrophobicContact CB-CG2 4.09Å; V210-T214 HydrophobicContact CG1-CG2 4.07Å; V210-T214 HydrophobicContact CG2-CG2 4.35Å; K212-T214 PolarHBondContact O-N 3.26Å; T214-Q219 HydrophobicContact CG2-CB 3.83Å; T214-T220 PolarHBondContact OG1-OG1 3.2Å
215	M	97.9	Very high	97.6	Very high	150 Å²	150	55.5 Å²	55.5	74%	0.739	28%	0.281	S	S	*	.	S	Bend	trans	-96.5	-17.9	-177.3	-61.2	-55.7	-63.3	0	0	112.9
216	T	97.9	Very high	97.5	Very high	59 Å²	59	57.3 Å²	57.3	36%	0.362	30%	0.296	S	S	.	.	S	Bend	trans	-130.4	151.5	-177.7	73.7	0	0	0	0	112.1	H201 E218 Q219 T220	H201-T216 PolarHBondContact ND1-O 3.25Å; T216-E218 PolarHBondContact O-N 2.7Å; T216-Q219 PolarHBondContact O-N 2.99Å; T216-Q219 WeakPolarHBondContact OG1-CG 3.22Å; T216-Q219 PolarHBondContact OG1-N 2.92Å; T216-T220 PolarHBondContact O-N 2.95Å; T216-T220 VanDerWaalsContact O-N 3.13Å; T216-T220 PolarHBondContact O-OG1 3.46Å
217	P	97.7	Very high	97.4	Very high	50 Å²	50	56.4 Å²	56.4	33%	0.325	29%	0.293	S	S	.	.	H	α-helix	trans	-55	-35.2	172.7	-28.6	36.5	0	0	0	113.4	V196 H201 T220 R221	V196-P217 HydrophobicContact CG1-CB 3.98Å; V196-P217 WeakPolarHBondContact CG1-O 3.46Å; H201-P217 HydrophobicContact CB-CB 4.39Å; H201-P217 HydrophobicContact CB-CG 4.29Å; P217-T220 PolarHBondContact O-N 3.11Å; P217-R221 PolarHBondContact O-N 3.08Å
218	E	97.8	Very high	97.4	Very high	59 Å²	59	55.8 Å²	55.8	28%	0.276	29%	0.29	S	S	.	.	H	α-helix	trans	-69.9	-37.2	179.6	-179.8	55.9	-159.1	0	0	112.5	T216 T220 R221 K222	T216-E218 PolarHBondContact O-N 2.7Å; E218-T220 VanDerWaalsContact C-N 3.34Å; E218-R221 PolarHBondContact O-N 2.93Å; E218-R221 IonicContact OE1-CZ 3.68Å; E218-R221 IonicContact OE1-NE 2.73Å; E218-R221 PolarHBondContact OE1-NE 3.19Å; E218-R221 IonicContact OE1-NH2 3.88Å; E218-R221 PolarHBondContact OE1-NH2 3.36Å; E218-R221 IonicContact OE2-CZ 3.29Å; E218-R221 IonicContact OE2-NE 3.09Å; E218-R221 PolarHBondContact OE2-NE 3.14Å; E218-R221 IonicContact OE2-NH2 2.72Å; E218-K222 PolarHBondContact O-N 3.11Å; E218-K222 VanDerWaalsContact OE1-CE 3.3Å; E218-K222 WeakPolarHBondContact OE1-CE 3.49Å
219	Q	98.2	Very high	97.4	Very high	91 Å²	91	56.7 Å²	56.7	43%	0.425	29%	0.291	S	S	.	.	H	α-helix	trans	-63.2	-42.5	171.1	-74.5	171.1	-12.2	0	0	111.1	T214 T216 R221 K222 A223	T214-Q219 HydrophobicContact CG2-CB 3.83Å; T216-Q219 PolarHBondContact O-N 2.99Å; T216-Q219 WeakPolarHBondContact OG1-CG 3.22Å; T216-Q219 PolarHBondContact OG1-N 2.92Å; Q219-R221 VanDerWaalsContact C-N 3.34Å; Q219-R221 PolarHBondContact O-N 3.06Å; Q219-K222 PolarHBondContact O-N 3.16Å; Q219-A223 WeakPolarHBondContact O-CB 3.31Å; Q219-A223 PolarHBondContact O-N 3.23Å
220	T	98.6	Very high	97.3	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-63.7	-38.9	175.3	-53.7	0	0	0	0	112.2	V196 H201 V210 T214 T216 P217 E218 A223 L224	V196-T220 HydrophobicContact CG1-CG2 4.19Å; H201-T220 PolarHBondContact ND1-OG1 2.89Å; V210-T220 HydrophobicContact CG1-CG2 3.95Å; T214-T220 PolarHBondContact OG1-OG1 3.2Å; T216-T220 PolarHBondContact O-N 2.95Å; T216-T220 VanDerWaalsContact O-N 3.13Å; T216-T220 PolarHBondContact O-OG1 3.46Å; P217-T220 PolarHBondContact O-N 3.11Å; E218-T220 VanDerWaalsContact C-N 3.34Å; T220-A223 PolarHBondContact O-N 3.02Å; T220-L224 HydrophobicContact CG2-CD1 3.96Å; T220-L224 HydrophobicContact CG2-CG 4.15Å; T220-L224 WeakPolarHBondContact O-CG 3.36Å; T220-L224 PolarHBondContact O-N 3.22Å
221	R	98.4	Very high	97.3	Very high	37 Å²	37	70.2 Å²	70.2	14%	0.14	35%	0.354	C	S	.	.	H	α-helix	trans	-56.7	-54.4	176.7	-174.6	-170.5	69.4	75.1	7.8	111.1	I194 V196 P217 E218 Q219 A223 L224 E225	I194-R221 HydrophobicContact CB-CG 4.34Å; I194-R221 VanDerWaalsContact O-CD 3.3Å; I194-R221 WeakPolarHBondContact O-CD 3.49Å; I194-R221 WeakPolarHBondContact O-CG 3.49Å; V196-R221 HydrophobicContact CB-CB 4.15Å; V196-R221 HydrophobicContact CG2-CB 3.63Å; V196-R221 HydrophobicContact CG2-CG 4.04Å; P217-R221 PolarHBondContact O-N 3.08Å; E218-R221 PolarHBondContact O-N 2.93Å; E218-R221 IonicContact OE1-CZ 3.68Å; E218-R221 IonicContact OE1-NE 2.73Å; E218-R221 PolarHBondContact OE1-NE 3.19Å; E218-R221 IonicContact OE1-NH2 3.88Å; E218-R221 PolarHBondContact OE1-NH2 3.36Å; E218-R221 IonicContact OE2-CZ 3.29Å; E218-R221 IonicContact OE2-NE 3.09Å; E218-R221 PolarHBondContact OE2-NE 3.14Å; E218-R221 IonicContact OE2-NH2 2.72Å; Q219-R221 VanDerWaalsContact C-N 3.34Å; Q219-R221 PolarHBondContact O-N 3.06Å; R221-A223 VanDerWaalsContact C-N 3.29Å; R221-A223 PolarHBondContact O-N 3.44Å; R221-L224 PolarHBondContact O-N 2.94Å; R221-E225 WeakPolarHBondContact CG-OE1 3.42Å; R221-E225 IonicContact CZ-OE1 3.43Å; R221-E225 IonicContact CZ-OE2 3.19Å; R221-E225 IonicContact NH1-OE1 2.67Å; R221-E225 PolarHBondContact NH1-OE1 3.43Å; R221-E225 IonicContact NH1-OE2 2.92Å; R221-E225 PolarHBondContact NH1-OE2 3.34Å; R221-E225 WeakPolarHBondContact O-CG 3.39Å; R221-E225 PolarHBondContact O-N 3.25Å
222	K	97.8	Very high	97.4	Very high	126 Å²	126	68.9 Å²	68.9	55%	0.548	34%	0.339	S	S	.	.	H	α-helix	trans	-58.5	-41.5	178	-68.8	179.5	179.5	-175.5	0	112	E218 Q219 E225 S226	E218-K222 PolarHBondContact O-N 3.11Å; E218-K222 VanDerWaalsContact OE1-CE 3.3Å; E218-K222 WeakPolarHBondContact OE1-CE 3.49Å; Q219-K222 PolarHBondContact O-N 3.16Å; K222-E225 PolarHBondContact O-N 3.42Å; K222-S226 PolarHBondContact O-N 3.04Å; K222-S226 VanDerWaalsContact O-N 3.13Å
223	A	97.9	Very high	97.6	Very high	14 Å²	14	61.9 Å²	61.9	12%	0.116	31%	0.308	C	S	.	.	H	α-helix	trans	-67.6	-34.7	178.1	0	0	0	0	0	113.3	V210 Q219 T220 R221 S226 W227	V210-A223 HydrophobicContact CB-CB 4.13Å; V210-A223 HydrophobicContact CG1-CB 3.79Å; Q219-A223 WeakPolarHBondContact O-CB 3.31Å; Q219-A223 PolarHBondContact O-N 3.23Å; T220-A223 PolarHBondContact O-N 3.02Å; R221-A223 VanDerWaalsContact C-N 3.29Å; R221-A223 PolarHBondContact O-N 3.44Å; A223-S226 PolarHBondContact O-OG 3.38Å; A223-W227 PolarHBondContact O-NE1 3.41Å
224	L	98.3	Very high	97.6	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-72.3	-43.7	174.7	-72.8	172.9	0	0	0	111.2	I194 V196 V200 W209 T220 R221 S226 W227 L228	I194-L224 HydrophobicContact CD1-CB 3.7Å; V196-L224 HydrophobicContact CG2-CD1 4.17Å; V200-L224 HydrophobicContact CG1-CD1 3.92Å; W209-L224 HydrophobicContact CB-CD2 4.12Å; W209-L224 HydrophobicContact CE3-CD2 4.14Å; T220-L224 HydrophobicContact CG2-CD1 3.96Å; T220-L224 HydrophobicContact CG2-CG 4.15Å; T220-L224 WeakPolarHBondContact O-CG 3.36Å; T220-L224 PolarHBondContact O-N 3.22Å; R221-L224 PolarHBondContact O-N 2.94Å; L224-S226 PolarHBondContact O-N 2.78Å; L224-W227 HydrophobicContact CD2-CZ2 3.94Å; L224-W227 PolarHBondContact O-N 3.37Å; L224-L228 WeakPolarHBondContact O-CB 3.27Å; L224-L228 PolarHBondContact O-N 3.08Å
225	E	97.5	Very high	97.5	Very high	43 Å²	43	61.2 Å²	61.2	20%	0.201	31%	0.31	C	S	.	.	H	α-helix	trans	-64.5	-24	179.6	-72.3	174	-168.3	0	0	113	G193 I194 R221 K222 W227 W233	G193-E225 WeakPolarHBondContact CA-OE1 3.34Å; I194-E225 HydrophobicContact CB-CG 4.44Å; I194-E225 HydrophobicContact CD1-CG 3.74Å; I194-E225 HydrophobicContact CG1-CG 3.84Å; I194-E225 PolarHBondContact N-OE1 2.67Å; R221-E225 WeakPolarHBondContact CG-OE1 3.42Å; R221-E225 IonicContact CZ-OE1 3.43Å; R221-E225 IonicContact CZ-OE2 3.19Å; R221-E225 IonicContact NH1-OE1 2.67Å; R221-E225 PolarHBondContact NH1-OE1 3.43Å; R221-E225 IonicContact NH1-OE2 2.92Å; R221-E225 PolarHBondContact NH1-OE2 3.34Å; R221-E225 WeakPolarHBondContact O-CG 3.39Å; R221-E225 PolarHBondContact O-N 3.25Å; K222-E225 PolarHBondContact O-N 3.42Å; E225-W227 PolarHBondContact O-N 3.06Å; E225-W233 HydrophobicContact CB-CH2 3.98Å; E225-W233 HydrophobicContact CB-CZ2 3.78Å; E225-W233 HydrophobicContact CG-CD2 4.49Å; E225-W233 HydrophobicContact CG-CH2 3.81Å; E225-W233 HydrophobicContact CG-CZ2 3.78Å; E225-W233 HydrophobicContact CG-CZ3 4.18Å
226	S	96.6	Very high	97.5	Very high	71 Å²	71	54.2 Å²	54.2	50%	0.497	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-11.6	179.3	76.2	0	0	0	0	114.4	K222 A223 L224	K222-S226 PolarHBondContact O-N 3.04Å; K222-S226 VanDerWaalsContact O-N 3.13Å; A223-S226 PolarHBondContact O-OG 3.38Å; L224-S226 PolarHBondContact O-N 2.78Å
227	W	97.2	Very high	97.5	Very high	9 Å²	9	52 Å²	52	3%	0.034	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-147.3	-27.9	-176.9	71.4	-99.4	0	0	0	115.5	W45 Q46 P47 W50 W209 A223 L224 E225 P229	W45-W227 AromaticContact CE3-CD1 3.8Å; W45-W227 HydrophobicContact CE3-CG 4.24Å; W45-W227 AromaticContact CZ3-CD1 3.7Å; W45-W227 HydrophobicContact CZ3-CG 4.37Å; W45-W227 AromaticContact CZ3-NE1 3.68Å; W45-W227 WeakPolarHBondContact O-CB 3.24Å; Q46-W227 HydrophobicContact CB-CE3 4.4Å; Q46-W227 HydrophobicContact CG-CB 4.14Å; Q46-W227 HydrophobicContact CG-CE3 4.03Å; P47-W227 HydrophobicContact CG-CD2 4.27Å; P47-W227 HydrophobicContact CG-CE3 4.47Å; P47-W227 HydrophobicContact CG-CH2 3.8Å; P47-W227 HydrophobicContact CG-CZ2 3.52Å; P47-W227 HydrophobicContact CG-CZ3 4.26Å; W50-W227 HydrophobicContact CB-CH2 3.91Å; W50-W227 HydrophobicContact CB-CZ3 3.9Å; W50-W227 HydrophobicContact CD2-CH2 4.25Å; W50-W227 AromaticContact CD2-CZ3 3.54Å; W50-W227 HydrophobicContact CD2-CZ3 3.54Å; W50-W227 HydrophobicContact CE3-CH2 4.3Å; W50-W227 AromaticContact CE3-CZ3 3.82Å; W50-W227 HydrophobicContact CE3-CZ3 3.82Å; W50-W227 HydrophobicContact CG-CE3 4.47Å; W50-W227 HydrophobicContact CG-CH2 4.1Å; W50-W227 AromaticContact CG-CZ3 3.57Å; W50-W227 HydrophobicContact CG-CZ3 3.57Å; W209-W227 HydrophobicContact CB-CZ2 3.84Å; W209-W227 HydrophobicContact CD2-CH2 4.14Å; W209-W227 HydrophobicContact CD2-CZ2 4.18Å; W209-W227 HydrophobicContact CG-CH2 4.19Å; W209-W227 AromaticContact CG-CZ2 3.9Å; W209-W227 HydrophobicContact CG-CZ2 3.9Å; W209-W227 PolarHBondContact O-NE1 3.29Å; A223-W227 PolarHBondContact O-NE1 3.41Å; L224-W227 HydrophobicContact CD2-CZ2 3.94Å; L224-W227 PolarHBondContact O-N 3.37Å; E225-W227 PolarHBondContact O-N 3.06Å; W227-P229 WeakPolarHBondContact O-CD 3.33Å
228	L	97.4	Very high	97.4	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.021	26%	0.263	C	S	.	.	S	Bend	trans	-69.4	126.2	-177.9	-178	69.1	0	0	0	109.1	W50 I194 L224 Q230 Y232 W233 I236	W50-L228 HydrophobicContact CE3-CD1 4.28Å; W50-L228 HydrophobicContact CZ3-CD1 4.01Å; I194-L228 HydrophobicContact CD1-CD2 3.98Å; L224-L228 WeakPolarHBondContact O-CB 3.27Å; L224-L228 PolarHBondContact O-N 3.08Å; L228-Q230 PolarHBondContact O-N 3.08Å; L228-Y232 HydrophobicContact CD1-CD2 4.28Å; L228-Y232 HydrophobicContact CD1-CG 4.45Å; L228-W233 PolarHBondContact O-NE1 3.2Å; L228-I236 HydrophobicContact CD2-CB 4.37Å; L228-I236 HydrophobicContact CD2-CG1 4.23Å; L228-I236 HydrophobicContact CD2-CG2 4.31Å
229	P	97.3	Very high	97.4	Very high	43 Å²	43	51.8 Å²	51.8	28%	0.279	26%	0.256	S	S	.	.			trans	-59	137.3	178.9	-25.7	34.8	0	0	0	112.3	W50 W227 Q231 Y232	W50-P229 HydrophobicContact CH2-CG 3.77Å; W50-P229 HydrophobicContact CZ2-CG 3.93Å; W227-P229 WeakPolarHBondContact O-CD 3.33Å; P229-Q231 HydrophobicContact CB-CG 4.32Å; P229-Q231 PolarHBondContact O-N 3.42Å; P229-Y232 HydrophobicContact CB-CD2 3.89Å; P229-Y232 HydrophobicContact CB-CE2 4.05Å; P229-Y232 HydrophobicContact CG-CD2 4.21Å; P229-Y232 HydrophobicContact CG-CE2 4.17Å; P229-Y232 WeakPolarHBondContact O-CD2 3.19Å; P229-Y232 PolarHBondContact O-N 2.84Å
230	Q	96.6	Very high	97.4	Very high	148 Å²	148	47.5 Å²	47.5	69%	0.692	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-55.6	-30.3	-171.8	-69.8	-174.8	17.8	0	0	114.1	L228 Y232 W233	L228-Q230 PolarHBondContact O-N 3.08Å; Q230-Y232 PolarHBondContact O-N 3.36Å; Q230-W233 HydrophobicContact CB-CD2 4.47Å; Q230-W233 HydrophobicContact CG-CD2 4.27Å; Q230-W233 HydrophobicContact CG-CH2 4.18Å; Q230-W233 HydrophobicContact CG-CZ2 3.86Å; Q230-W233 HydrophobicContact CG-CZ3 4.49Å; Q230-W233 WeakPolarHBondContact O-CB 3.38Å; Q230-W233 PolarHBondContact O-N 3.27Å
231	Q	96.9	Very high	97.4	Very high	149 Å²	149	47.8 Å²	47.8	70%	0.696	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-57	-23.8	176.8	69.5	-173.1	47.8	0	0	113.8	P229	P229-Q231 HydrophobicContact CB-CG 4.32Å; P229-Q231 PolarHBondContact O-N 3.42Å
232	Y	97.8	Very high	97.3	Very high	51 Å²	51	46 Å²	46	20%	0.2	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-92.1	-15.1	179.7	-60.3	-72.1	0	0	0	113.7	W50 L54 L228 P229 Q230 R234 G235 I236	W50-Y232 HydrophobicContact CH2-CD2 4.15Å; W50-Y232 AromaticContact CH2-CE2 3.64Å; W50-Y232 HydrophobicContact CH2-CE2 3.64Å; W50-Y232 HydrophobicContact CZ3-CD2 4.19Å; W50-Y232 AromaticContact CZ3-CE2 3.94Å; W50-Y232 HydrophobicContact CZ3-CE2 3.94Å; L54-Y232 HydrophobicContact CD2-CD1 3.48Å; L54-Y232 VanDerWaalsContact CD2-CD1 3.48Å; L54-Y232 HydrophobicContact CD2-CE1 3.49Å; L54-Y232 VanDerWaalsContact CD2-CE1 3.49Å; L54-Y232 HydrophobicContact CD2-CG 4.05Å; L228-Y232 HydrophobicContact CD1-CD2 4.28Å; L228-Y232 HydrophobicContact CD1-CG 4.45Å; P229-Y232 HydrophobicContact CB-CD2 3.89Å; P229-Y232 HydrophobicContact CB-CE2 4.05Å; P229-Y232 HydrophobicContact CG-CD2 4.21Å; P229-Y232 HydrophobicContact CG-CE2 4.17Å; P229-Y232 WeakPolarHBondContact O-CD2 3.19Å; P229-Y232 PolarHBondContact O-N 2.84Å; Q230-Y232 PolarHBondContact O-N 3.36Å; Y232-R234 VanDerWaalsContact C-N 3.3Å; Y232-R234 PolarHBondContact O-N 3.46Å; Y232-G235 PolarHBondContact O-N 3.03Å; Y232-G235 VanDerWaalsContact O-N 3.11Å; Y232-I236 WeakPolarHBondContact O-CB 3.42Å; Y232-I236 PolarHBondContact O-N 3.41Å
233	W	98.1	Very high	97.3	Very high	27 Å²	27	40.2 Å²	40.2	10%	0.102	21%	0.206	C	C	.	.	H	α-helix	trans	-59.4	-40.5	-171.2	-70.9	16	0	0	0	112.6	C191 I194 E225 L228 Q230 G235	C191-W233 VanDerWaalsContact SG-CB 3.6Å; I194-W233 HydrophobicContact CD1-CD2 4.25Å; I194-W233 HydrophobicContact CD1-CG 3.96Å; I194-W233 HydrophobicContact CG1-CB 3.87Å; I194-W233 HydrophobicContact CG1-CD2 3.88Å; I194-W233 HydrophobicContact CG1-CE3 4.39Å; I194-W233 HydrophobicContact CG1-CG 3.63Å; E225-W233 HydrophobicContact CB-CH2 3.98Å; E225-W233 HydrophobicContact CB-CZ2 3.78Å; E225-W233 HydrophobicContact CG-CD2 4.49Å; E225-W233 HydrophobicContact CG-CH2 3.81Å; E225-W233 HydrophobicContact CG-CZ2 3.78Å; E225-W233 HydrophobicContact CG-CZ3 4.18Å; L228-W233 PolarHBondContact O-NE1 3.2Å; Q230-W233 HydrophobicContact CB-CD2 4.47Å; Q230-W233 HydrophobicContact CG-CD2 4.27Å; Q230-W233 HydrophobicContact CG-CH2 4.18Å; Q230-W233 HydrophobicContact CG-CZ2 3.86Å; Q230-W233 HydrophobicContact CG-CZ3 4.49Å; Q230-W233 WeakPolarHBondContact O-CB 3.38Å; Q230-W233 PolarHBondContact O-N 3.27Å; W233-G235 PolarHBondContact O-N 2.67Å
234	R	96.2	Very high	97.3	Very high	111 Å²	111	39.6 Å²	39.6	42%	0.419	20%	0.201	S	C	.	.	H	α-helix	trans	-63.2	-41.8	178.5	-172.1	-179.2	-74.2	-85.2	-0.8	112.2	Q185 R189 Y232	Q185-R234 HydrophobicContact CG-CG 3.93Å; Q185-R234 PolarHBondContact NE2-O 3.26Å; Q185-R234 PolarHBondContact O-NH1 3.5Å; R189-R234 PolarHBondContact O-NH2 3.44Å; Y232-R234 VanDerWaalsContact C-N 3.3Å; Y232-R234 PolarHBondContact O-N 3.46Å
235	G	95.4	Very high	97.2	Very high	43 Å²	43	42 Å²	42	44%	0.443	21%	0.212	S	C	.	.	H	α-helix	trans	-87.3	-25.9	-172.3	0	0	0	0	0	114.3	Y232 W233 N237 K238 L239	Y232-G235 PolarHBondContact O-N 3.03Å; Y232-G235 VanDerWaalsContact O-N 3.11Å; W233-G235 PolarHBondContact O-N 2.67Å; G235-N237 PolarHBondContact O-N 3.33Å; G235-K238 PolarHBondContact O-N 3.36Å; G235-L239 PolarHBondContact O-N 2.83Å; G235-L239 VanDerWaalsContact O-N 3.17Å
236	I	98	Very high	97.2	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.015	21%	0.21	C	C	.	.	H	α-helix	trans	-65.1	-36.7	-163	-161.6	59.6	0	0	0	113.5	L54 I194 W209 L228 Y232 L239 L240	L54-I236 HydrophobicContact CD1-CD1 3.61Å; I194-I236 HydrophobicContact CG2-CG2 3.56Å; W209-I236 HydrophobicContact CH2-CD1 4.27Å; W209-I236 HydrophobicContact CZ3-CD1 3.92Å; W209-I236 HydrophobicContact CZ3-CG1 4.4Å; L228-I236 HydrophobicContact CD2-CB 4.37Å; L228-I236 HydrophobicContact CD2-CG1 4.23Å; L228-I236 HydrophobicContact CD2-CG2 4.31Å; Y232-I236 WeakPolarHBondContact O-CB 3.42Å; Y232-I236 PolarHBondContact O-N 3.41Å; I236-L239 HydrophobicContact CD1-CD2 4.35Å; I236-L240 HydrophobicContact CD1-CD1 4.16Å; I236-L240 HydrophobicContact CD1-CG 4.05Å; I236-L240 HydrophobicContact CG1-CD1 3.93Å; I236-L240 HydrophobicContact CG1-CG 4.17Å; I236-L240 WeakPolarHBondContact O-CB 3.38Å; I236-L240 WeakPolarHBondContact O-CG 3.45Å; I236-L240 PolarHBondContact O-N 3.31Å
237	N	97.7	Very high	97.2	Very high	14 Å²	14	38 Å²	38	8%	0.075	19%	0.188	C	C	.	.	H	α-helix	trans	-59	-58.9	178	176.6	-90.5	0	0	0	111	L182 G195 V200 G235 L239 L240 V241	L182-N237 HydrophobicContact CD2-CB 4.27Å; G195-N237 VanDerWaalsContact O-CB 3.31Å; G195-N237 WeakPolarHBondContact O-CB 3.42Å; G195-N237 PolarHBondContact O-ND2 3.41Å; V200-N237 HydrophobicContact CG2-CB 4.39Å; G235-N237 PolarHBondContact O-N 3.33Å; N237-L239 VanDerWaalsContact C-N 3.28Å; N237-L239 PolarHBondContact O-N 3.31Å; N237-L240 PolarHBondContact O-N 3.5Å; N237-V241 WeakPolarHBondContact O-CB 3.32Å; N237-V241 WeakPolarHBondContact O-CG2 3.47Å; N237-V241 PolarHBondContact O-N 3.42Å
238	K	96.6	Very high	97.2	Very high	77 Å²	77	38.3 Å²	38.3	34%	0.335	19%	0.191	S	C	.	.	H	α-helix	trans	-59	-42	-176.5	-175.1	179.6	178.5	-172	0	111.6	V68 D69 G235 G242	V68-K238 HydrophobicContact CG1-CG 4.36Å; V68-K238 HydrophobicContact CG2-CG 4.2Å; D69-K238 WeakPolarHBondContact OD1-CE 3.18Å; D69-K238 IonicContact OD1-NZ 2.79Å; G235-K238 PolarHBondContact O-N 3.36Å; K238-G242 PolarHBondContact O-N 3.09Å; K238-G242 VanDerWaalsContact O-N 3.07Å
239	L	97.8	Very high	97.2	Very high	27 Å²	27	39.6 Å²	39.6	14%	0.141	20%	0.199	C	C	.	.	H	α-helix	trans	-58.7	-52	178.6	-177.1	68.5	0	0	0	111.4	L54 I57 E58 R61 G235 I236 N237 G242 F243	L54-L239 HydrophobicContact CD1-CD2 3.48Å; L54-L239 VanDerWaalsContact CD1-CD2 3.48Å; I57-L239 HydrophobicContact CG2-CD1 3.97Å; I57-L239 HydrophobicContact CG2-CD2 4.05Å; I57-L239 HydrophobicContact CG2-CG 3.77Å; E58-L239 HydrophobicContact CG-CD1 4.17Å; E58-L239 HydrophobicContact CG-CD2 3.86Å; R61-L239 HydrophobicContact CB-CD1 3.99Å; R61-L239 HydrophobicContact CG-CD1 3.94Å; G235-L239 PolarHBondContact O-N 2.83Å; G235-L239 VanDerWaalsContact O-N 3.17Å; I236-L239 HydrophobicContact CD1-CD2 4.35Å; N237-L239 VanDerWaalsContact C-N 3.28Å; N237-L239 PolarHBondContact O-N 3.31Å; L239-G242 PolarHBondContact O-N 2.77Å; L239-F243 WeakPolarHBondContact O-CB 3.46Å; L239-F243 PolarHBondContact O-N 3.34Å
240	L	98.5	Very high	97.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-73.7	-31.6	-177.2	-66.2	-172.4	0	0	0	112.9	I57 V200 I203 W209 I236 N237 G244	I57-L240 HydrophobicContact CD1-CD2 3.87Å; V200-L240 HydrophobicContact CG1-CD1 4.04Å; V200-L240 HydrophobicContact CG2-CB 4.1Å; I203-L240 HydrophobicContact CD1-CB 4.32Å; I203-L240 WeakPolarHBondContact CD1-O 3.14Å; I203-L240 HydrophobicContact CG2-CD2 4Å; W209-L240 HydrophobicContact CZ3-CD1 4.06Å; W209-L240 HydrophobicContact CZ3-CD2 4.47Å; I236-L240 HydrophobicContact CD1-CD1 4.16Å; I236-L240 HydrophobicContact CD1-CG 4.05Å; I236-L240 HydrophobicContact CG1-CD1 3.93Å; I236-L240 HydrophobicContact CG1-CG 4.17Å; I236-L240 WeakPolarHBondContact O-CB 3.38Å; I236-L240 WeakPolarHBondContact O-CG 3.45Å; I236-L240 PolarHBondContact O-N 3.31Å; N237-L240 PolarHBondContact O-N 3.5Å; L240-G244 PolarHBondContact O-N 3.25Å
241	V	97.5	Very high	97.1	Very high	6 Å²	6	45 Å²	45	4%	0.036	22%	0.217	C	C	.	.	H	α-helix	trans	-59.8	-53.4	171.6	172	0	0	0	0	109.8	V68 D197 H199 N237 F243 G244 Q245	V68-V241 HydrophobicContact CB-CG1 3.75Å; V68-V241 HydrophobicContact CG1-CB 4.45Å; V68-V241 HydrophobicContact CG1-CG1 4.07Å; V68-V241 HydrophobicContact CG2-CB 4.29Å; V68-V241 HydrophobicContact CG2-CG1 3.78Å; D197-V241 WeakPolarHBondContact OD2-CG2 3.32Å; H199-V241 HydrophobicContact CB-CG2 4.14Å; N237-V241 WeakPolarHBondContact O-CB 3.32Å; N237-V241 WeakPolarHBondContact O-CG2 3.47Å; N237-V241 PolarHBondContact O-N 3.42Å; V241-F243 VanDerWaalsContact C-N 3.35Å; V241-F243 PolarHBondContact O-N 3Å; V241-G244 CarbonylContact O-C 3.36Å; V241-G244 WeakPolarHBondContact O-CA 3.4Å; V241-G244 PolarHBondContact O-N 2.97Å; V241-G244 VanDerWaalsContact O-N 3.07Å; V241-Q245 HydrophobicContact CG1-CG 4.39Å; V241-Q245 WeakPolarHBondContact O-CG 3.38Å; V241-Q245 PolarHBondContact O-N 3.23Å
242	G	97.2	Very high	97	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.4	-39.7	180	0	0	0	0	0	112.9	K238 L239 G244 Q245 T246	K238-G242 PolarHBondContact O-N 3.09Å; K238-G242 VanDerWaalsContact O-N 3.07Å; L239-G242 PolarHBondContact O-N 2.77Å; G242-G244 VanDerWaalsContact C-N 3.32Å; G242-G244 PolarHBondContact O-N 3.13Å; G242-Q245 PolarHBondContact O-N 2.72Å; G242-T246 WeakPolarHBondContact O-CG2 3.48Å; G242-T246 PolarHBondContact O-N 3.33Å; G242-T246 PolarHBondContact O-OG1 2.72Å
243	F	98	Very high	96.9	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.018	22%	0.218	C	C	.	.	H	α-helix	trans	-61.4	-40.5	172.1	-179.5	-121.4	0	0	0	112.2	I57 M60 I203 L239 V241 Q245 T246 I247 C248	I57-F243 HydrophobicContact CD1-CD1 4.21Å; I57-F243 HydrophobicContact CD1-CE1 4.15Å; I57-F243 HydrophobicContact CG1-CD1 4.31Å; I57-F243 HydrophobicContact CG1-CE1 4.19Å; I57-F243 HydrophobicContact CG1-CE2 4.41Å; I57-F243 HydrophobicContact CG1-CG 4.48Å; I57-F243 HydrophobicContact CG1-CZ 4.26Å; I57-F243 HydrophobicContact CG2-CB 3.87Å; I57-F243 HydrophobicContact CG2-CD1 4.29Å; I57-F243 HydrophobicContact CG2-CD2 4.08Å; I57-F243 HydrophobicContact CG2-CG 3.84Å; M60-F243 HydrophobicContact CE-CD2 4.4Å; M60-F243 HydrophobicContact CE-CE2 3.59Å; M60-F243 HydrophobicContact CE-CZ 4.14Å; M60-F243 HydrophobicContact SD-CE2 4.26Å; I203-F243 HydrophobicContact CD1-CD1 3.94Å; I203-F243 HydrophobicContact CG2-CD1 4.14Å; I203-F243 HydrophobicContact CG2-CE1 4.24Å; L239-F243 WeakPolarHBondContact O-CB 3.46Å; L239-F243 PolarHBondContact O-N 3.34Å; V241-F243 VanDerWaalsContact C-N 3.35Å; V241-F243 PolarHBondContact O-N 3Å; F243-Q245 VanDerWaalsContact C-N 3.33Å; F243-T246 PolarHBondContact O-N 3.4Å; F243-T246 PolarHBondContact O-OG1 2.72Å; F243-I247 HydrophobicContact CD2-CB 3.8Å; F243-I247 HydrophobicContact CD2-CD1 4.06Å; F243-I247 HydrophobicContact CD2-CG1 4.34Å; F243-I247 HydrophobicContact CD2-CG2 4.35Å; F243-I247 HydrophobicContact CE2-CB 3.53Å; F243-I247 HydrophobicContact CE2-CD1 3.91Å; F243-I247 HydrophobicContact CE2-CG1 4.26Å; F243-I247 HydrophobicContact CE2-CG2 3.56Å; F243-I247 HydrophobicContact CZ-CB 4.36Å; F243-I247 HydrophobicContact CZ-CG2 4.08Å; F243-I247 PolarHBondContact O-N 3.05Å; F243-C248 HydrophobicContact CD1-CB 3.68Å; F243-C248 HydrophobicContact CE1-CB 3.31Å; F243-C248 HydrophobicContact CE2-CB 4.47Å; F243-C248 HydrophobicContact CG-CB 4.4Å; F243-C248 HydrophobicContact CZ-CB 3.75Å; F243-C248 PolarHBondContact O-N 2.81Å
244	G	97.7	Very high	96.8	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-74.2	-18.8	177.7	0	0	0	0	0	114.6	R202 L240 V241 G242 V249	R202-G244 PolarHBondContact NH2-O 3.37Å; L240-G244 PolarHBondContact O-N 3.25Å; V241-G244 CarbonylContact O-C 3.36Å; V241-G244 WeakPolarHBondContact O-CA 3.4Å; V241-G244 PolarHBondContact O-N 2.97Å; V241-G244 VanDerWaalsContact O-N 3.07Å; G242-G244 VanDerWaalsContact C-N 3.32Å; G242-G244 PolarHBondContact O-N 3.13Å; G244-V249 WeakPolarHBondContact O-CA 3.49Å
245	Q	96.1	Very high	96.8	Very high	51 Å²	51	43.6 Å²	43.6	24%	0.238	23%	0.227	C	C	.	.	H	α-helix	trans	-84.5	-22.1	173.7	-73.7	174.5	-18.7	0	0	112.1	A66 V68 D102 V241 G242 F243	A66-Q245 HydrophobicContact CB-CB 4.33Å; V68-Q245 VanDerWaalsContact N-OE1 3.1Å; D102-Q245 PolarHBondContact OD2-NE2 2.71Å; V241-Q245 HydrophobicContact CG1-CG 4.39Å; V241-Q245 WeakPolarHBondContact O-CG 3.38Å; V241-Q245 PolarHBondContact O-N 3.23Å; G242-Q245 PolarHBondContact O-N 2.72Å; F243-Q245 VanDerWaalsContact C-N 3.33Å
246	T	96.2	Very high	96.7	Very high	26 Å²	26	49.5 Å²	49.5	16%	0.16	24%	0.242	C	C	.	.	H	α-helix	trans	-115.8	-46.3	-169.8	53.3	0	0	0	0	114.5	A66 G242 F243	A66-T246 HydrophobicContact CB-CG2 3.76Å; G242-T246 WeakPolarHBondContact O-CG2 3.48Å; G242-T246 PolarHBondContact O-N 3.33Å; G242-T246 PolarHBondContact O-OG1 2.72Å; F243-T246 PolarHBondContact O-N 3.4Å; F243-T246 PolarHBondContact O-OG1 2.72Å
247	I	96.9	Very high	96.5	Very high	5 Å²	5	52 Å²	52	3%	0.026	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	-59.4	-171.5	-59.7	176.2	0	0	0	110.7	M60 F243 V249 K254 C258	M60-I247 HydrophobicContact CB-CD1 3.81Å; M60-I247 HydrophobicContact CG-CD1 4.17Å; M60-I247 HydrophobicContact SD-CD1 3.67Å; F243-I247 HydrophobicContact CD2-CB 3.8Å; F243-I247 HydrophobicContact CD2-CD1 4.06Å; F243-I247 HydrophobicContact CD2-CG1 4.34Å; F243-I247 HydrophobicContact CD2-CG2 4.35Å; F243-I247 HydrophobicContact CE2-CB 3.53Å; F243-I247 HydrophobicContact CE2-CD1 3.91Å; F243-I247 HydrophobicContact CE2-CG1 4.26Å; F243-I247 HydrophobicContact CE2-CG2 3.56Å; F243-I247 HydrophobicContact CZ-CB 4.36Å; F243-I247 HydrophobicContact CZ-CG2 4.08Å; F243-I247 PolarHBondContact O-N 3.05Å; I247-V249 PolarHBondContact O-N 3.49Å; I247-K254 HydrophobicContact CG2-CB 4.34Å; I247-K254 PolarHBondContact O-N 3.38Å; I247-C258 HydrophobicContact CG2-CB 4.12Å
248	C	97.8	Very high	96.5	Very high	14 Å²	14	52 Å²	52	10%	0.095	26%	0.261	C	S	.	.	S	Bend	trans	-88.3	55.3	-177.5	-164.1	0	0	0	0	111.7	R202 I203 R206 F243	R202-C248 PolarHBondContact NE-O 2.74Å; R202-C248 PolarHBondContact NH2-O 3.21Å; I203-C248 HydrophobicContact CD1-CB 4.25Å; I203-C248 HydrophobicContact CG1-CB 4.15Å; R206-C248 PolarHBondContact NH1-SG 2.94Å; R206-C248 VanDerWaalsContact NH1-SG 3.41Å; F243-C248 HydrophobicContact CD1-CB 3.68Å; F243-C248 HydrophobicContact CE1-CB 3.31Å; F243-C248 HydrophobicContact CE2-CB 4.47Å; F243-C248 HydrophobicContact CG-CB 4.4Å; F243-C248 HydrophobicContact CZ-CB 3.75Å; F243-C248 PolarHBondContact O-N 2.81Å
249	V	97	Very high	96.5	Very high	32 Å²	32	52.5 Å²	52.5	19%	0.194	27%	0.267	C	S	.	.			trans	-66.6	159	-178.8	-66.7	0	0	0	0	112.4	R206 G244 I247 R251	R206-V249 PolarHBondContact NH1-O 3.1Å; G244-V249 WeakPolarHBondContact O-CA 3.49Å; I247-V249 PolarHBondContact O-N 3.49Å; V249-R251 VanDerWaalsContact CG2-O 3.27Å; V249-R251 WeakPolarHBondContact CG2-O 3.18Å; V249-R251 PolarHBondContact O-N 3.17Å
250	P	96.4	Very high	96.5	Very high	78 Å²	78	51.3 Å²	51.3	51%	0.506	26%	0.26	S	S	.	.	S	Bend	trans	-58.7	-47.6	-176	-25.8	33.9	0	0	0	114.2	R206	R206-P250 PolarHBondContact NH2-O 2.97Å
251	R	95.3	Very high	96.4	Very high	225 Å²	225	53.1 Å²	53.1	85%	0.849	27%	0.273	S	S	*	.	S	Bend	trans	-106.1	134.2	177.2	-65.9	-177.8	178.8	168.1	-1	109.6	V249	V249-R251 VanDerWaalsContact CG2-O 3.27Å; V249-R251 WeakPolarHBondContact CG2-O 3.18Å; V249-R251 PolarHBondContact O-N 3.17Å
252	N	93.8	Very high	96.3	Very high	150 Å²	150	55.9 Å²	55.9	80%	0.802	29%	0.288	S	S	*	.	S	Bend	trans	47.8	62.8	176.9	-59.8	-19.7	0	0	0	113.2
253	P	96.9	Very high	96.2	Very high	19 Å²	19	57.2 Å²	57.2	12%	0.123	30%	0.295	C	S	.	.			trans	-56.8	148.5	176.3	25.8	-33.4	0	0	0	110.9	C255 Y266	P253-C255 PolarHBondContact O-N 3.36Å; P253-Y266 HydrophobicContact CG-CD1 4.32Å; P253-Y266 HydrophobicContact CG-CE1 3.55Å
254	K	95.8	Very high	96.2	Very high	107 Å²	107	57.6 Å²	57.6	47%	0.465	30%	0.298	S	S	.	.			trans	-77.7	54.8	-177	-59	-179.9	-178.6	172.8	0	111.5	I247 H256 S257 C258	I247-K254 HydrophobicContact CG2-CB 4.34Å; I247-K254 PolarHBondContact O-N 3.38Å; K254-H256 VanDerWaalsContact C-N 3.25Å; K254-H256 PolarHBondContact O-N 3.03Å; K254-S257 PolarHBondContact O-N 3.08Å; K254-S257 VanDerWaalsContact O-N 3.16Å; K254-S257 PolarHBondContact O-OG 3.31Å; K254-C258 PolarHBondContact O-N 3.43Å
255	C	96.4	Very high	96.1	Very high	34 Å²	34	60.8 Å²	60.8	23%	0.23	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-60.7	-32.4	-174.3	-71.5	0	0	0	0	112.9	P253 S257 C258 S261 A267	P253-C255 PolarHBondContact O-N 3.36Å; C255-S257 PolarHBondContact O-N 3.12Å; C255-C258 WeakPolarHBondContact O-CB 3.43Å; C255-C258 PolarHBondContact O-N 2.91Å; C255-C258 VanDerWaalsContact O-N 3.13Å; C255-S261 VanDerWaalsContact O-CB 3.25Å; C255-S261 WeakPolarHBondContact O-CB 3.34Å; C255-A267 HydrophobicContact CB-CB 4.2Å
256	H	94	Very high	96.1	Very high	167 Å²	167	61.6 Å²	61.6	77%	0.773	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-61.3	-29.9	177.9	65.5	-92.3	0	0	0	113.5	K254	K254-H256 VanDerWaalsContact C-N 3.25Å; K254-H256 PolarHBondContact O-N 3.03Å
257	S	93.1	Very high	96	Very high	54 Å²	54	60.7 Å²	60.7	38%	0.378	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-103.5	8.7	178.4	46.2	0	0	0	0	112.7	K254 C255	K254-S257 PolarHBondContact O-N 3.08Å; K254-S257 VanDerWaalsContact O-N 3.16Å; K254-S257 PolarHBondContact O-OG 3.31Å; C255-S257 PolarHBondContact O-N 3.12Å
258	C	96.8	Very high	95.8	Very high	14 Å²	14	66 Å²	66	10%	0.095	34%	0.337	C	S	.	.			trans	-90.5	125.7	178.8	-175.5	0	0	0	0	110.3	M60 I247 K254 C255 N260 S261	M60-C258 HydrophobicContact SD-CB 4.5Å; I247-C258 HydrophobicContact CG2-CB 4.12Å; K254-C258 PolarHBondContact O-N 3.43Å; C255-C258 WeakPolarHBondContact O-CB 3.43Å; C255-C258 PolarHBondContact O-N 2.91Å; C255-C258 VanDerWaalsContact O-N 3.13Å; C258-N260 PolarHBondContact O-N 3.44Å; C258-S261 WeakPolarHBondContact O-CB 3.49Å; C258-S261 PolarHBondContact O-N 3.11Å; C258-S261 PolarHBondContact O-OG 2.97Å
259	L	97.1	Very high	95.5	Very high	89 Å²	89	69.5 Å²	69.5	47%	0.466	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-11.6	176.9	-62.5	-176.4	0	0	0	113.9	N56 A59 M60	N56-L259 HydrophobicContact CB-CB 3.89Å; N56-L259 PolarHBondContact ND2-O 2.75Å; N56-L259 VanDerWaalsContact ND2-O 3.13Å; A59-L259 HydrophobicContact CB-CD1 4.31Å; M60-L259 HydrophobicContact CE-CB 4.21Å; M60-L259 HydrophobicContact CG-CB 4.37Å; M60-L259 HydrophobicContact CG-CD1 3.77Å; M60-L259 HydrophobicContact CG-CG 3.76Å; M60-L259 HydrophobicContact SD-CB 4.08Å; M60-L259 HydrophobicContact SD-CG 3.95Å; M60-L259 PolarHBondContact SD-N 3.31Å; M60-L259 VanDerWaalsContact SD-N 3.4Å
260	N	97.7	Very high	95	Very high	1 Å²	1	72.3 Å²	72.3	1%	0.005	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	6.8	178.4	-67.1	-41.5	0	0	0	113.6	V53 N56 C258 D262 I263 C264	V53-N260 WeakPolarHBondContact CA-OD1 3.38Å; V53-N260 PolarHBondContact O-ND2 3.46Å; V53-N260 VanDerWaalsContact O-ND2 3.11Å; N56-N260 WeakPolarHBondContact CB-OD1 3.39Å; N56-N260 PolarHBondContact ND2-OD1 3.21Å; C258-N260 PolarHBondContact O-N 3.44Å; N260-D262 PolarHBondContact O-N 3.33Å; N260-I263 HydrophobicContact CB-CG1 4.19Å; N260-I263 PolarHBondContact O-N 3.26Å; N260-I263 VanDerWaalsContact O-N 3.12Å; N260-C264 HydrophobicContact CB-CB 4.38Å; N260-C264 WeakPolarHBondContact O-CB 3.43Å; N260-C264 PolarHBondContact O-N 2.67Å
261	S	96	Very high	94.1	Very high	39 Å²	39	76 Å²	76	27%	0.273	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-25.1	-172.8	61.7	0	0	0	0	114.8	C255 C258	C255-S261 VanDerWaalsContact O-CB 3.25Å; C255-S261 WeakPolarHBondContact O-CB 3.34Å; C258-S261 WeakPolarHBondContact O-CB 3.49Å; C258-S261 PolarHBondContact O-N 3.11Å; C258-S261 PolarHBondContact O-OG 2.97Å
262	D	95.1	Very high	92.8	Very high	63 Å²	63	71 Å²	71	34%	0.337	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-17.8	177.7	67.1	-44.2	0	0	0	113.6	R52 N260 K268	R52-D262 IonicContact CZ-OD2 3.66Å; R52-D262 IonicContact NH1-OD2 3.72Å; R52-D262 IonicContact NH2-OD1 2.82Å; R52-D262 IonicContact NH2-OD2 3.32Å; R52-D262 PolarHBondContact NH2-OD2 3.01Å; N260-D262 PolarHBondContact O-N 3.33Å; D262-K268 WeakPolarHBondContact O-CE 3.37Å; D262-K268 PolarHBondContact O-NZ 3.01Å
263	I	96.1	Very high	91.4	Very high	28 Å²	28	68.3 Å²	68.3	14%	0.144	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-15.7	-177.3	58.3	178.5	0	0	0	114.2	N49 R52 V53 N260 P265	N49-I263 HydrophobicContact CB-CD1 4.38Å; R52-I263 HydrophobicContact CB-CD1 4.47Å; R52-I263 HydrophobicContact CG-CD1 3.99Å; V53-I263 HydrophobicContact CG2-CD1 3.49Å; V53-I263 VanDerWaalsContact CG2-CD1 3.49Å; V53-I263 HydrophobicContact CG2-CG1 3.97Å; N260-I263 HydrophobicContact CB-CG1 4.19Å; N260-I263 PolarHBondContact O-N 3.26Å; N260-I263 VanDerWaalsContact O-N 3.12Å; I263-P265 WeakPolarHBondContact O-CD 3.41Å
264	C	97.1	Very high	89.5	Confident	13 Å²	13	76.6 Å²	76.6	9%	0.088	41%	0.409	C	S	.	.			trans	-77.5	122.6	179.1	174.7	0	0	0	0	111.5	L207 N260 Y266 A267 K268	L207-C264 HydrophobicContact CD2-CB 4.32Å; N260-C264 HydrophobicContact CB-CB 4.38Å; N260-C264 WeakPolarHBondContact O-CB 3.43Å; N260-C264 PolarHBondContact O-N 2.67Å; C264-Y266 VanDerWaalsContact C-N 3.35Å; C264-Y266 PolarHBondContact O-N 3.24Å; C264-A267 HydrophobicContact CB-CB 3.9Å; C264-A267 PolarHBondContact O-N 2.89Å; C264-K268 PolarHBondContact O-N 3.18Å; C264-K268 VanDerWaalsContact O-N 3.14Å
265	P	95.8	Very high	87.2	Confident	67 Å²	67	82.2 Å²	82.2	44%	0.435	43%	0.428	S	S	.	.	H	α-helix	trans	-55.3	-45.6	178.2	-26.6	34.9	0	0	0	113.3	L207 I263 A267 K268 S269	L207-P265 WeakPolarHBondContact O-CD 3.46Å; I263-P265 WeakPolarHBondContact O-CD 3.41Å; P265-A267 VanDerWaalsContact C-N 3.35Å; P265-A267 PolarHBondContact O-N 2.89Å; P265-K268 PolarHBondContact O-N 3.01Å; P265-S269 PolarHBondContact O-N 3.48Å; P265-S269 VanDerWaalsContact O-N 3.1Å; P265-S269 PolarHBondContact O-OG 3.45Å
266	Y	96	Very high	84.9	Confident	69 Å²	69	88 Å²	88	27%	0.271	46%	0.457	S	S	.	.	H	α-helix	trans	-63.8	-36.9	179.3	-177.2	-88.2	0	0	0	113.4	R206 P253 C264 K268 S269 N270	R206-Y266 HydrophobicContact CB-CD2 4.38Å; R206-Y266 HydrophobicContact CB-CG 4.04Å; R206-Y266 HydrophobicContact CG-CD1 4.34Å; R206-Y266 HydrophobicContact CG-CD2 3.68Å; R206-Y266 HydrophobicContact CG-CE2 4.25Å; R206-Y266 HydrophobicContact CG-CG 3.72Å; R206-Y266 WeakPolarHBondContact O-CB 3.44Å; R206-Y266 PolarHBondContact O-N 3.48Å; P253-Y266 HydrophobicContact CG-CD1 4.32Å; P253-Y266 HydrophobicContact CG-CE1 3.55Å; C264-Y266 VanDerWaalsContact C-N 3.35Å; C264-Y266 PolarHBondContact O-N 3.24Å; Y266-K268 VanDerWaalsContact C-N 3.35Å; Y266-S269 PolarHBondContact O-OG 3.46Å; Y266-S269 VanDerWaalsContact O-OG 3.09Å; Y266-N270 WeakPolarHBondContact CE2-ND2 3.43Å; Y266-N270 PolarHBondContact O-N 3.2Å; Y266-N270 PolarHBondContact O-ND2 3.39Å
267	A	94.9	Very high	82.9	Confident	7 Å²	7	90.7 Å²	90.7	6%	0.058	48%	0.476	C	S	.	.	H	α-helix	trans	-70	-35.4	178.6	0	0	0	0	0	111.5	C255 C264 P265 R271	C255-A267 HydrophobicContact CB-CB 4.2Å; C264-A267 HydrophobicContact CB-CB 3.9Å; C264-A267 PolarHBondContact O-N 2.89Å; P265-A267 VanDerWaalsContact C-N 3.35Å; P265-A267 PolarHBondContact O-N 2.89Å; A267-R271 WeakPolarHBondContact O-CG 2.79Å; A267-R271 PolarHBondContact O-N 2.94Å
268	K	93.6	Very high	82.4	Confident	115 Å²	115	92.5 Å²	92.5	50%	0.5	48%	0.481	S	S	.	.	H	α-helix	trans	-67	-43.1	176.3	-71.4	-177.9	179.1	-178.9	0	112.3	D262 C264 P265 Y266 N270	D262-K268 WeakPolarHBondContact O-CE 3.37Å; D262-K268 PolarHBondContact O-NZ 3.01Å; C264-K268 PolarHBondContact O-N 3.18Å; C264-K268 VanDerWaalsContact O-N 3.14Å; P265-K268 PolarHBondContact O-N 3.01Å; Y266-K268 VanDerWaalsContact C-N 3.35Å; K268-N270 VanDerWaalsContact C-N 3.29Å; K268-N270 PolarHBondContact O-N 2.69Å
269	S	90.8	Very high	81.7	Confident	88 Å²	88	96.6 Å²	96.6	62%	0.615	50%	0.502	S	S	*	.	H	α-helix	trans	-70.9	-23.8	-179.2	60.4	0	0	0	0	113.8	P265 Y266	P265-S269 PolarHBondContact O-N 3.48Å; P265-S269 VanDerWaalsContact O-N 3.1Å; P265-S269 PolarHBondContact O-OG 3.45Å; Y266-S269 PolarHBondContact O-OG 3.46Å; Y266-S269 VanDerWaalsContact O-OG 3.09Å
270	N	87.2	Confident	80.8	Confident	92 Å²	92	97.1 Å²	97.1	49%	0.492	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	23.2	-178.8	-65.3	-74.9	0	0	0	113.6	Y266 K268	Y266-N270 WeakPolarHBondContact CE2-ND2 3.43Å; Y266-N270 PolarHBondContact O-N 3.2Å; Y266-N270 PolarHBondContact O-ND2 3.39Å; K268-N270 VanDerWaalsContact C-N 3.29Å; K268-N270 PolarHBondContact O-N 2.69Å
271	R	75.8	Confident	79.8	Confident	155 Å²	155	102.7 Å²	102.7	59%	0.585	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-64	133.7	173.7	-75.9	-172.9	-179.4	-176.2	-1.3	109.5	A267 A273	A267-R271 WeakPolarHBondContact O-CG 2.79Å; A267-R271 PolarHBondContact O-N 2.94Å; R271-A273 PolarHBondContact O-N 3.24Å
272	P	68.1	Low	78.8	Confident	120 Å²	120	106.7 Å²	106.7	78%	0.779	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-58.9	136.1	168.1	24	-29.7	0	0	0	108.6	K274	P272-K274 PolarHBondContact O-N 2.92Å
273	A	66	Low	77.7	Confident	94 Å²	94	109.6 Å²	109.6	78%	0.777	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-51.3	130.9	171.3	0	0	0	0	0	108	R271 R275	R271-A273 PolarHBondContact O-N 3.24Å; A273-R275 PolarHBondContact O-N 3.44Å
274	K	55.2	Low	76.4	Confident	192 Å²	192	115.4 Å²	115.4	84%	0.835	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-50.1	121.7	173.4	-79.1	-176.8	174.1	-177.2	0	106.9	P272 N276	P272-K274 PolarHBondContact O-N 2.92Å; K274-N276 PolarHBondContact O-N 3Å; K274-N276 VanDerWaalsContact O-N 3.09Å
275	R	49.3	Very low	74.8	Confident	226 Å²	226	123.3 Å²	123.3	85%	0.853	63%	0.632	S	S	*	*			trans	-61.3	115.2	162.3	-84.9	-175	174.9	-169.9	-2.6	105.1	A273 D277	A273-R275 PolarHBondContact O-N 3.44Å; R275-D277 VanDerWaalsContact C-N 3.32Å; R275-D277 PolarHBondContact O-N 3.02Å; R275-D277 VanDerWaalsContact O-N 3.16Å
276	N	47.8	Very low	73.1	Confident	156 Å²	156	128 Å²	128	83%	0.834	65%	0.649	S	S	*	*			trans	-69	103	160.5	-70.9	-14.9	0	0	0	104.5	K274	K274-N276 PolarHBondContact O-N 3Å; K274-N276 VanDerWaalsContact O-N 3.09Å
277	D	52.2	Low	71	Confident	222 Å²	222	133.4 Å²	133.4	100%	1.187	68%	0.683	S	S	*	*			trans	-76.4	0	157	-74.5	-19.4	0	0	0	108.4	R275	R275-D277 VanDerWaalsContact C-N 3.32Å; R275-D277 PolarHBondContact O-N 3.02Å; R275-D277 VanDerWaalsContact O-N 3.16Å

Retrieved 277 of 277 residues in 1450.2 ms (Link to these results)

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