A0A096N4C9_PAPAN Loading...

Ankyrin repeat domain 45

AlphaFold DB (A0A2K5WAJ6), UniProt , Accession A0A096N4C9, Species PAPAN (Papio anubis, Olive baboon), Gene ANKRD45, Length 266 aa.

Structure Viewer

Loading PAE data...

(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	43.3	Very low	38.7	Very low	248 Å²	248	152.6 Å²	152.6	100%	1.222	87%	0.865	S	S	*	*				0	91.4	0	-87.4	-179.8	168.1	0	0	106.4
2	E	38.7	Very low	38.7	Very low	194 Å²	194	149.3 Å²	149.3	91%	0.907	86%	0.859	S	S	*	*			trans	-152.9	142.8	172.5	-66.3	-178.1	141.6	0	0	102.9
3	S	38.4	Very low	38.4	Very low	119 Å²	119	152.7 Å²	152.7	83%	0.832	86%	0.862	S	S	*	*			cis	-164.8	164.8	20.2	45.3	0	0	0	0	111
4	E	39.3	Very low	38.1	Very low	199 Å²	199	155.6 Å²	155.6	93%	0.93	86%	0.861	S	S	*	*			trans	-57.6	161.1	179.8	-64.8	179.3	140.2	0	0	118.2
5	G	34.9	Very low	37.5	Very low	72 Å²	72	157.9 Å²	157.9	74%	0.742	86%	0.859	S	S	*	*			trans	142.7	110.8	148.6	0	0	0	0	0	116.3
6	P	43.8	Very low	37.3	Very low	127 Å²	127	153.6 Å²	153.6	83%	0.825	85%	0.845	S	S	*	*			trans	-99.1	177	179.6	40.9	-33	0	0	0	113.4
7	P	44.1	Very low	37.1	Very low	123 Å²	123	154.5 Å²	154.5	80%	0.799	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-89.3	159.7	-144.4	36.8	-35.8	0	0	0	115.5
8	E	34.6	Very low	37	Very low	197 Å²	197	155.6 Å²	155.6	92%	0.921	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-61.1	130.7	174.8	-64	-176.1	155.5	0	0	111.9
9	S	36.7	Very low	36.9	Very low	105 Å²	105	155.1 Å²	155.1	73%	0.734	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-96.7	125.9	176.3	52.8	0	0	0	0	110.6
10	E	37.9	Very low	37	Very low	199 Å²	199	155.6 Å²	155.6	93%	0.93	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-59.1	129.2	164.2	-59.3	-175.8	134.4	0	0	110.6
11	S	34.5	Very low	36.9	Very low	96 Å²	96	155.7 Å²	155.7	67%	0.671	82%	0.824	S	S	*	*			trans	-148.2	94.9	162.8	53.5	0	0	0	0	110.2	E13	S11-E13 PolarHBondContact O-N 2.84Å
12	S	38.6	Very low	36.7	Very low	113 Å²	113	148.2 Å²	148.2	79%	0.79	79%	0.789	S	S	*	*			trans	22.7	93.4	138.6	66.4	0	0	0	0	117.4
13	E	34.8	Very low	36.7	Very low	193 Å²	193	144.9 Å²	144.9	90%	0.902	77%	0.774	S	S	*	*			trans	-99.6	80.3	148	-72	-166.5	150.1	0	0	108.3	S11 F15	S11-E13 PolarHBondContact O-N 2.84Å; E13-F15 PolarHBondContact O-N 2.91Å; E13-F15 VanDerWaalsContact O-N 3.13Å
14	F	33.7	Very low	36.9	Very low	194 Å²	194	147.3 Å²	147.3	85%	0.851	77%	0.772	S	S	*	*			trans	-72.8	83.5	155.5	-170.7	-91.3	0	0	0	106
15	F	29.8	Very low	37.4	Very low	189 Å²	189	141.6 Å²	141.6	83%	0.829	75%	0.745	S	S	*	*			trans	-126.4	108.2	167	-138.3	-95.1	0	0	0	107.8	E13 Q17	E13-F15 PolarHBondContact O-N 2.91Å; E13-F15 VanDerWaalsContact O-N 3.13Å; F15-Q17 PolarHBondContact O-N 2.97Å
16	S	33.1	Very low	37.6	Very low	90 Å²	90	145.1 Å²	145.1	63%	0.629	74%	0.742	S	S	*	*			trans	-33.8	101	177.6	-40	0	0	0	0	111.8	Q18	S16-Q18 PolarHBondContact O-N 2.99Å
17	Q	34.3	Very low	37.7	Very low	169 Å²	169	143.3 Å²	143.3	79%	0.79	73%	0.728	S	S	*	*			trans	-66.7	86.6	149.3	-68.6	174.5	17.3	0	0	104.8	F15 E19	F15-Q17 PolarHBondContact O-N 2.97Å; Q17-E19 PolarHBondContact O-N 3.01Å
18	Q	35.1	Very low	37.5	Very low	173 Å²	173	142.8 Å²	142.8	81%	0.808	72%	0.715	S	S	*	*			trans	-63.8	92.3	145.9	-90.2	175.2	-53.3	0	0	103.5	S16 E20	S16-Q18 PolarHBondContact O-N 2.99Å; Q18-E20 PolarHBondContact O-N 3.05Å
19	E	36	Very low	38.1	Very low	146 Å²	146	141.2 Å²	141.2	68%	0.682	71%	0.708	S	S	*	*			trans	-52.1	95.1	155	-70.2	170.7	153.5	0	0	104.6	Q17 E21	Q17-E19 PolarHBondContact O-N 3.01Å; E19-E21 HydrophobicContact CB-CG 4.44Å; E19-E21 PolarHBondContact O-N 3.21Å
20	E	39.5	Very low	38.5	Very low	165 Å²	165	139.8 Å²	139.8	77%	0.771	70%	0.696	S	S	*	*			trans	-61.3	89.4	149.6	-69.9	-158.6	170.8	0	0	103.8	Q18 D22	Q18-E20 PolarHBondContact O-N 3.05Å; E20-D22 PolarHBondContact O-N 3.02Å
21	E	34.8	Very low	38.7	Very low	158 Å²	158	137.8 Å²	137.8	74%	0.738	69%	0.687	S	S	*	*			trans	-60.5	80.5	156.8	-72.9	-179.8	157.2	0	0	105.2	E19 E23	E19-E21 HydrophobicContact CB-CG 4.44Å; E19-E21 PolarHBondContact O-N 3.21Å; E21-E23 PolarHBondContact O-N 3.15Å
22	D	37.3	Very low	39.4	Very low	92 Å²	92	140.2 Å²	140.2	49%	0.492	69%	0.688	S	S	.	*			trans	-58.1	86.7	153.4	-87.8	-40.9	0	0	0	105.3	E20 E24 R142	E20-D22 PolarHBondContact O-N 3.02Å; D22-E24 PolarHBondContact O-N 2.93Å; D22-R142 IonicContact OD1-CZ 3.78Å; D22-R142 IonicContact OD1-NH1 3.34Å; D22-R142 PolarHBondContact OD1-NH1 2.9Å; D22-R142 IonicContact OD1-NH2 3.17Å
23	E	40.4	Very low	39.7	Very low	124 Å²	124	141 Å²	141	58%	0.579	69%	0.688	S	S	*	*			trans	-57	80.7	143.3	-70.2	-178.1	165	0	0	105.4	E21 E25 R109	E21-E23 PolarHBondContact O-N 3.15Å; E23-E25 PolarHBondContact O-N 3.01Å; E23-R109 IonicContact OE2-NH1 2.65Å; E23-R109 IonicContact OE2-NH2 3.4Å; E23-R109 PolarHBondContact OE2-NH2 3.29Å
24	E	42.8	Very low	40.5	Very low	170 Å²	170	134.6 Å²	134.6	79%	0.794	67%	0.673	S	S	*	*			trans	-44.9	105.4	148.7	-68.4	-176.6	172.9	0	0	103.6	D22 E26	D22-E24 PolarHBondContact O-N 2.93Å; E24-E26 PolarHBondContact O-N 3.15Å
25	E	47.9	Very low	41.6	Very low	78 Å²	78	130.9 Å²	130.9	36%	0.364	67%	0.669	S	S	.	*			trans	-57.8	99.6	163	-84.7	-171.2	-178.6	0	0	104	E23 V27 R109	E23-E25 PolarHBondContact O-N 3.01Å; E25-V27 WeakPolarHBondContact O-CG2 3.43Å; E25-V27 PolarHBondContact O-N 3.11Å; E25-R109 WeakPolarHBondContact OE1-CD 3.42Å; E25-R109 IonicContact OE1-CZ 2.7Å; E25-R109 IonicContact OE1-NE 3.66Å; E25-R109 IonicContact OE1-NH1 3.43Å; E25-R109 PolarHBondContact OE1-NH1 3.08Å
26	E	39.6	Very low	43.9	Very low	147 Å²	147	130.6 Å²	130.6	69%	0.687	66%	0.662	S	S	*	*			trans	-46.3	112.3	173	-146.8	178	-149.5	0	0	103.8	E24 Q28	E24-E26 PolarHBondContact O-N 3.15Å; E26-Q28 HydrophobicContact CB-CG 4.09Å; E26-Q28 HydrophobicContact CG-CG 4.31Å; E26-Q28 PolarHBondContact O-N 3.46Å; E26-Q28 PolarHBondContact OE2-NE2 3.37Å
27	V	46.9	Very low	46.5	Very low	88 Å²	88	127.4 Å²	127.4	53%	0.533	64%	0.638	S	S	.	*			trans	-70.4	69	-175.4	-177.9	0	0	0	0	106	E25 E29 W120	E25-V27 WeakPolarHBondContact O-CG2 3.43Å; E25-V27 PolarHBondContact O-N 3.11Å; V27-E29 PolarHBondContact O-N 3.06Å; V27-W120 HydrophobicContact CG1-CH2 3.14Å; V27-W120 HydrophobicContact CG1-CZ2 3.33Å; V27-W120 HydrophobicContact CG1-CZ3 4.02Å
28	Q	38.4	Very low	49.2	Very low	112 Å²	112	121 Å²	121	52%	0.523	61%	0.611	S	S	.	*			trans	-78.5	114.6	-178.6	-72.7	-176.2	3.5	0	0	105.7	E26	E26-Q28 HydrophobicContact CB-CG 4.09Å; E26-Q28 HydrophobicContact CG-CG 4.31Å; E26-Q28 PolarHBondContact O-N 3.46Å; E26-Q28 PolarHBondContact OE2-NE2 3.37Å
29	E	47.9	Very low	51.9	Low	165 Å²	165	112.8 Å²	112.8	77%	0.771	57%	0.573	S	S	*	*			trans	-45.1	137	156.3	-63.1	-169.4	163.4	0	0	107.9	V27 E31	V27-E29 PolarHBondContact O-N 3.06Å; E29-E31 PolarHBondContact O-N 3.36Å
30	P	45.4	Very low	54.5	Low	74 Å²	74	108.2 Å²	108.2	48%	0.481	55%	0.553	S	S	.	*			trans	-59.9	110.1	-173.5	24.1	-31.8	0	0	0	109	E32	P30-E32 PolarHBondContact O-N 3.36Å
31	E	42.9	Very low	57	Low	157 Å²	157	104 Å²	104	73%	0.734	53%	0.533	S	S	*	.			trans	-60.7	111.3	171.5	-72.9	-140.3	157.6	0	0	108.4	E29 T33	E29-E31 PolarHBondContact O-N 3.36Å; E31-T33 VanDerWaalsContact C-N 3.31Å; E31-T33 PolarHBondContact O-N 3.49Å; E31-T33 PolarHBondContact O-OG1 3.3Å
32	E	49.2	Very low	59.8	Low	148 Å²	148	97.2 Å²	97.2	69%	0.692	50%	0.503	S	S	*	.			trans	-61.2	83.9	178	-79.9	-168.6	143	0	0	111	P30	P30-E32 PolarHBondContact O-N 3.36Å
33	T	44.3	Very low	62.4	Low	129 Å²	129	92.9 Å²	92.9	79%	0.791	48%	0.479	S	S	*	.			trans	-132.7	29.2	176.1	57.5	0	0	0	0	113.5	E31	E31-T33 VanDerWaalsContact C-N 3.31Å; E31-T33 PolarHBondContact O-N 3.49Å; E31-T33 PolarHBondContact O-OG1 3.3Å
34	G	51.6	Low	64.9	Low	58 Å²	58	89.4 Å²	89.4	60%	0.598	47%	0.465	S	S	*	.	S	Bend	trans	-121.7	165.4	172.6	0	0	0	0	0	113.6	R36	G34-R36 PolarHBondContact O-N 2.99Å
35	P	56.8	Low	67.3	Low	116 Å²	116	85.6 Å²	85.6	75%	0.753	45%	0.453	S	S	*	.			trans	-54.6	128.7	169.3	24.8	-31.9	0	0	0	109.3	N37	P35-N37 PolarHBondContact O-N 3.19Å
36	R	77	Confident	69.5	Low	184 Å²	184	83.1 Å²	83.1	69%	0.694	45%	0.449	S	S	*	.			trans	-65.8	100.4	-169	-164.9	178	-169.8	-170.9	1.6	110.5	G34 P38	G34-R36 PolarHBondContact O-N 2.99Å; R36-P38 WeakPolarHBondContact O-CD 3.35Å
37	N	87.8	Confident	72.1	Confident	23 Å²	23	79.5 Å²	79.5	12%	0.123	43%	0.434	C	S	.	.			trans	-61.6	117	173.7	-176.3	-27.8	0	0	0	108.7	P35 L39 L40 L69	P35-N37 PolarHBondContact O-N 3.19Å; N37-L39 PolarHBondContact O-N 2.98Å; N37-L39 VanDerWaalsContact OD1-CB 3.31Å; N37-L39 WeakPolarHBondContact OD1-CB 3.46Å; N37-L39 PolarHBondContact OD1-N 3Å; N37-L40 HydrophobicContact CB-CB 4.29Å; N37-L40 VanDerWaalsContact O-CB 3.29Å; N37-L40 WeakPolarHBondContact O-CB 3.49Å; N37-L40 PolarHBondContact O-N 3.09Å; N37-L69 PolarHBondContact ND2-O 3.33Å
38	P	90.8	Very high	74.4	Confident	35 Å²	35	76.8 Å²	76.8	23%	0.227	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-19.1	-174.8	28.4	-36.4	0	0	0	112.9	R36 P42 I54 H62 L69	R36-P38 WeakPolarHBondContact O-CD 3.35Å; P38-P42 WeakPolarHBondContact O-CD 3.43Å; P38-I54 HydrophobicContact CB-CD1 4.44Å; P38-H62 HydrophobicContact CG-CB 4.08Å; P38-L69 HydrophobicContact CG-CD1 3.79Å
39	L	92.5	Very high	77.1	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-20.9	175.7	-58.6	174.3	0	0	0	112.5	N37 P42 A43 I54 F55 L69 L70 L80	N37-L39 PolarHBondContact O-N 2.98Å; N37-L39 VanDerWaalsContact OD1-CB 3.31Å; N37-L39 WeakPolarHBondContact OD1-CB 3.46Å; N37-L39 PolarHBondContact OD1-N 3Å; L39-P42 WeakPolarHBondContact O-CD 3.34Å; L39-A43 WeakPolarHBondContact O-CB 3.38Å; L39-A43 PolarHBondContact O-N 3.49Å; L39-I54 HydrophobicContact CD2-CB 3.95Å; L39-I54 HydrophobicContact CD2-CD1 3.71Å; L39-I54 HydrophobicContact CD2-CG1 4.43Å; L39-I54 HydrophobicContact CD2-CG2 3.72Å; L39-F55 HydrophobicContact CD1-CE2 4.21Å; L39-F55 HydrophobicContact CD1-CZ 4Å; L39-F55 HydrophobicContact CD2-CD2 4.44Å; L39-F55 HydrophobicContact CD2-CE2 3.73Å; L39-F55 HydrophobicContact CD2-CZ 4.32Å; L39-L69 HydrophobicContact CD1-CB 3.7Å; L39-L69 HydrophobicContact CG-CB 4.41Å; L39-L70 HydrophobicContact CD1-CB 4.26Å; L39-L80 HydrophobicContact CB-CD1 3.98Å; L39-L80 HydrophobicContact CB-CD2 3.51Å; L39-L80 HydrophobicContact CB-CG 4.41Å; L39-L80 HydrophobicContact CD1-CD2 4Å; L39-L80 HydrophobicContact CG-CD2 4.36Å
40	L	90.9	Very high	79.2	Confident	50 Å²	50	72.2 Å²	72.2	26%	0.262	40%	0.402	S	S	.	.	H	α-helix	trans	-64.2	-46.9	-172.9	-175.3	63.3	0	0	0	112.7	N37 A43 L44 L80 A83	N37-L40 HydrophobicContact CB-CB 4.29Å; N37-L40 VanDerWaalsContact O-CB 3.29Å; N37-L40 WeakPolarHBondContact O-CB 3.49Å; N37-L40 PolarHBondContact O-N 3.09Å; L40-A43 PolarHBondContact O-N 3.13Å; L40-L44 HydrophobicContact CD1-CD1 4.06Å; L40-L44 HydrophobicContact CD1-CG 4.17Å; L40-L44 HydrophobicContact CG-CD1 3.96Å; L40-L44 HydrophobicContact CG-CG 4.42Å; L40-L44 VanDerWaalsContact O-CG 3.31Å; L40-L44 WeakPolarHBondContact O-CG 3.5Å; L40-L44 PolarHBondContact O-N 3.2Å; L40-L80 HydrophobicContact CB-CD1 4.26Å; L40-L80 HydrophobicContact CD1-CD1 4.11Å; L40-A83 HydrophobicContact CD1-CB 3.93Å
41	Q	91.6	Very high	81.5	Confident	77 Å²	77	68.7 Å²	68.7	36%	0.36	38%	0.379	S	S	.	.	H	α-helix	trans	-61.8	-52.6	-179.9	-74.7	-72.8	-49.3	0	0	111.6	A43 L44 T45	Q41-A43 VanDerWaalsContact C-N 3.25Å; Q41-A43 PolarHBondContact O-N 3.25Å; Q41-L44 PolarHBondContact O-N 3.38Å; Q41-T45 WeakPolarHBondContact O-CG2 3.48Å; Q41-T45 PolarHBondContact O-N 2.67Å; Q41-T45 PolarHBondContact O-OG1 3.41Å
42	P	93.1	Very high	83.9	Confident	15 Å²	15	63.5 Å²	63.5	10%	0.097	35%	0.354	C	S	.	.	H	α-helix	trans	-55.3	-39.6	173.2	-26.6	33.5	0	0	0	113.9	P38 L39 L44 G46 D47 L51	P38-P42 WeakPolarHBondContact O-CD 3.43Å; L39-P42 WeakPolarHBondContact O-CD 3.34Å; P42-L44 VanDerWaalsContact C-N 3.33Å; P42-L44 PolarHBondContact O-N 3.08Å; P42-G46 PolarHBondContact O-N 3.31Å; P42-D47 HydrophobicContact CB-CB 4.12Å; P42-D47 WeakPolarHBondContact CB-O 3.2Å; P42-D47 PolarHBondContact O-N 3.37Å; P42-L51 HydrophobicContact CB-CB 3.93Å
43	A	93.5	Very high	86.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-69.2	-28.5	-179.4	0	0	0	0	0	113.9	L39 L40 Q41 L80 A84 Q89 V92	L39-A43 WeakPolarHBondContact O-CB 3.38Å; L39-A43 PolarHBondContact O-N 3.49Å; L40-A43 PolarHBondContact O-N 3.13Å; Q41-A43 VanDerWaalsContact C-N 3.25Å; Q41-A43 PolarHBondContact O-N 3.25Å; A43-L80 HydrophobicContact CB-CD1 3.6Å; A43-L80 HydrophobicContact CB-CD2 4.21Å; A43-L80 HydrophobicContact CB-CG 3.84Å; A43-A84 HydrophobicContact CB-CB 4.37Å; A43-Q89 VanDerWaalsContact O-CG 3.25Å; A43-Q89 WeakPolarHBondContact O-CG 3.43Å; A43-V92 HydrophobicContact CB-CG1 4.05Å
44	L	92.7	Very high	88.5	Confident	52 Å²	52	56.7 Å²	56.7	27%	0.272	31%	0.312	S	S	.	.	H	α-helix	trans	-84.9	-34.8	176.8	-70.5	175.4	0	0	0	112.6	L40 Q41 P42 A83 A87 Q89	L40-L44 HydrophobicContact CD1-CD1 4.06Å; L40-L44 HydrophobicContact CD1-CG 4.17Å; L40-L44 HydrophobicContact CG-CD1 3.96Å; L40-L44 HydrophobicContact CG-CG 4.42Å; L40-L44 VanDerWaalsContact O-CG 3.31Å; L40-L44 WeakPolarHBondContact O-CG 3.5Å; L40-L44 PolarHBondContact O-N 3.2Å; Q41-L44 PolarHBondContact O-N 3.38Å; P42-L44 VanDerWaalsContact C-N 3.33Å; P42-L44 PolarHBondContact O-N 3.08Å; L44-A83 HydrophobicContact CD2-CB 4.07Å; L44-A87 HydrophobicContact CD2-CB 3.87Å; L44-Q89 PolarHBondContact O-NE2 3.04Å
45	T	92.8	Very high	90.5	Very high	90 Å²	90	54.8 Å²	54.8	55%	0.552	29%	0.287	S	S	*	.	H	α-helix	trans	-88.3	-14.8	-177.3	59.8	0	0	0	0	113.8	Q41 Q89	Q41-T45 WeakPolarHBondContact O-CG2 3.48Å; Q41-T45 PolarHBondContact O-N 2.67Å; Q41-T45 PolarHBondContact O-OG1 3.41Å; T45-Q89 VanDerWaalsContact C-NE2 3.34Å
46	G	92.9	Very high	92.2	Very high	26 Å²	26	55.2 Å²	55.2	27%	0.268	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	17.1	-175.8	0	0	0	0	0	113.7	P42 V48 Q89	P42-G46 PolarHBondContact O-N 3.31Å; G46-V48 VanDerWaalsContact C-N 3.3Å; G46-V48 PolarHBondContact O-N 3.14Å; G46-Q89 VanDerWaalsContact CA-CD 3.47Å
47	D	94.8	Very high	93.1	Very high	71 Å²	71	48.6 Å²	48.6	38%	0.38	26%	0.258	S	S	.	.			trans	-76.1	80.2	178	-179.3	14.6	0	0	0	111	P42 E49 G50 L51	P42-D47 HydrophobicContact CB-CB 4.12Å; P42-D47 WeakPolarHBondContact CB-O 3.2Å; P42-D47 PolarHBondContact O-N 3.37Å; D47-E49 VanDerWaalsContact C-N 3.3Å; D47-E49 PolarHBondContact O-N 3.31Å; D47-E49 PolarHBondContact OD1-N 3.42Å; D47-G50 PolarHBondContact OD1-N 3.39Å; D47-G50 WeakPolarHBondContact OD2-CA 3.37Å; D47-L51 VanDerWaalsContact O-CB 3.31Å; D47-L51 WeakPolarHBondContact O-CB 3.4Å; D47-L51 PolarHBondContact O-N 2.98Å
48	V	95.6	Very high	93.3	Very high	31 Å²	31	52.4 Å²	52.4	19%	0.188	28%	0.284	C	S	.	.	H	α-helix	trans	-64	-35.9	179.1	177.9	0	0	0	0	111.7	G46 L51 Q52 D91 V92 A95	G46-V48 VanDerWaalsContact C-N 3.3Å; G46-V48 PolarHBondContact O-N 3.14Å; V48-L51 PolarHBondContact O-N 2.98Å; V48-Q52 HydrophobicContact CG1-CG 4.25Å; V48-Q52 WeakPolarHBondContact O-CB 3.49Å; V48-Q52 VanDerWaalsContact O-CG 3.29Å; V48-Q52 WeakPolarHBondContact O-CG 3.39Å; V48-Q52 PolarHBondContact O-N 3.46Å; V48-D91 HydrophobicContact CG2-CB 3.82Å; V48-V92 HydrophobicContact CG2-CG2 3.99Å; V48-A95 HydrophobicContact CG1-CB 3.77Å
49	E	94.3	Very high	93.4	Very high	160 Å²	160	59.1 Å²	59.1	75%	0.748	31%	0.312	S	S	*	.	H	α-helix	trans	-68.7	-47.9	-179.2	-66.4	-176.2	-178.2	0	0	111.1	D47 L51 Q52 K53	D47-E49 VanDerWaalsContact C-N 3.3Å; D47-E49 PolarHBondContact O-N 3.31Å; D47-E49 PolarHBondContact OD1-N 3.42Å; E49-L51 VanDerWaalsContact C-N 3.27Å; E49-L51 PolarHBondContact O-N 3.07Å; E49-Q52 PolarHBondContact O-N 2.94Å; E49-K53 WeakPolarHBondContact O-CB 3.31Å; E49-K53 PolarHBondContact O-N 2.92Å
50	G	92.6	Very high	93.3	Very high	21 Å²	21	60.5 Å²	60.5	22%	0.216	32%	0.319	C	S	.	.	H	α-helix	trans	-61.3	-38.3	175.5	0	0	0	0	0	112.1	D47 I54	D47-G50 PolarHBondContact OD1-N 3.39Å; D47-G50 WeakPolarHBondContact OD2-CA 3.37Å; G50-I54 PolarHBondContact O-N 3.47Å
51	L	94.3	Very high	93.3	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-64	-52.6	173.7	-174.6	147	0	0	0	111.5	P42 D47 V48 E49 K53 I54 F55 V92 L96	P42-L51 HydrophobicContact CB-CB 3.93Å; D47-L51 VanDerWaalsContact O-CB 3.31Å; D47-L51 WeakPolarHBondContact O-CB 3.4Å; D47-L51 PolarHBondContact O-N 2.98Å; V48-L51 PolarHBondContact O-N 2.98Å; E49-L51 VanDerWaalsContact C-N 3.27Å; E49-L51 PolarHBondContact O-N 3.07Å; L51-K53 PolarHBondContact O-N 3.36Å; L51-I54 WeakPolarHBondContact O-CB 3.35Å; L51-I54 PolarHBondContact O-N 3.2Å; L51-F55 HydrophobicContact CD2-CD2 3.9Å; L51-F55 HydrophobicContact CD2-CE2 3.83Å; L51-F55 HydrophobicContact CG-CD2 4.45Å; L51-F55 HydrophobicContact CG-CE2 4.18Å; L51-F55 WeakPolarHBondContact O-CD2 3.28Å; L51-F55 PolarHBondContact O-N 3.37Å; L51-V92 HydrophobicContact CD1-CG1 3.92Å; L51-L96 HydrophobicContact CD1-CD1 4.08Å; L51-L96 HydrophobicContact CD1-CD2 3.99Å; L51-L96 HydrophobicContact CD1-CG 4.04Å; L51-L96 HydrophobicContact CD2-CD2 3.64Å; L51-L96 HydrophobicContact CD2-CG 4.08Å; L51-L96 HydrophobicContact CG-CD2 4.26Å
52	Q	93.8	Very high	93.3	Very high	47 Å²	47	63.2 Å²	63.2	22%	0.22	34%	0.34	C	S	.	.	H	α-helix	trans	-59.4	-38.4	179.7	-79.2	172.4	-8.6	0	0	111.6	V48 E49 I54 F55 E56	V48-Q52 HydrophobicContact CG1-CG 4.25Å; V48-Q52 WeakPolarHBondContact O-CB 3.49Å; V48-Q52 VanDerWaalsContact O-CG 3.29Å; V48-Q52 WeakPolarHBondContact O-CG 3.39Å; V48-Q52 PolarHBondContact O-N 3.46Å; E49-Q52 PolarHBondContact O-N 2.94Å; Q52-I54 PolarHBondContact O-N 3.25Å; Q52-F55 CarbonylContact O-C 3.59Å; Q52-F55 PolarHBondContact O-N 2.92Å; Q52-E56 WeakPolarHBondContact O-CB 3.5Å; Q52-E56 WeakPolarHBondContact O-CG 3.17Å; Q52-E56 PolarHBondContact O-N 2.91Å
53	K	94.6	Very high	93.3	Very high	122 Å²	122	65.3 Å²	65.3	53%	0.53	35%	0.349	S	S	.	.	H	α-helix	trans	-56.5	-38.3	175.2	-172.1	175.2	-178.6	178	0	112.3	E49 L51 F55 D57	E49-K53 WeakPolarHBondContact O-CB 3.31Å; E49-K53 PolarHBondContact O-N 2.92Å; L51-K53 PolarHBondContact O-N 3.36Å; K53-F55 VanDerWaalsContact C-N 3.31Å; K53-F55 PolarHBondContact O-N 3.22Å; K53-D57 VanDerWaalsContact CE-OD2 3.31Å; K53-D57 WeakPolarHBondContact CE-OD2 3.49Å; K53-D57 HydrophobicContact CG-CB 4.01Å; K53-D57 WeakPolarHBondContact O-CB 3.43Å; K53-D57 PolarHBondContact O-N 3.24Å
54	I	94.3	Very high	93.3	Very high	13 Å²	13	74.1 Å²	74.1	7%	0.067	39%	0.39	C	S	.	.	H	α-helix	trans	-64.8	-38	177.1	-64.8	164.4	0	0	0	111	P38 L39 G50 L51 Q52 H62 H63 A66	P38-I54 HydrophobicContact CB-CD1 4.44Å; L39-I54 HydrophobicContact CD2-CB 3.95Å; L39-I54 HydrophobicContact CD2-CD1 3.71Å; L39-I54 HydrophobicContact CD2-CG1 4.43Å; L39-I54 HydrophobicContact CD2-CG2 3.72Å; G50-I54 PolarHBondContact O-N 3.47Å; L51-I54 WeakPolarHBondContact O-CB 3.35Å; L51-I54 PolarHBondContact O-N 3.2Å; Q52-I54 PolarHBondContact O-N 3.25Å; I54-H62 HydrophobicContact CG2-CB 4.01Å; I54-H63 VanDerWaalsContact O-CA 3.31Å; I54-H63 WeakPolarHBondContact O-CA 3.48Å; I54-H63 PolarHBondContact O-ND1 2.97Å; I54-A66 HydrophobicContact CG2-CB 4.07Å
55	F	93.7	Very high	93.3	Very high	17 Å²	17	76.4 Å²	76.4	8%	0.075	40%	0.399	C	S	.	.	H	α-helix	trans	-81.7	-26.3	179.6	-74.7	-86.6	0	0	0	114.6	L39 L51 Q52 K53 H63 A66 M67 L70 L96 Y99	L39-F55 HydrophobicContact CD1-CE2 4.21Å; L39-F55 HydrophobicContact CD1-CZ 4Å; L39-F55 HydrophobicContact CD2-CD2 4.44Å; L39-F55 HydrophobicContact CD2-CE2 3.73Å; L39-F55 HydrophobicContact CD2-CZ 4.32Å; L51-F55 HydrophobicContact CD2-CD2 3.9Å; L51-F55 HydrophobicContact CD2-CE2 3.83Å; L51-F55 HydrophobicContact CG-CD2 4.45Å; L51-F55 HydrophobicContact CG-CE2 4.18Å; L51-F55 WeakPolarHBondContact O-CD2 3.28Å; L51-F55 PolarHBondContact O-N 3.37Å; Q52-F55 CarbonylContact O-C 3.59Å; Q52-F55 PolarHBondContact O-N 2.92Å; K53-F55 VanDerWaalsContact C-N 3.31Å; K53-F55 PolarHBondContact O-N 3.22Å; F55-H63 PolarHBondContact O-CE1 3.24Å; F55-H63 PolarHBondContact O-ND1 2.88Å; F55-A66 HydrophobicContact CD1-CB 3.65Å; F55-A66 HydrophobicContact CE1-CB 3.63Å; F55-A66 HydrophobicContact CG-CB 4.15Å; F55-A66 HydrophobicContact CZ-CB 4.1Å; F55-M67 HydrophobicContact CD1-SD 4.43Å; F55-M67 HydrophobicContact CE1-SD 3.88Å; F55-L70 HydrophobicContact CE1-CD2 4.09Å; F55-L70 HydrophobicContact CZ-CB 4.16Å; F55-L70 HydrophobicContact CZ-CD2 3.85Å; F55-L96 HydrophobicContact CE2-CD2 3.71Å; F55-L96 HydrophobicContact CZ-CD2 3.87Å; F55-Y99 HydrophobicContact CB-CE1 3.61Å; F55-Y99 HydrophobicContact CB-CE2 4.11Å; F55-Y99 WeakPolarHBondContact CB-OH 3.49Å; F55-Y99 AromaticContact CD1-CD1 3.82Å; F55-Y99 HydrophobicContact CD1-CD1 3.82Å; F55-Y99 HydrophobicContact CD1-CD2 4.07Å; F55-Y99 AromaticContact CD1-CE1 3.7Å; F55-Y99 HydrophobicContact CD1-CE1 3.7Å; F55-Y99 AromaticContact CD1-CE2 3.96Å; F55-Y99 HydrophobicContact CD1-CE2 3.96Å; F55-Y99 HydrophobicContact CD1-CG 4.02Å; F55-Y99 AromaticContact CD1-CZ 3.78Å; F55-Y99 HydrophobicContact CD2-CD2 4.49Å; F55-Y99 AromaticContact CD2-CE2 3.86Å; F55-Y99 HydrophobicContact CD2-CE2 3.86Å; F55-Y99 AromaticContact CD2-CZ 3.99Å; F55-Y99 HydrophobicContact CE1-CD1 4.38Å; F55-Y99 HydrophobicContact CE1-CD2 4.13Å; F55-Y99 HydrophobicContact CE1-CE2 4.37Å; F55-Y99 HydrophobicContact CE1-CG 4.16Å; F55-Y99 HydrophobicContact CE2-CE2 4.29Å; F55-Y99 HydrophobicContact CG-CD1 4.34Å; F55-Y99 HydrophobicContact CG-CD2 4.27Å; F55-Y99 AromaticContact CG-CE1 3.77Å; F55-Y99 HydrophobicContact CG-CE1 3.77Å; F55-Y99 AromaticContact CG-CE2 3.7Å; F55-Y99 HydrophobicContact CG-CE2 3.7Å; F55-Y99 AromaticContact CG-CZ 3.43Å; F55-Y99 VanDerWaalsContact CG-CZ 3.43Å; F55-Y99 HydrophobicContact CZ-CD2 4.4Å
56	E	93.8	Very high	93.4	Very high	125 Å²	125	72.2 Å²	72.2	58%	0.584	37%	0.374	S	S	*	.	H	α-helix	trans	-105.7	-26.4	-169.8	-66.4	178.8	-171.9	0	0	113.7	Q52 P58	Q52-E56 WeakPolarHBondContact O-CB 3.5Å; Q52-E56 WeakPolarHBondContact O-CG 3.17Å; Q52-E56 PolarHBondContact O-N 2.91Å; E56-P58 VanDerWaalsContact O-CD 3.27Å; E56-P58 WeakPolarHBondContact O-CD 3.35Å
57	D	94.5	Very high	93.4	Very high	45 Å²	45	74.7 Å²	74.7	24%	0.241	38%	0.379	C	S	.	.			trans	-90	108.7	-177.1	-175.2	-4	0	0	0	111.2	K53 E59 N60 H63	K53-D57 VanDerWaalsContact CE-OD2 3.31Å; K53-D57 WeakPolarHBondContact CE-OD2 3.49Å; K53-D57 HydrophobicContact CG-CB 4.01Å; K53-D57 WeakPolarHBondContact O-CB 3.43Å; K53-D57 PolarHBondContact O-N 3.24Å; D57-E59 PolarHBondContact O-N 2.89Å; D57-E59 WeakPolarHBondContact OD1-CB 3.33Å; D57-E59 PolarHBondContact OD1-N 3.32Å; D57-N60 HydrophobicContact CB-CB 4.18Å; D57-N60 WeakPolarHBondContact O-CB 3.22Å; D57-N60 PolarHBondContact O-N 3.22Å; D57-H63 WeakPolarHBondContact O-CB 3.38Å
58	P	92.2	Very high	93.4	Very high	103 Å²	103	78.2 Å²	78.2	67%	0.669	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-17.1	-179.9	-18.3	33.7	0	0	0	113.5	E56 N60	E56-P58 VanDerWaalsContact O-CD 3.27Å; E56-P58 WeakPolarHBondContact O-CD 3.35Å; P58-N60 VanDerWaalsContact C-N 3.26Å
59	E	92.8	Very high	93.3	Very high	176 Å²	176	77.8 Å²	77.8	82%	0.822	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-11.2	174.6	-57.8	-171.4	166.4	0	0	111.9	D57	D57-E59 PolarHBondContact O-N 2.89Å; D57-E59 WeakPolarHBondContact OD1-CB 3.33Å; D57-E59 PolarHBondContact OD1-N 3.32Å
60	N	91.6	Very high	93.3	Very high	29 Å²	29	70.2 Å²	70.2	16%	0.155	35%	0.354	C	S	.	.	S	Bend	trans	-68.6	126.8	177.3	-168.9	-56.1	0	0	0	110.3	D57 P58 H62 H63	D57-N60 HydrophobicContact CB-CB 4.18Å; D57-N60 WeakPolarHBondContact O-CB 3.22Å; D57-N60 PolarHBondContact O-N 3.22Å; P58-N60 VanDerWaalsContact C-N 3.26Å; N60-H62 PolarHBondContact O-N 3.44Å; N60-H62 PolarHBondContact OD1-N 2.86Å; N60-H63 HydrophobicContact CB-CB 4.21Å; N60-H63 VanDerWaalsContact O-CB 3.29Å; N60-H63 WeakPolarHBondContact O-CB 3.27Å; N60-H63 PolarHBondContact O-N 3.46Å
61	P	90.8	Very high	93.3	Very high	112 Å²	112	73 Å²	73	73%	0.727	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-23.2	-179	-26.2	34.2	0	0	0	114.8
62	H	91.9	Very high	93.2	Very high	72 Å²	72	77.5 Å²	77.5	33%	0.333	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	1.2	-177.6	-57	-66.6	0	0	0	113.4	P38 I54 N60 E64 Q65 A66 L69	P38-H62 HydrophobicContact CG-CB 4.08Å; I54-H62 HydrophobicContact CG2-CB 4.01Å; N60-H62 PolarHBondContact O-N 3.44Å; N60-H62 PolarHBondContact OD1-N 2.86Å; H62-E64 PolarHBondContact O-N 3.38Å; H62-Q65 CarbonylContact O-C 3.56Å; H62-Q65 PolarHBondContact O-N 2.93Å; H62-Q65 VanDerWaalsContact O-N 3.14Å; H62-A66 PolarHBondContact O-N 3.39Å; H62-L69 HydrophobicContact CB-CD1 4.23Å
63	H	92.9	Very high	93.1	Very high	59 Å²	59	79.8 Å²	79.8	27%	0.273	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-50.7	-177.3	177.9	75.4	0	0	0	112.9	I54 F55 D57 N60 Q65 A66	I54-H63 VanDerWaalsContact O-CA 3.31Å; I54-H63 WeakPolarHBondContact O-CA 3.48Å; I54-H63 PolarHBondContact O-ND1 2.97Å; F55-H63 PolarHBondContact O-CE1 3.24Å; F55-H63 PolarHBondContact O-ND1 2.88Å; D57-H63 WeakPolarHBondContact O-CB 3.38Å; N60-H63 HydrophobicContact CB-CB 4.21Å; N60-H63 VanDerWaalsContact O-CB 3.29Å; N60-H63 WeakPolarHBondContact O-CB 3.27Å; N60-H63 PolarHBondContact O-N 3.46Å; H63-Q65 PolarHBondContact O-N 2.95Å; H63-A66 WeakPolarHBondContact O-CB 2.98Å; H63-A66 PolarHBondContact O-N 3.31Å
64	E	92.6	Very high	92.9	Very high	186 Å²	186	76.8 Å²	76.8	87%	0.869	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-26.7	-179.7	-64.6	-173.8	168.5	0	0	112.8	H62	H62-E64 PolarHBondContact O-N 3.38Å
65	Q	93.6	Very high	92.8	Very high	100 Å²	100	84 Å²	84	47%	0.467	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-2.2	-178.1	-65	174.1	8.4	0	0	112.9	H62 H63 M67 Q68 L69	H62-Q65 CarbonylContact O-C 3.56Å; H62-Q65 PolarHBondContact O-N 2.93Å; H62-Q65 VanDerWaalsContact O-N 3.14Å; H63-Q65 PolarHBondContact O-N 2.95Å; Q65-M67 VanDerWaalsContact C-N 3.3Å; Q65-M67 PolarHBondContact O-N 3.45Å; Q65-Q68 WeakPolarHBondContact O-CA 3.22Å; Q65-Q68 WeakPolarHBondContact O-CB 3.28Å; Q65-Q68 PolarHBondContact O-N 2.86Å; Q65-L69 HydrophobicContact CB-CD1 4.15Å; Q65-L69 HydrophobicContact CB-CG 4.35Å; Q65-L69 WeakPolarHBondContact O-CG 3.46Å; Q65-L69 PolarHBondContact O-N 3.2Å
66	A	93.3	Very high	92.6	Very high	2 Å²	2	85.9 Å²	85.9	2%	0.017	44%	0.435	C	S	.	.	H	α-helix	trans	-57.6	-42.1	-170.4	0	0	0	0	0	112.4	I54 F55 H62 H63 L69 L70	I54-A66 HydrophobicContact CG2-CB 4.07Å; F55-A66 HydrophobicContact CD1-CB 3.65Å; F55-A66 HydrophobicContact CE1-CB 3.63Å; F55-A66 HydrophobicContact CG-CB 4.15Å; F55-A66 HydrophobicContact CZ-CB 4.1Å; H62-A66 PolarHBondContact O-N 3.39Å; H63-A66 WeakPolarHBondContact O-CB 2.98Å; H63-A66 PolarHBondContact O-N 3.31Å; A66-L69 PolarHBondContact O-N 3Å; A66-L70 WeakPolarHBondContact O-CB 3.5Å; A66-L70 PolarHBondContact O-N 2.85Å
67	M	94.4	Very high	92.5	Very high	77 Å²	77	80.5 Å²	80.5	38%	0.379	41%	0.413	S	S	.	.	H	α-helix	trans	-66.8	-38	175.5	-72.6	-56	-59.3	0	0	113	F55 Q65 L70 L71 Y99	F55-M67 HydrophobicContact CD1-SD 4.43Å; F55-M67 HydrophobicContact CE1-SD 3.88Å; Q65-M67 VanDerWaalsContact C-N 3.3Å; Q65-M67 PolarHBondContact O-N 3.45Å; M67-L70 HydrophobicContact CE-CD2 4.36Å; M67-L70 PolarHBondContact O-N 3.31Å; M67-L70 HydrophobicContact SD-CD2 4.24Å; M67-L71 WeakPolarHBondContact O-CG 3.08Å; M67-L71 PolarHBondContact O-N 2.98Å; M67-Y99 HydrophobicContact SD-CG 4.36Å
68	Q	93.8	Very high	92.4	Very high	146 Å²	146	82.7 Å²	82.7	68%	0.682	42%	0.418	S	S	*	.	H	α-helix	trans	-66.2	-43.1	176.3	-178.6	-178	-11	0	0	110.8	Q65 L70 L71 E72	Q65-Q68 WeakPolarHBondContact O-CA 3.22Å; Q65-Q68 WeakPolarHBondContact O-CB 3.28Å; Q65-Q68 PolarHBondContact O-N 2.86Å; Q68-L70 VanDerWaalsContact C-N 3.29Å; Q68-L70 PolarHBondContact O-N 3.22Å; Q68-L71 PolarHBondContact O-N 3.38Å; Q68-E72 PolarHBondContact O-N 2.74Å
69	L	93.6	Very high	92.4	Very high	22 Å²	22	78.6 Å²	78.6	12%	0.115	39%	0.39	C	S	.	.	H	α-helix	trans	-66.5	-30.6	177.8	-68.9	167.6	0	0	0	112.5	N37 P38 L39 H62 Q65 A66	N37-L69 PolarHBondContact ND2-O 3.33Å; P38-L69 HydrophobicContact CG-CD1 3.79Å; L39-L69 HydrophobicContact CD1-CB 3.7Å; L39-L69 HydrophobicContact CG-CB 4.41Å; H62-L69 HydrophobicContact CB-CD1 4.23Å; Q65-L69 HydrophobicContact CB-CD1 4.15Å; Q65-L69 HydrophobicContact CB-CG 4.35Å; Q65-L69 WeakPolarHBondContact O-CG 3.46Å; Q65-L69 PolarHBondContact O-N 3.2Å; A66-L69 PolarHBondContact O-N 3Å
70	L	93.6	Very high	92.4	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-69.8	-39	175.2	176.9	55.1	0	0	0	112.3	L39 F55 A66 M67 Q68 L80 L81 L96 V101	L39-L70 HydrophobicContact CD1-CB 4.26Å; F55-L70 HydrophobicContact CE1-CD2 4.09Å; F55-L70 HydrophobicContact CZ-CB 4.16Å; F55-L70 HydrophobicContact CZ-CD2 3.85Å; A66-L70 WeakPolarHBondContact O-CB 3.5Å; A66-L70 PolarHBondContact O-N 2.85Å; M67-L70 HydrophobicContact CE-CD2 4.36Å; M67-L70 PolarHBondContact O-N 3.31Å; M67-L70 HydrophobicContact SD-CD2 4.24Å; Q68-L70 VanDerWaalsContact C-N 3.29Å; Q68-L70 PolarHBondContact O-N 3.22Å; L70-L80 HydrophobicContact CD1-CB 4.24Å; L70-L80 HydrophobicContact CD1-CD2 3.75Å; L70-L81 HydrophobicContact CD1-CG 4.4Å; L70-L96 HydrophobicContact CD1-CB 4.5Å; L70-L96 HydrophobicContact CD1-CD1 3.88Å; L70-L96 HydrophobicContact CD1-CD2 3.66Å; L70-L96 HydrophobicContact CD1-CG 4.24Å; L70-L96 HydrophobicContact CD2-CD2 3.95Å; L70-L96 HydrophobicContact CG-CD2 4.44Å; L70-V101 HydrophobicContact CD1-CG1 4.43Å; L70-V101 HydrophobicContact CD2-CG1 3.28Å; L70-V101 HydrophobicContact CG-CG1 3.73Å
71	L	93.3	Very high	92.6	Very high	79 Å²	79	69.3 Å²	69.3	41%	0.414	35%	0.346	S	S	.	.	S	Bend	trans	-91.1	1.5	-178.2	-61.1	176.2	0	0	0	113.2	M67 Q68 E73 V101	M67-L71 WeakPolarHBondContact O-CG 3.08Å; M67-L71 PolarHBondContact O-N 2.98Å; Q68-L71 PolarHBondContact O-N 3.38Å; L71-E73 PolarHBondContact O-N 3.49Å; L71-V101 HydrophobicContact CD2-CG1 4.11Å
72	E	92.8	Very high	92.8	Very high	95 Å²	95	65.3 Å²	65.3	44%	0.444	32%	0.317	S	S	.	.			trans	-66.6	126.7	176.2	-172.4	175.6	-168.8	0	0	109.7	Q68 N79	Q68-E72 PolarHBondContact O-N 2.74Å; E72-N79 VanDerWaalsContact O-CA 3.31Å; E72-N79 WeakPolarHBondContact O-CA 3.39Å; E72-N79 VanDerWaalsContact O-CB 3.32Å; E72-N79 WeakPolarHBondContact O-CB 3.46Å
73	E	91.9	Very high	92.9	Very high	96 Å²	96	62.5 Å²	62.5	45%	0.449	31%	0.306	S	S	.	.			trans	-113.2	144.7	179.1	-72.7	175.1	-170.2	0	0	110.4	L71 R78 N79	L71-E73 PolarHBondContact O-N 3.49Å; E73-R78 CarbonylContact C-O 3.56Å; E73-R78 WeakPolarHBondContact CA-O 3.37Å; E73-N79 HydrophobicContact CG-CB 3.98Å
74	D	90.3	Very high	93	Very high	58 Å²	58	59.7 Å²	59.7	31%	0.31	29%	0.293	S	S	.	.			trans	-77.7	-178.6	168.7	74.6	5.4	0	0	0	112.4	V76 G77 R78	D74-V76 PolarHBondContact O-N 3.24Å; D74-V76 WeakPolarHBondContact OD1-CG2 3.36Å; D74-V76 PolarHBondContact OD1-N 3.39Å; D74-V76 WeakPolarHBondContact OD2-CG2 3.45Å; D74-G77 PolarHBondContact O-N 3.22Å; D74-G77 PolarHBondContact OD1-N 3.02Å; D74-R78 PolarHBondContact N-O 3.25Å; D74-R78 PolarHBondContact OD1-N 3.36Å; D74-R78 IonicContact OD1-NE 2.81Å; D74-R78 IonicContact OD2-CZ 3.47Å; D74-R78 IonicContact OD2-NE 3.94Å; D74-R78 PolarHBondContact OD2-NE 3.27Å; D74-R78 IonicContact OD2-NH2 3.52Å; D74-R78 PolarHBondContact OD2-NH2 2.91Å
75	I	90.9	Very high	93.2	Very high	166 Å²	166	50.8 Å²	50.8	85%	0.851	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-18.6	-177.8	58.2	165.4	0	0	0	114.6
76	V	90.9	Very high	93.3	Very high	56 Å²	56	47.4 Å²	47.4	34%	0.339	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	2.7	177.7	-67.5	0	0	0	0	112.2	D74 R78 T107 T108	D74-V76 PolarHBondContact O-N 3.24Å; D74-V76 WeakPolarHBondContact OD1-CG2 3.36Å; D74-V76 PolarHBondContact OD1-N 3.39Å; D74-V76 WeakPolarHBondContact OD2-CG2 3.45Å; V76-R78 HydrophobicContact CG2-CG 3.89Å; V76-T107 VanDerWaalsContact O-CB 3.28Å; V76-T107 WeakPolarHBondContact O-CB 3.42Å; V76-T108 WeakPolarHBondContact O-CG2 3.46Å; V76-T108 PolarHBondContact O-N 3.44Å; V76-T108 PolarHBondContact O-OG1 3.42Å
77	G	90.6	Very high	93.3	Very high	11 Å²	11	48.7 Å²	48.7	11%	0.113	25%	0.247	C	C	.	.	S	Bend	trans	83.2	26	178.4	0	0	0	0	0	113.5	D74	D74-G77 PolarHBondContact O-N 3.22Å; D74-G77 PolarHBondContact OD1-N 3.02Å
78	R	92.7	Very high	93.5	Very high	92 Å²	92	46 Å²	46	35%	0.347	24%	0.239	S	C	.	.			trans	-93.6	129.7	173	-62.6	174.7	-56.8	-176.4	3.5	109.5	E73 D74 V76 Y82 T107	E73-R78 CarbonylContact C-O 3.56Å; E73-R78 WeakPolarHBondContact CA-O 3.37Å; D74-R78 PolarHBondContact N-O 3.25Å; D74-R78 PolarHBondContact OD1-N 3.36Å; D74-R78 IonicContact OD1-NE 2.81Å; D74-R78 IonicContact OD2-CZ 3.47Å; D74-R78 IonicContact OD2-NE 3.94Å; D74-R78 PolarHBondContact OD2-NE 3.27Å; D74-R78 IonicContact OD2-NH2 3.52Å; D74-R78 PolarHBondContact OD2-NH2 2.91Å; V76-R78 HydrophobicContact CG2-CG 3.89Å; R78-Y82 HydrophobicContact CB-CD1 4.12Å; R78-Y82 HydrophobicContact CB-CG 3.99Å; R78-Y82 HydrophobicContact CG-CD1 3.79Å; R78-Y82 HydrophobicContact CG-CD2 4.06Å; R78-Y82 HydrophobicContact CG-CE1 3.96Å; R78-Y82 HydrophobicContact CG-CE2 4.22Å; R78-Y82 HydrophobicContact CG-CG 3.84Å; R78-T107 HydrophobicContact CG-CG2 3.98Å
79	N	92	Very high	93.6	Very high	17 Å²	17	41.4 Å²	41.4	9%	0.091	22%	0.217	C	C	.	.			trans	-109.9	-174.3	175.2	64.3	24.9	0	0	0	111.8	E72 E73 L81 Y82 A83 E105	E72-N79 VanDerWaalsContact O-CA 3.31Å; E72-N79 WeakPolarHBondContact O-CA 3.39Å; E72-N79 VanDerWaalsContact O-CB 3.32Å; E72-N79 WeakPolarHBondContact O-CB 3.46Å; E73-N79 HydrophobicContact CG-CB 3.98Å; N79-L81 VanDerWaalsContact C-N 3.27Å; N79-L81 PolarHBondContact O-N 2.98Å; N79-L81 WeakPolarHBondContact OD1-CB 3.5Å; N79-L81 PolarHBondContact OD1-N 2.97Å; N79-Y82 VanDerWaalsContact O-CB 3.28Å; N79-Y82 WeakPolarHBondContact O-CB 3.38Å; N79-Y82 PolarHBondContact O-N 3.42Å; N79-Y82 VanDerWaalsContact O-N 3.08Å; N79-Y82 PolarHBondContact OD1-N 2.93Å; N79-A83 PolarHBondContact O-N 3.38Å; N79-E105 PolarHBondContact ND2-OE2 3.39Å
80	L	93.9	Very high	93.8	Very high	7 Å²	7	41.4 Å²	41.4	4%	0.037	22%	0.219	C	C	.	.	H	α-helix	trans	-55.2	-38.8	179.2	-173.8	74.7	0	0	0	113.5	L39 L40 A43 L70 Y82 A83 A84 L96	L39-L80 HydrophobicContact CB-CD1 3.98Å; L39-L80 HydrophobicContact CB-CD2 3.51Å; L39-L80 HydrophobicContact CB-CG 4.41Å; L39-L80 HydrophobicContact CD1-CD2 4Å; L39-L80 HydrophobicContact CG-CD2 4.36Å; L40-L80 HydrophobicContact CB-CD1 4.26Å; L40-L80 HydrophobicContact CD1-CD1 4.11Å; A43-L80 HydrophobicContact CB-CD1 3.6Å; A43-L80 HydrophobicContact CB-CD2 4.21Å; A43-L80 HydrophobicContact CB-CG 3.84Å; L70-L80 HydrophobicContact CD1-CB 4.24Å; L70-L80 HydrophobicContact CD1-CD2 3.75Å; L80-Y82 VanDerWaalsContact C-N 3.27Å; L80-Y82 PolarHBondContact O-N 2.95Å; L80-A83 PolarHBondContact O-N 2.82Å; L80-A84 PolarHBondContact O-N 3.16Å; L80-L96 HydrophobicContact CD2-CD1 3.88Å
81	L	95.7	Very high	94	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-35	179.9	-64.2	164.5	0	0	0	111	L70 N79 A83 A84 C85 I93 L96 V101 L103 L113	L70-L81 HydrophobicContact CD1-CG 4.4Å; N79-L81 VanDerWaalsContact C-N 3.27Å; N79-L81 PolarHBondContact O-N 2.98Å; N79-L81 WeakPolarHBondContact OD1-CB 3.5Å; N79-L81 PolarHBondContact OD1-N 2.97Å; L81-A83 VanDerWaalsContact C-N 3.34Å; L81-A83 PolarHBondContact O-N 3.19Å; L81-A84 PolarHBondContact O-N 2.85Å; L81-C85 WeakPolarHBondContact O-CB 3.41Å; L81-C85 PolarHBondContact O-N 3.1Å; L81-C85 PolarHBondContact O-SG 3.03Å; L81-C85 VanDerWaalsContact O-SG 3.37Å; L81-I93 HydrophobicContact CB-CD1 4.14Å; L81-I93 HydrophobicContact CD2-CD1 3.7Å; L81-L96 HydrophobicContact CD2-CB 3.7Å; L81-L96 HydrophobicContact CD2-CD1 3.58Å; L81-L96 HydrophobicContact CD2-CG 4.31Å; L81-L96 HydrophobicContact CG-CD1 4.49Å; L81-V101 HydrophobicContact CD1-CB 4.14Å; L81-V101 HydrophobicContact CD1-CG2 3.89Å; L81-L103 HydrophobicContact CD1-CD2 3.81Å; L81-L103 HydrophobicContact CD2-CD2 4.45Å; L81-L113 HydrophobicContact CB-CD1 3.8Å; L81-L113 HydrophobicContact CB-CD2 3.81Å; L81-L113 HydrophobicContact CB-CG 4.48Å; L81-L113 HydrophobicContact CD1-CD1 4.21Å
82	Y	95	Very high	94.2	Very high	29 Å²	29	42.6 Å²	42.6	11%	0.114	23%	0.226	C	C	.	.	H	α-helix	trans	-61.1	-44.3	174.9	-162.5	-81.5	0	0	0	111.1	R78 N79 L80 C85 M86 T107 L113 C116	R78-Y82 HydrophobicContact CB-CD1 4.12Å; R78-Y82 HydrophobicContact CB-CG 3.99Å; R78-Y82 HydrophobicContact CG-CD1 3.79Å; R78-Y82 HydrophobicContact CG-CD2 4.06Å; R78-Y82 HydrophobicContact CG-CE1 3.96Å; R78-Y82 HydrophobicContact CG-CE2 4.22Å; R78-Y82 HydrophobicContact CG-CG 3.84Å; N79-Y82 VanDerWaalsContact O-CB 3.28Å; N79-Y82 WeakPolarHBondContact O-CB 3.38Å; N79-Y82 PolarHBondContact O-N 3.42Å; N79-Y82 VanDerWaalsContact O-N 3.08Å; N79-Y82 PolarHBondContact OD1-N 2.93Å; L80-Y82 VanDerWaalsContact C-N 3.27Å; L80-Y82 PolarHBondContact O-N 2.95Å; Y82-C85 PolarHBondContact O-N 3.14Å; Y82-M86 PolarHBondContact O-N 2.82Å; Y82-T107 HydrophobicContact CD2-CG2 4.11Å; Y82-T107 HydrophobicContact CE2-CG2 3.8Å; Y82-L113 HydrophobicContact CD2-CD2 4.4Å; Y82-C116 HydrophobicContact CD2-CB 4.11Å; Y82-C116 HydrophobicContact CE1-CB 4.19Å; Y82-C116 WeakPolarHBondContact CE1-SG 3.31Å; Y82-C116 HydrophobicContact CE2-CB 3.65Å
83	A	93.1	Very high	94.4	Very high	12 Å²	12	38 Å²	38	10%	0.099	20%	0.204	C	C	.	.	H	α-helix	trans	-64.1	-43.1	176.5	0	0	0	0	0	112.3	L40 L44 N79 L80 L81 C85 M86 A87	L40-A83 HydrophobicContact CD1-CB 3.93Å; L44-A83 HydrophobicContact CD2-CB 4.07Å; N79-A83 PolarHBondContact O-N 3.38Å; L80-A83 PolarHBondContact O-N 2.82Å; L81-A83 VanDerWaalsContact C-N 3.34Å; L81-A83 PolarHBondContact O-N 3.19Å; A83-C85 VanDerWaalsContact C-N 3.32Å; A83-C85 PolarHBondContact O-N 3.08Å; A83-M86 PolarHBondContact O-N 2.94Å; A83-A87 WeakPolarHBondContact O-CB 3.39Å; A83-A87 PolarHBondContact O-N 3.33Å
84	A	95.9	Very high	94.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.9	-38.8	174.2	0	0	0	0	0	112.2	A43 L80 L81 A87 G88 Q89 V92 I93	A43-A84 HydrophobicContact CB-CB 4.37Å; L80-A84 PolarHBondContact O-N 3.16Å; L81-A84 PolarHBondContact O-N 2.85Å; A84-A87 PolarHBondContact O-N 3.43Å; A84-G88 PolarHBondContact O-N 2.87Å; A84-Q89 HydrophobicContact CB-CB 4.42Å; A84-Q89 PolarHBondContact O-N 2.82Å; A84-V92 HydrophobicContact CB-CG1 3.88Å; A84-I93 HydrophobicContact CB-CD1 3.65Å; A84-I93 HydrophobicContact CB-CG1 4.27Å
85	C	96.5	Very high	95	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.5	-43.2	175.5	-76.8	0	0	0	0	112.6	L81 Y82 A83 A87 G88 C116 A117 R122 T125	L81-C85 WeakPolarHBondContact O-CB 3.41Å; L81-C85 PolarHBondContact O-N 3.1Å; L81-C85 PolarHBondContact O-SG 3.03Å; L81-C85 VanDerWaalsContact O-SG 3.37Å; Y82-C85 PolarHBondContact O-N 3.14Å; A83-C85 VanDerWaalsContact C-N 3.32Å; A83-C85 PolarHBondContact O-N 3.08Å; C85-A87 VanDerWaalsContact C-N 3.32Å; C85-A87 PolarHBondContact O-N 3.34Å; C85-G88 PolarHBondContact O-N 3.1Å; C85-C116 HydrophobicContact CB-CB 4.36Å; C85-A117 HydrophobicContact CB-CB 4.48Å; C85-R122 VanDerWaalsContact O-CG 3.3Å; C85-R122 WeakPolarHBondContact O-CG 3.49Å; C85-T125 HydrophobicContact CB-CG2 4.2Å
86	M	94.9	Very high	95.2	Very high	29 Å²	29	26.8 Å²	26.8	14%	0.143	14%	0.144	C	C	.	.	H	α-helix	trans	-61.7	-39.7	174.1	170.6	168.8	56.4	0	0	112.1	Y82 A83 G88 W120 R122	Y82-M86 PolarHBondContact O-N 2.82Å; A83-M86 PolarHBondContact O-N 2.94Å; M86-G88 VanDerWaalsContact C-N 3.28Å; M86-G88 PolarHBondContact O-N 2.81Å; M86-W120 HydrophobicContact CB-CG 4.47Å; M86-W120 HydrophobicContact CG-CD2 3.82Å; M86-W120 VanDerWaalsContact CG-CE2 3.44Å; M86-W120 HydrophobicContact CG-CE3 4.4Å; M86-W120 HydrophobicContact CG-CG 4.16Å; M86-W120 HydrophobicContact CG-CH2 4.23Å; M86-W120 HydrophobicContact CG-CZ2 3.67Å; M86-W120 HydrophobicContact SD-CH2 4.06Å; M86-W120 HydrophobicContact SD-CZ2 3.34Å; M86-W120 WeakPolarHBondContact SD-CZ2 3.49Å; M86-R122 PolarHBondContact O-NE 3.45Å; M86-R122 PolarHBondContact O-NH2 2.94Å
87	A	94.6	Very high	95.4	Very high	29 Å²	29	25.3 Å²	25.3	24%	0.24	14%	0.137	C	C	.	.	H	α-helix	trans	-75.5	-13.1	176.6	0	0	0	0	0	113.8	L44 A83 A84 C85 Q89	L44-A87 HydrophobicContact CD2-CB 3.87Å; A83-A87 WeakPolarHBondContact O-CB 3.39Å; A83-A87 PolarHBondContact O-N 3.33Å; A84-A87 PolarHBondContact O-N 3.43Å; C85-A87 VanDerWaalsContact C-N 3.32Å; C85-A87 PolarHBondContact O-N 3.34Å; A87-Q89 HydrophobicContact CB-CG 3.87Å
88	G	96.9	Very high	95.6	Very high	21 Å²	21	32.4 Å²	32.4	22%	0.216	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	23.2	-179.7	0	0	0	0	0	114.6	A84 C85 M86 S90 T125	A84-G88 PolarHBondContact O-N 2.87Å; C85-G88 PolarHBondContact O-N 3.1Å; M86-G88 VanDerWaalsContact C-N 3.28Å; M86-G88 PolarHBondContact O-N 2.81Å; G88-S90 PolarHBondContact O-N 2.98Å; G88-S90 VanDerWaalsContact O-N 3.09Å; G88-T125 VanDerWaalsContact CA-OG1 3.28Å; G88-T125 WeakPolarHBondContact CA-OG1 3.37Å; G88-T125 PolarHBondContact O-OG1 3.18Å
89	Q	97.6	Very high	95.6	Very high	49 Å²	49	31 Å²	31	23%	0.229	16%	0.16	C	C	.	.			trans	-86.9	73.3	-173.4	-58.5	-63.4	-5.7	0	0	111.8	A43 L44 T45 G46 A84 A87 D91 V92 I93	A43-Q89 VanDerWaalsContact O-CG 3.25Å; A43-Q89 WeakPolarHBondContact O-CG 3.43Å; L44-Q89 PolarHBondContact O-NE2 3.04Å; T45-Q89 VanDerWaalsContact C-NE2 3.34Å; G46-Q89 VanDerWaalsContact CA-CD 3.47Å; A84-Q89 HydrophobicContact CB-CB 4.42Å; A84-Q89 PolarHBondContact O-N 2.82Å; A87-Q89 HydrophobicContact CB-CG 3.87Å; Q89-D91 VanDerWaalsContact C-N 3.3Å; Q89-D91 PolarHBondContact O-N 3.02Å; Q89-V92 HydrophobicContact CB-CB 3.89Å; Q89-V92 HydrophobicContact CB-CG2 3.98Å; Q89-V92 WeakPolarHBondContact O-CB 3.33Å; Q89-V92 PolarHBondContact O-N 2.52Å; Q89-I93 WeakPolarHBondContact O-CG1 3.5Å; Q89-I93 PolarHBondContact O-N 3.4Å; Q89-I93 VanDerWaalsContact O-N 3.13Å
90	S	97.8	Very high	95.5	Very high	22 Å²	22	33.5 Å²	33.5	15%	0.154	19%	0.19	C	C	.	.	H	α-helix	trans	-57.8	-38	-177.3	53.7	0	0	0	0	113.7	G88 I93 R94	G88-S90 PolarHBondContact O-N 2.98Å; G88-S90 VanDerWaalsContact O-N 3.09Å; S90-I93 PolarHBondContact O-N 2.88Å; S90-R94 WeakPolarHBondContact O-CG 3.41Å; S90-R94 PolarHBondContact O-N 3.43Å
91	D	97.6	Very high	95.5	Very high	103 Å²	103	34 Å²	34	55%	0.551	19%	0.193	S	C	*	.	H	α-helix	trans	-71.7	-34.2	-178.4	-65	-23.2	0	0	0	112	V48 Q89 R94 A95	V48-D91 HydrophobicContact CG2-CB 3.82Å; Q89-D91 VanDerWaalsContact C-N 3.3Å; Q89-D91 PolarHBondContact O-N 3.02Å; D91-R94 PolarHBondContact O-N 3.12Å; D91-A95 WeakPolarHBondContact O-CB 3.49Å; D91-A95 PolarHBondContact O-N 2.89Å
92	V	96.9	Very high	95.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.9	-47	170.5	165.2	0	0	0	0	110.2	A43 V48 L51 A84 Q89 R94 A95 L96	A43-V92 HydrophobicContact CB-CG1 4.05Å; V48-V92 HydrophobicContact CG2-CG2 3.99Å; L51-V92 HydrophobicContact CD1-CG1 3.92Å; A84-V92 HydrophobicContact CB-CG1 3.88Å; Q89-V92 HydrophobicContact CB-CB 3.89Å; Q89-V92 HydrophobicContact CB-CG2 3.98Å; Q89-V92 WeakPolarHBondContact O-CB 3.33Å; Q89-V92 PolarHBondContact O-N 2.52Å; V92-R94 VanDerWaalsContact C-N 3.34Å; V92-R94 PolarHBondContact O-N 2.71Å; V92-A95 PolarHBondContact O-N 3.48Å; V92-L96 HydrophobicContact CG1-CD1 3.68Å; V92-L96 HydrophobicContact CG1-CG 4.29Å; V92-L96 WeakPolarHBondContact O-CB 3.46Å; V92-L96 WeakPolarHBondContact O-CG 3.28Å; V92-L96 PolarHBondContact O-N 3.5Å
93	I	97.3	Very high	95.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.2	-47.2	177.3	-63.4	-61.5	0	0	0	110.8	L81 A84 Q89 S90 A95 L96 A97 T125 L129 L132	L81-I93 HydrophobicContact CB-CD1 4.14Å; L81-I93 HydrophobicContact CD2-CD1 3.7Å; A84-I93 HydrophobicContact CB-CD1 3.65Å; A84-I93 HydrophobicContact CB-CG1 4.27Å; Q89-I93 WeakPolarHBondContact O-CG1 3.5Å; Q89-I93 PolarHBondContact O-N 3.4Å; Q89-I93 VanDerWaalsContact O-N 3.13Å; S90-I93 PolarHBondContact O-N 2.88Å; I93-A95 VanDerWaalsContact C-N 3.33Å; I93-A95 PolarHBondContact O-N 3.3Å; I93-L96 PolarHBondContact O-N 2.83Å; I93-A97 WeakPolarHBondContact O-CB 3.32Å; I93-A97 PolarHBondContact O-N 3.43Å; I93-T125 HydrophobicContact CG1-CG2 4.45Å; I93-L129 HydrophobicContact CG2-CD2 3.84Å; I93-L132 HydrophobicContact CG2-CD1 3.98Å
94	R	97.6	Very high	95.7	Very high	80 Å²	80	39.4 Å²	39.4	30%	0.302	22%	0.223	S	C	.	.	H	α-helix	trans	-62.7	-38.7	177.4	-69.3	175.4	-171	-78.9	10.2	112.6	S90 D91 V92 A128 E131	S90-R94 WeakPolarHBondContact O-CG 3.41Å; S90-R94 PolarHBondContact O-N 3.43Å; D91-R94 PolarHBondContact O-N 3.12Å; V92-R94 VanDerWaalsContact C-N 3.34Å; V92-R94 PolarHBondContact O-N 2.71Å; R94-A128 HydrophobicContact CG-CB 4.27Å; R94-E131 IonicContact CZ-OE2 2.72Å; R94-E131 IonicContact NH1-OE2 3.86Å; R94-E131 PolarHBondContact NH1-OE2 3.33Å; R94-E131 VanDerWaalsContact NH2-CD 3.32Å; R94-E131 IonicContact NH2-OE1 3.12Å; R94-E131 PolarHBondContact NH2-OE1 3.3Å; R94-E131 IonicContact NH2-OE2 3.57Å; R94-E131 PolarHBondContact NH2-OE2 2.85Å
95	A	96.3	Very high	95.7	Very high	4 Å²	4	42.1 Å²	42.1	3%	0.033	24%	0.235	C	C	.	.	H	α-helix	trans	-66.4	-45.9	176.8	0	0	0	0	0	111.1	V48 D91 V92 I93 K98	V48-A95 HydrophobicContact CG1-CB 3.77Å; D91-A95 WeakPolarHBondContact O-CB 3.49Å; D91-A95 PolarHBondContact O-N 2.89Å; V92-A95 PolarHBondContact O-N 3.48Å; I93-A95 VanDerWaalsContact C-N 3.33Å; I93-A95 PolarHBondContact O-N 3.3Å; A95-K98 WeakPolarHBondContact O-CB 3.24Å; A95-K98 PolarHBondContact O-N 3.2Å
96	L	94.8	Very high	95.7	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-68.3	-34.1	-179.2	-73.7	174.1	0	0	0	113.1	L51 F55 L70 L80 L81 V92 I93 K98 Y99	L51-L96 HydrophobicContact CD1-CD1 4.08Å; L51-L96 HydrophobicContact CD1-CD2 3.99Å; L51-L96 HydrophobicContact CD1-CG 4.04Å; L51-L96 HydrophobicContact CD2-CD2 3.64Å; L51-L96 HydrophobicContact CD2-CG 4.08Å; L51-L96 HydrophobicContact CG-CD2 4.26Å; F55-L96 HydrophobicContact CE2-CD2 3.71Å; F55-L96 HydrophobicContact CZ-CD2 3.87Å; L70-L96 HydrophobicContact CD1-CB 4.5Å; L70-L96 HydrophobicContact CD1-CD1 3.88Å; L70-L96 HydrophobicContact CD1-CD2 3.66Å; L70-L96 HydrophobicContact CD1-CG 4.24Å; L70-L96 HydrophobicContact CD2-CD2 3.95Å; L70-L96 HydrophobicContact CG-CD2 4.44Å; L80-L96 HydrophobicContact CD2-CD1 3.88Å; L81-L96 HydrophobicContact CD2-CB 3.7Å; L81-L96 HydrophobicContact CD2-CD1 3.58Å; L81-L96 HydrophobicContact CD2-CG 4.31Å; L81-L96 HydrophobicContact CG-CD1 4.49Å; V92-L96 HydrophobicContact CG1-CD1 3.68Å; V92-L96 HydrophobicContact CG1-CG 4.29Å; V92-L96 WeakPolarHBondContact O-CB 3.46Å; V92-L96 WeakPolarHBondContact O-CG 3.28Å; V92-L96 PolarHBondContact O-N 3.5Å; I93-L96 PolarHBondContact O-N 2.83Å; L96-K98 PolarHBondContact O-N 3.47Å; L96-K98 VanDerWaalsContact O-N 3.1Å; L96-Y99 HydrophobicContact CD2-CD2 4.36Å; L96-Y99 PolarHBondContact O-N 3.23Å
97	A	95.6	Very high	95.7	Very high	24 Å²	24	46.2 Å²	46.2	20%	0.198	25%	0.254	C	S	.	.	H	α-helix	trans	-56.7	-26.9	176	0	0	0	0	0	113.2	I93 Y99 G100 L103 L132	I93-A97 WeakPolarHBondContact O-CB 3.32Å; I93-A97 PolarHBondContact O-N 3.43Å; A97-Y99 PolarHBondContact O-N 3.22Å; A97-G100 PolarHBondContact O-N 3.43Å; A97-L103 HydrophobicContact CB-CD1 4.19Å; A97-L132 HydrophobicContact CB-CD1 3.99Å; A97-L132 HydrophobicContact CB-CD2 3.99Å
98	K	94.8	Very high	95.8	Very high	160 Å²	160	49.7 Å²	49.7	70%	0.696	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-19.6	177.4	-61.1	175.9	-175.7	175.5	0	113.4	A95 L96 G100	A95-K98 WeakPolarHBondContact O-CB 3.24Å; A95-K98 PolarHBondContact O-N 3.2Å; L96-K98 PolarHBondContact O-N 3.47Å; L96-K98 VanDerWaalsContact O-N 3.1Å; K98-G100 VanDerWaalsContact C-N 3.28Å; K98-G100 PolarHBondContact O-N 3.1Å
99	Y	92.9	Very high	95.7	Very high	62 Å²	62	51.8 Å²	51.8	24%	0.243	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	10.8	178.8	-59.4	-73	0	0	0	113.6	F55 M67 L96 A97 V101	F55-Y99 HydrophobicContact CB-CE1 3.61Å; F55-Y99 HydrophobicContact CB-CE2 4.11Å; F55-Y99 WeakPolarHBondContact CB-OH 3.49Å; F55-Y99 AromaticContact CD1-CD1 3.82Å; F55-Y99 HydrophobicContact CD1-CD1 3.82Å; F55-Y99 HydrophobicContact CD1-CD2 4.07Å; F55-Y99 AromaticContact CD1-CE1 3.7Å; F55-Y99 HydrophobicContact CD1-CE1 3.7Å; F55-Y99 AromaticContact CD1-CE2 3.96Å; F55-Y99 HydrophobicContact CD1-CE2 3.96Å; F55-Y99 HydrophobicContact CD1-CG 4.02Å; F55-Y99 AromaticContact CD1-CZ 3.78Å; F55-Y99 HydrophobicContact CD2-CD2 4.49Å; F55-Y99 AromaticContact CD2-CE2 3.86Å; F55-Y99 HydrophobicContact CD2-CE2 3.86Å; F55-Y99 AromaticContact CD2-CZ 3.99Å; F55-Y99 HydrophobicContact CE1-CD1 4.38Å; F55-Y99 HydrophobicContact CE1-CD2 4.13Å; F55-Y99 HydrophobicContact CE1-CE2 4.37Å; F55-Y99 HydrophobicContact CE1-CG 4.16Å; F55-Y99 HydrophobicContact CE2-CE2 4.29Å; F55-Y99 HydrophobicContact CG-CD1 4.34Å; F55-Y99 HydrophobicContact CG-CD2 4.27Å; F55-Y99 AromaticContact CG-CE1 3.77Å; F55-Y99 HydrophobicContact CG-CE1 3.77Å; F55-Y99 AromaticContact CG-CE2 3.7Å; F55-Y99 HydrophobicContact CG-CE2 3.7Å; F55-Y99 AromaticContact CG-CZ 3.43Å; F55-Y99 VanDerWaalsContact CG-CZ 3.43Å; F55-Y99 HydrophobicContact CZ-CD2 4.4Å; M67-Y99 HydrophobicContact SD-CG 4.36Å; L96-Y99 HydrophobicContact CD2-CD2 4.36Å; L96-Y99 PolarHBondContact O-N 3.23Å; A97-Y99 PolarHBondContact O-N 3.22Å; Y99-V101 PolarHBondContact O-N 3.01Å
100	G	90.6	Very high	95.7	Very high	70 Å²	70	50.1 Å²	50.1	72%	0.722	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	22.4	172.4	0	0	0	0	0	114.6	A97 K98	A97-G100 PolarHBondContact O-N 3.43Å; K98-G100 VanDerWaalsContact C-N 3.28Å; K98-G100 PolarHBondContact O-N 3.1Å
101	V	94	Very high	95.7	Very high	17 Å²	17	49.9 Å²	49.9	10%	0.103	27%	0.265	C	S	.	.			trans	-66.1	148.4	173.9	-68.8	0	0	0	0	112.1	L70 L71 L81 Y99 L103	L70-V101 HydrophobicContact CD1-CG1 4.43Å; L70-V101 HydrophobicContact CD2-CG1 3.28Å; L70-V101 HydrophobicContact CG-CG1 3.73Å; L71-V101 HydrophobicContact CD2-CG1 4.11Å; L81-V101 HydrophobicContact CD1-CB 4.14Å; L81-V101 HydrophobicContact CD1-CG2 3.89Å; Y99-V101 PolarHBondContact O-N 3.01Å; V101-L103 HydrophobicContact CG2-CD2 3.86Å; V101-L103 PolarHBondContact O-N 2.98Å
102	N	95	Very high	95.7	Very high	81 Å²	81	45.2 Å²	45.2	43%	0.433	24%	0.24	S	C	.	.			trans	-85.1	105.5	175	179.9	14.6	0	0	0	110.8	N104 E105	N102-N104 PolarHBondContact O-N 3.33Å; N102-N104 WeakPolarHBondContact OD1-CB 3.42Å; N102-N104 PolarHBondContact OD1-N 3.03Å; N102-E105 HydrophobicContact CB-CG 4Å; N102-E105 WeakPolarHBondContact O-CG 3.37Å; N102-E105 PolarHBondContact O-N 3.34Å
103	L	96.4	Very high	95.7	Very high	16 Å²	16	45.7 Å²	45.7	8%	0.084	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-7.8	179.8	-57.6	-180	0	0	0	114.1	L81 A97 V101 L113 L132 V134	L81-L103 HydrophobicContact CD1-CD2 3.81Å; L81-L103 HydrophobicContact CD2-CD2 4.45Å; A97-L103 HydrophobicContact CB-CD1 4.19Å; V101-L103 HydrophobicContact CG2-CD2 3.86Å; V101-L103 PolarHBondContact O-N 2.98Å; L103-L113 HydrophobicContact CB-CD1 4.26Å; L103-L113 HydrophobicContact CD2-CD1 3.96Å; L103-L132 HydrophobicContact CD1-CB 3.68Å; L103-L132 HydrophobicContact CD1-CD1 3.68Å; L103-L132 HydrophobicContact CD1-CG 4.21Å; L103-V134 HydrophobicContact CB-CG1 3.62Å; L103-V134 HydrophobicContact CD1-CG1 4.15Å
104	N	96.3	Very high	95.7	Very high	61 Å²	61	45.9 Å²	45.9	33%	0.326	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	10.9	178.8	-66.1	-53.8	0	0	0	113	N102 V134 D135	N102-N104 PolarHBondContact O-N 3.33Å; N102-N104 WeakPolarHBondContact OD1-CB 3.42Å; N102-N104 PolarHBondContact OD1-N 3.03Å; N104-V134 WeakPolarHBondContact OD1-CA 3.41Å; N104-V134 WeakPolarHBondContact OD1-CB 3.33Å; N104-D135 PolarHBondContact OD1-N 2.97Å
105	E	95	Very high	95.8	Very high	57 Å²	57	42.1 Å²	42.1	27%	0.266	23%	0.229	S	C	.	.			trans	-56.6	144.3	171.6	-78	170.8	-179.7	0	0	111	N79 N102	N79-E105 PolarHBondContact ND2-OE2 3.39Å; N102-E105 HydrophobicContact CB-CG 4Å; N102-E105 WeakPolarHBondContact O-CG 3.37Å; N102-E105 PolarHBondContact O-N 3.34Å
106	K	96	Very high	95.8	Very high	99 Å²	99	42 Å²	42	43%	0.43	23%	0.228	S	C	.	.			trans	-117.3	135.8	-178	-74	-172	178.9	-162.9	0	108.9	Y111 T112 L139	K106-Y111 CarbonylContact C-O 3.47Å; K106-Y111 WeakPolarHBondContact CA-O 3.43Å; K106-T112 HydrophobicContact CD-CG2 4.47Å; K106-T112 HydrophobicContact CG-CG2 3.76Å; K106-L139 PolarHBondContact NZ-O 2.93Å
107	T	96.1	Very high	96	Very high	16 Å²	16	42 Å²	42	10%	0.098	23%	0.228	C	C	.	.			trans	-61.3	171.5	167.2	69.1	0	0	0	0	110.5	V76 R78 Y82 R109 G110 Y111	V76-T107 VanDerWaalsContact O-CB 3.28Å; V76-T107 WeakPolarHBondContact O-CB 3.42Å; R78-T107 HydrophobicContact CG-CG2 3.98Å; Y82-T107 HydrophobicContact CD2-CG2 4.11Å; Y82-T107 HydrophobicContact CE2-CG2 3.8Å; T107-R109 PolarHBondContact O-N 2.87Å; T107-R109 VanDerWaalsContact O-N 3.08Å; T107-R109 PolarHBondContact OG1-N 3.37Å; T107-G110 WeakPolarHBondContact O-CA 3.49Å; T107-G110 PolarHBondContact O-N 3.17Å; T107-Y111 PolarHBondContact N-O 3.25Å; T107-Y111 WeakPolarHBondContact OG1-CB 3.32Å; T107-Y111 PolarHBondContact OG1-N 2.92Å; T107-Y111 VanDerWaalsContact OG1-N 3.11Å
108	T	95.9	Very high	96.1	Very high	102 Å²	102	40.8 Å²	40.8	63%	0.626	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-27.8	173.5	52.5	0	0	0	0	113.8	V76	V76-T108 WeakPolarHBondContact O-CG2 3.46Å; V76-T108 PolarHBondContact O-N 3.44Å; V76-T108 PolarHBondContact O-OG1 3.42Å
109	R	95.6	Very high	96.3	Very high	65 Å²	65	34.1 Å²	34.1	25%	0.245	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	13.9	174.7	-66.3	-171.1	93	158.4	16.9	113.5	E23 E25 T107 Y111 F141	E23-R109 IonicContact OE2-NH1 2.65Å; E23-R109 IonicContact OE2-NH2 3.4Å; E23-R109 PolarHBondContact OE2-NH2 3.29Å; E25-R109 WeakPolarHBondContact OE1-CD 3.42Å; E25-R109 IonicContact OE1-CZ 2.7Å; E25-R109 IonicContact OE1-NE 3.66Å; E25-R109 IonicContact OE1-NH1 3.43Å; E25-R109 PolarHBondContact OE1-NH1 3.08Å; T107-R109 PolarHBondContact O-N 2.87Å; T107-R109 VanDerWaalsContact O-N 3.08Å; T107-R109 PolarHBondContact OG1-N 3.37Å; R109-Y111 VanDerWaalsContact C-N 3.3Å; R109-Y111 HydrophobicContact CB-CD2 3.84Å; R109-Y111 HydrophobicContact CB-CE2 4.03Å; R109-Y111 PolarHBondContact O-N 3.34Å; R109-F141 HydrophobicContact CB-CB 4.48Å; R109-F141 HydrophobicContact CB-CD1 3.66Å; R109-F141 HydrophobicContact CB-CE1 4.18Å; R109-F141 HydrophobicContact CB-CG 4.2Å; R109-F141 HydrophobicContact CG-CD1 4.33Å; R109-F141 VanDerWaalsContact O-CB 3.29Å; R109-F141 WeakPolarHBondContact O-CB 3.29Å; R109-F141 VanDerWaalsContact O-CD1 3.28Å; R109-F141 WeakPolarHBondContact O-CD1 3.47Å; R109-F141 PolarHBondContact O-N 2.87Å
110	G	96.8	Very high	96.4	Very high	14 Å²	14	35.2 Å²	35.2	14%	0.144	20%	0.197	C	C	.	.			trans	78.2	5.6	175.7	0	0	0	0	0	115.5	T107 N140	T107-G110 WeakPolarHBondContact O-CA 3.49Å; T107-G110 PolarHBondContact O-N 3.17Å; G110-N140 WeakPolarHBondContact O-CA 3.38Å
111	Y	97.6	Very high	96.8	Very high	17 Å²	17	32.9 Å²	32.9	7%	0.067	17%	0.173	C	C	.	.			trans	-72.2	132.4	178	-74	-97.9	0	0	0	110.4	K106 T107 R109 H115 N140 F141 V149 R152	K106-Y111 CarbonylContact C-O 3.47Å; K106-Y111 WeakPolarHBondContact CA-O 3.43Å; T107-Y111 PolarHBondContact N-O 3.25Å; T107-Y111 WeakPolarHBondContact OG1-CB 3.32Å; T107-Y111 PolarHBondContact OG1-N 2.92Å; T107-Y111 VanDerWaalsContact OG1-N 3.11Å; R109-Y111 VanDerWaalsContact C-N 3.3Å; R109-Y111 HydrophobicContact CB-CD2 3.84Å; R109-Y111 HydrophobicContact CB-CE2 4.03Å; R109-Y111 PolarHBondContact O-N 3.34Å; Y111-H115 HydrophobicContact CD1-CB 3.56Å; Y111-H115 HydrophobicContact CE1-CB 4.36Å; Y111-H115 HydrophobicContact CG-CB 4.42Å; Y111-N140 HydrophobicContact CD1-CB 4.41Å; Y111-N140 HydrophobicContact CD2-CB 4.29Å; Y111-N140 WeakPolarHBondContact CE1-ND2 3.35Å; Y111-N140 HydrophobicContact CE2-CB 4.46Å; Y111-N140 HydrophobicContact CG-CB 4.28Å; Y111-F141 AromaticContact CE2-CD1 3.83Å; Y111-F141 HydrophobicContact CE2-CD1 3.83Å; Y111-F141 AromaticContact CE2-CE1 3.61Å; Y111-F141 HydrophobicContact CE2-CE1 3.61Å; Y111-V149 HydrophobicContact CE1-CG2 4.26Å; Y111-R152 PolarHBondContact OH-NH2 3.48Å
112	T	97.9	Very high	97	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.031	19%	0.185	C	C	.	.			trans	-95.8	170.5	170.4	66.6	0	0	0	0	110.9	K106 L114 H115 C116 A138	K106-T112 HydrophobicContact CD-CG2 4.47Å; K106-T112 HydrophobicContact CG-CG2 3.76Å; T112-L114 PolarHBondContact O-N 2.85Å; T112-L114 PolarHBondContact OG1-N 3.37Å; T112-H115 PolarHBondContact N-ND1 2.88Å; T112-H115 VanDerWaalsContact N-ND1 3.15Å; T112-H115 PolarHBondContact O-N 3.23Å; T112-H115 VanDerWaalsContact O-N 3.07Å; T112-H115 PolarHBondContact OG1-ND1 3.03Å; T112-C116 PolarHBondContact O-N 2.9Å; T112-C116 VanDerWaalsContact O-N 3.14Å; T112-A138 HydrophobicContact CG2-CB 3.74Å
113	L	97.8	Very high	97.1	Very high	10 Å²	10	34 Å²	34	5%	0.052	17%	0.172	C	C	.	.	H	α-helix	trans	-53.4	-35.5	171	-63.1	-178.6	0	0	0	112.8	L81 Y82 L103 C116 A117 L129	L81-L113 HydrophobicContact CB-CD1 3.8Å; L81-L113 HydrophobicContact CB-CD2 3.81Å; L81-L113 HydrophobicContact CB-CG 4.48Å; L81-L113 HydrophobicContact CD1-CD1 4.21Å; Y82-L113 HydrophobicContact CD2-CD2 4.4Å; L103-L113 HydrophobicContact CB-CD1 4.26Å; L103-L113 HydrophobicContact CD2-CD1 3.96Å; L113-C116 WeakPolarHBondContact O-CB 3.35Å; L113-C116 PolarHBondContact O-N 3.16Å; L113-A117 PolarHBondContact O-N 3.45Å; L113-L129 HydrophobicContact CB-CD1 3.97Å; L113-L129 HydrophobicContact CB-CD2 4.06Å; L113-L129 HydrophobicContact CD1-CD2 4.13Å
114	L	97.9	Very high	97.2	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-66.4	-39.8	178.4	-159.6	76	0	0	0	111.8	T112 C116 A118 L126 L129 V130 V134 I136 A146 L162	T112-L114 PolarHBondContact O-N 2.85Å; T112-L114 PolarHBondContact OG1-N 3.37Å; L114-C116 VanDerWaalsContact C-N 3.35Å; L114-A118 WeakPolarHBondContact O-CB 3.39Å; L114-A118 PolarHBondContact O-N 3.34Å; L114-L126 HydrophobicContact CD1-CD2 3.42Å; L114-L126 VanDerWaalsContact CD1-CD2 3.42Å; L114-L126 HydrophobicContact CG-CD2 3.76Å; L114-L126 WeakPolarHBondContact O-CD2 3.43Å; L114-L129 HydrophobicContact CD1-CB 3.89Å; L114-L129 HydrophobicContact CD1-CD1 4.12Å; L114-V130 HydrophobicContact CD1-CG2 4.1Å; L114-V134 HydrophobicContact CD1-CG2 4.02Å; L114-V134 HydrophobicContact CD2-CG2 4.43Å; L114-I136 HydrophobicContact CD2-CB 3.94Å; L114-I136 HydrophobicContact CD2-CG2 3.89Å; L114-A146 HydrophobicContact CB-CB 4.07Å; L114-A146 HydrophobicContact CD2-CB 3.72Å; L114-A146 HydrophobicContact CG-CB 3.69Å; L114-L162 HydrophobicContact CD2-CD2 4.02Å; L114-L162 HydrophobicContact CG-CD2 4.33Å
115	H	98.4	Very high	97.3	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-65.2	-40.1	174.2	-62.6	89.3	0	0	0	111.8	Y111 T112 A118 A119 A138 E144 A146	Y111-H115 HydrophobicContact CD1-CB 3.56Å; Y111-H115 HydrophobicContact CE1-CB 4.36Å; Y111-H115 HydrophobicContact CG-CB 4.42Å; T112-H115 PolarHBondContact N-ND1 2.88Å; T112-H115 VanDerWaalsContact N-ND1 3.15Å; T112-H115 PolarHBondContact O-N 3.23Å; T112-H115 VanDerWaalsContact O-N 3.07Å; T112-H115 PolarHBondContact OG1-ND1 3.03Å; H115-A118 WeakPolarHBondContact O-CB 3.47Å; H115-A118 PolarHBondContact O-N 3.09Å; H115-A119 PolarHBondContact O-N 3.35Å; H115-A138 PolarHBondContact CE1-O 3.08Å; H115-A138 PolarHBondContact NE2-O 3.48Å; H115-E144 PolarHBondContact NE2-O 2.7Å; H115-A146 PolarHBondContact CD2-N 3.42Å; H115-A146 PolarHBondContact NE2-N 3.45Å
116	C	97.6	Very high	97.4	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.007	16%	0.163	C	C	.	.	H	α-helix	trans	-60.4	-55	176.6	-179	0	0	0	0	111	Y82 C85 T112 L113 L114 A118 A119 W120	Y82-C116 HydrophobicContact CD2-CB 4.11Å; Y82-C116 HydrophobicContact CE1-CB 4.19Å; Y82-C116 WeakPolarHBondContact CE1-SG 3.31Å; Y82-C116 HydrophobicContact CE2-CB 3.65Å; C85-C116 HydrophobicContact CB-CB 4.36Å; T112-C116 PolarHBondContact O-N 2.9Å; T112-C116 VanDerWaalsContact O-N 3.14Å; L113-C116 WeakPolarHBondContact O-CB 3.35Å; L113-C116 PolarHBondContact O-N 3.16Å; L114-C116 VanDerWaalsContact C-N 3.35Å; C116-A118 PolarHBondContact O-N 3.32Å; C116-A119 PolarHBondContact O-N 2.97Å; C116-A119 VanDerWaalsContact O-N 3.15Å; C116-W120 VanDerWaalsContact O-CD1 3.24Å; C116-W120 PolarHBondContact O-N 3.43Å; C116-W120 VanDerWaalsContact O-N 3.13Å
117	A	98.1	Very high	97.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59	-35.5	178.7	0	0	0	0	0	112.1	C85 L113 G121 R122 T125 L126 L129	C85-A117 HydrophobicContact CB-CB 4.48Å; L113-A117 PolarHBondContact O-N 3.45Å; A117-G121 PolarHBondContact O-N 3.18Å; A117-G121 VanDerWaalsContact O-N 3.16Å; A117-R122 HydrophobicContact CB-CB 4.29Å; A117-R122 PolarHBondContact O-N 2.98Å; A117-T125 HydrophobicContact CB-CG2 3.89Å; A117-L126 HydrophobicContact CB-CD2 3.72Å; A117-L126 HydrophobicContact CB-CG 3.88Å; A117-L129 HydrophobicContact CB-CD1 4.19Å
118	A	98.3	Very high	97.6	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.5	-45.8	174.4	0	0	0	0	0	113.5	L114 H115 C116 W120 G121 L126 A146 A150 Q155 L162	L114-A118 WeakPolarHBondContact O-CB 3.39Å; L114-A118 PolarHBondContact O-N 3.34Å; H115-A118 WeakPolarHBondContact O-CB 3.47Å; H115-A118 PolarHBondContact O-N 3.09Å; C116-A118 PolarHBondContact O-N 3.32Å; A118-W120 VanDerWaalsContact C-N 3.31Å; A118-W120 PolarHBondContact O-N 3.49Å; A118-G121 PolarHBondContact O-N 3.47Å; A118-L126 HydrophobicContact CB-CD1 4.47Å; A118-L126 HydrophobicContact CB-CD2 4.24Å; A118-A146 HydrophobicContact CB-CB 4.11Å; A118-A146 WeakPolarHBondContact CB-O 3.28Å; A118-A150 HydrophobicContact CB-CB 3.95Å; A118-Q155 WeakPolarHBondContact O-CG 3.4Å; A118-L162 HydrophobicContact CB-CD1 4.26Å
119	A	97.5	Very high	97.8	Very high	20 Å²	20	25.2 Å²	25.2	17%	0.165	12%	0.121	C	C	.	.	H	α-helix	trans	-61	-41.2	178.1	0	0	0	0	0	112	H115 C116 G121 V149 Y153 Q155	H115-A119 PolarHBondContact O-N 3.35Å; C116-A119 PolarHBondContact O-N 2.97Å; C116-A119 VanDerWaalsContact O-N 3.15Å; A119-G121 VanDerWaalsContact C-N 3.33Å; A119-G121 PolarHBondContact O-N 3.3Å; A119-V149 HydrophobicContact CB-CG1 3.65Å; A119-Y153 HydrophobicContact CB-CD2 3.87Å; A119-Y153 HydrophobicContact CB-CE2 3.97Å; A119-Q155 PolarHBondContact O-NE2 2.79Å
120	W	96.6	Very high	97.8	Very high	85 Å²	85	23.6 Å²	23.6	32%	0.322	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	3	-177.2	-71.4	98.1	0	0	0	114.5	V27 M86 C116 A118 R122	V27-W120 HydrophobicContact CG1-CH2 3.14Å; V27-W120 HydrophobicContact CG1-CZ2 3.33Å; V27-W120 HydrophobicContact CG1-CZ3 4.02Å; M86-W120 HydrophobicContact CB-CG 4.47Å; M86-W120 HydrophobicContact CG-CD2 3.82Å; M86-W120 VanDerWaalsContact CG-CE2 3.44Å; M86-W120 HydrophobicContact CG-CE3 4.4Å; M86-W120 HydrophobicContact CG-CG 4.16Å; M86-W120 HydrophobicContact CG-CH2 4.23Å; M86-W120 HydrophobicContact CG-CZ2 3.67Å; M86-W120 HydrophobicContact SD-CH2 4.06Å; M86-W120 HydrophobicContact SD-CZ2 3.34Å; M86-W120 WeakPolarHBondContact SD-CZ2 3.49Å; C116-W120 VanDerWaalsContact O-CD1 3.24Å; C116-W120 PolarHBondContact O-N 3.43Å; C116-W120 VanDerWaalsContact O-N 3.13Å; A118-W120 VanDerWaalsContact C-N 3.31Å; A118-W120 PolarHBondContact O-N 3.49Å; W120-R122 VanDerWaalsContact C-N 3.29Å; W120-R122 HydrophobicContact CB-CG 3.86Å; W120-R122 WeakPolarHBondContact O-CD 3.36Å; W120-R122 PolarHBondContact O-N 3.14Å
121	G	97.6	Very high	97.8	Very high	21 Å²	21	28.7 Å²	28.7	22%	0.216	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	26.8	177.9	0	0	0	0	0	114.3	A117 A118 A119 L123 Q155 C158	A117-G121 PolarHBondContact O-N 3.18Å; A117-G121 VanDerWaalsContact O-N 3.16Å; A118-G121 PolarHBondContact O-N 3.47Å; A119-G121 VanDerWaalsContact C-N 3.33Å; A119-G121 PolarHBondContact O-N 3.3Å; G121-L123 VanDerWaalsContact C-N 3.34Å; G121-L123 PolarHBondContact O-N 3.12Å; G121-Q155 VanDerWaalsContact CA-CD 3.44Å; G121-C158 VanDerWaalsContact C-SG 3.59Å
122	R	98.2	Very high	97.8	Very high	91 Å²	91	30.7 Å²	30.7	34%	0.343	15%	0.149	S	C	.	.			trans	-85.9	73.2	-175.4	-54	-51.5	-168.9	-167.3	-1.9	111.1	C85 M86 A117 W120 E124 T125 L126	C85-R122 VanDerWaalsContact O-CG 3.3Å; C85-R122 WeakPolarHBondContact O-CG 3.49Å; M86-R122 PolarHBondContact O-NE 3.45Å; M86-R122 PolarHBondContact O-NH2 2.94Å; A117-R122 HydrophobicContact CB-CB 4.29Å; A117-R122 PolarHBondContact O-N 2.98Å; W120-R122 VanDerWaalsContact C-N 3.29Å; W120-R122 HydrophobicContact CB-CG 3.86Å; W120-R122 WeakPolarHBondContact O-CD 3.36Å; W120-R122 PolarHBondContact O-N 3.14Å; R122-E124 PolarHBondContact O-N 3.19Å; R122-T125 WeakPolarHBondContact O-CB 3.34Å; R122-T125 PolarHBondContact O-N 3.22Å; R122-L126 PolarHBondContact O-N 3.45Å
123	L	98.3	Very high	97.6	Very high	31 Å²	31	36.3 Å²	36.3	16%	0.162	18%	0.179	C	C	.	.	H	α-helix	trans	-52.7	-49.2	-175.1	179.5	62.1	0	0	0	113.6	G121 T125 L126 K127 E157 F161	G121-L123 VanDerWaalsContact C-N 3.34Å; G121-L123 PolarHBondContact O-N 3.12Å; L123-T125 VanDerWaalsContact C-N 3.25Å; L123-T125 PolarHBondContact O-N 2.96Å; L123-L126 WeakPolarHBondContact O-CB 3.36Å; L123-L126 PolarHBondContact O-N 3.25Å; L123-L126 VanDerWaalsContact O-N 3.15Å; L123-K127 HydrophobicContact CG-CD 4.5Å; L123-K127 WeakPolarHBondContact O-CG 3.11Å; L123-K127 PolarHBondContact O-N 2.89Å; L123-E157 HydrophobicContact CD2-CB 4.14Å; L123-F161 HydrophobicContact CD1-CB 3.61Å; L123-F161 HydrophobicContact CD1-CD1 4.36Å; L123-F161 HydrophobicContact CD1-CG 3.95Å
124	E	98.3	Very high	97.6	Very high	104 Å²	104	36.4 Å²	36.4	49%	0.486	18%	0.18	S	C	.	.	H	α-helix	trans	-66.6	-29.8	-178.8	-60.9	-51.1	127.9	0	0	112.5	R122 K127 A128	R122-E124 PolarHBondContact O-N 3.19Å; E124-K127 IonicContact OE1-NZ 2.89Å; E124-K127 PolarHBondContact OE1-NZ 3.47Å; E124-K127 IonicContact OE2-NZ 3.77Å; E124-A128 WeakPolarHBondContact O-CB 3.38Å; E124-A128 PolarHBondContact O-N 3.31Å
125	T	98.1	Very high	97.5	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-71.4	-40.3	172.5	-60.5	0	0	0	0	111.5	C85 G88 I93 A117 R122 L123 K127 A128 L129	C85-T125 HydrophobicContact CB-CG2 4.2Å; G88-T125 VanDerWaalsContact CA-OG1 3.28Å; G88-T125 WeakPolarHBondContact CA-OG1 3.37Å; G88-T125 PolarHBondContact O-OG1 3.18Å; I93-T125 HydrophobicContact CG1-CG2 4.45Å; A117-T125 HydrophobicContact CB-CG2 3.89Å; R122-T125 WeakPolarHBondContact O-CB 3.34Å; R122-T125 PolarHBondContact O-N 3.22Å; L123-T125 VanDerWaalsContact C-N 3.25Å; L123-T125 PolarHBondContact O-N 2.96Å; T125-K127 PolarHBondContact O-N 2.89Å; T125-A128 PolarHBondContact O-N 3.05Å; T125-L129 HydrophobicContact CG2-CD1 4.18Å; T125-L129 HydrophobicContact CG2-CG 4.48Å; T125-L129 WeakPolarHBondContact O-CG 3.43Å; T125-L129 PolarHBondContact O-N 2.94Å
126	L	97.7	Very high	97.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58.8	-46.6	172.7	-75.1	175	0	0	0	111.5	L114 A117 A118 R122 L123 A128 L129 V130 C158 F161 L162	L114-L126 HydrophobicContact CD1-CD2 3.42Å; L114-L126 VanDerWaalsContact CD1-CD2 3.42Å; L114-L126 HydrophobicContact CG-CD2 3.76Å; L114-L126 WeakPolarHBondContact O-CD2 3.43Å; A117-L126 HydrophobicContact CB-CD2 3.72Å; A117-L126 HydrophobicContact CB-CG 3.88Å; A118-L126 HydrophobicContact CB-CD1 4.47Å; A118-L126 HydrophobicContact CB-CD2 4.24Å; R122-L126 PolarHBondContact O-N 3.45Å; L123-L126 WeakPolarHBondContact O-CB 3.36Å; L123-L126 PolarHBondContact O-N 3.25Å; L123-L126 VanDerWaalsContact O-N 3.15Å; L126-A128 VanDerWaalsContact C-N 3.34Å; L126-A128 PolarHBondContact O-N 3.36Å; L126-L129 PolarHBondContact O-N 3.42Å; L126-V130 WeakPolarHBondContact O-CG2 3.37Å; L126-V130 PolarHBondContact O-N 3.1Å; L126-C158 HydrophobicContact CD1-CB 3.47Å; L126-C158 VanDerWaalsContact CD1-CB 3.47Å; L126-C158 WeakPolarHBondContact CD1-SG 3.29Å; L126-F161 HydrophobicContact CB-CD1 3.95Å; L126-F161 HydrophobicContact CB-CE1 3.93Å; L126-L162 HydrophobicContact CD1-CD1 4.15Å; L126-L162 HydrophobicContact CD1-CG 4.39Å; L126-L162 HydrophobicContact CD2-CD2 4.46Å
127	K	98.1	Very high	97.5	Very high	61 Å²	61	44.1 Å²	44.1	27%	0.265	22%	0.219	S	C	.	.	H	α-helix	trans	-56	-49.3	175.4	-71.2	172	-177.3	168.7	0	111.3	L123 E124 T125 L129 V130 E131 F161	L123-K127 HydrophobicContact CG-CD 4.5Å; L123-K127 WeakPolarHBondContact O-CG 3.11Å; L123-K127 PolarHBondContact O-N 2.89Å; E124-K127 IonicContact OE1-NZ 2.89Å; E124-K127 PolarHBondContact OE1-NZ 3.47Å; E124-K127 IonicContact OE2-NZ 3.77Å; T125-K127 PolarHBondContact O-N 2.89Å; K127-L129 PolarHBondContact O-N 3.05Å; K127-V130 PolarHBondContact O-N 3.32Å; K127-E131 WeakPolarHBondContact O-CG 3.31Å; K127-E131 PolarHBondContact O-N 2.9Å; K127-F161 HydrophobicContact CB-CE2 4.41Å; K127-F161 HydrophobicContact CB-CZ 4.11Å; K127-F161 HydrophobicContact CG-CD1 4.45Å; K127-F161 HydrophobicContact CG-CD2 3.92Å; K127-F161 HydrophobicContact CG-CE1 4.09Å; K127-F161 HydrophobicContact CG-CE2 3.53Å; K127-F161 HydrophobicContact CG-CG 4.37Å; K127-F161 HydrophobicContact CG-CZ 3.63Å
128	A	98.2	Very high	97.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60	-42.6	178	0	0	0	0	0	113	R94 E124 T125 L126 E131 L132	R94-A128 HydrophobicContact CG-CB 4.27Å; E124-A128 WeakPolarHBondContact O-CB 3.38Å; E124-A128 PolarHBondContact O-N 3.31Å; T125-A128 PolarHBondContact O-N 3.05Å; L126-A128 VanDerWaalsContact C-N 3.34Å; L126-A128 PolarHBondContact O-N 3.36Å; A128-E131 PolarHBondContact O-N 3.4Å; A128-L132 WeakPolarHBondContact O-CD1 3.43Å; A128-L132 VanDerWaalsContact O-CG 3.23Å; A128-L132 WeakPolarHBondContact O-CG 3.44Å; A128-L132 PolarHBondContact O-N 3.02Å; A128-L132 VanDerWaalsContact O-N 3.17Å
129	L	98.3	Very high	97.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65	-44.7	177.1	-72.6	169.8	0	0	0	111.8	I93 L113 L114 A117 T125 L126 K127 E131 L132 V134	I93-L129 HydrophobicContact CG2-CD2 3.84Å; L113-L129 HydrophobicContact CB-CD1 3.97Å; L113-L129 HydrophobicContact CB-CD2 4.06Å; L113-L129 HydrophobicContact CD1-CD2 4.13Å; L114-L129 HydrophobicContact CD1-CB 3.89Å; L114-L129 HydrophobicContact CD1-CD1 4.12Å; A117-L129 HydrophobicContact CB-CD1 4.19Å; T125-L129 HydrophobicContact CG2-CD1 4.18Å; T125-L129 HydrophobicContact CG2-CG 4.48Å; T125-L129 WeakPolarHBondContact O-CG 3.43Å; T125-L129 PolarHBondContact O-N 2.94Å; L126-L129 PolarHBondContact O-N 3.42Å; K127-L129 PolarHBondContact O-N 3.05Å; L129-E131 VanDerWaalsContact C-N 3.31Å; L129-E131 PolarHBondContact O-N 2.99Å; L129-L132 CarbonylContact O-C 3.6Å; L129-L132 WeakPolarHBondContact O-CA 3.23Å; L129-L132 WeakPolarHBondContact O-CB 3.46Å; L129-L132 PolarHBondContact O-N 3.17Å; L129-V134 HydrophobicContact CB-CG1 4.32Å; L129-V134 HydrophobicContact CB-CG2 3.96Å; L129-V134 HydrophobicContact CD2-CG1 4.21Å; L129-V134 WeakPolarHBondContact O-CG1 3.44Å; L129-V134 WeakPolarHBondContact O-CG2 3.46Å; L129-V134 PolarHBondContact O-N 3.43Å
130	V	97.1	Very high	97.5	Very high	30 Å²	30	47.6 Å²	47.6	18%	0.182	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-38.7	177.7	171.6	0	0	0	0	111.6	L114 L126 K127 L132 D133 I136 F161 A165	L114-V130 HydrophobicContact CD1-CG2 4.1Å; L126-V130 WeakPolarHBondContact O-CG2 3.37Å; L126-V130 PolarHBondContact O-N 3.1Å; K127-V130 PolarHBondContact O-N 3.32Å; V130-L132 PolarHBondContact O-N 3.34Å; V130-D133 PolarHBondContact O-N 3.3Å; V130-D133 VanDerWaalsContact O-N 3.1Å; V130-I136 HydrophobicContact CG2-CG2 3.9Å; V130-F161 HydrophobicContact CB-CE1 4.24Å; V130-F161 HydrophobicContact CB-CZ 4.02Å; V130-F161 HydrophobicContact CG1-CZ 4.3Å; V130-F161 HydrophobicContact CG2-CE1 3.72Å; V130-F161 HydrophobicContact CG2-CZ 3.99Å; V130-A165 HydrophobicContact CG1-CB 4.19Å; V130-A165 HydrophobicContact CG2-CB 4.43Å
131	E	95.9	Very high	97.5	Very high	122 Å²	122	47.8 Å²	47.8	57%	0.57	24%	0.238	S	C	*	.	H	α-helix	trans	-64.9	-24.3	173.2	-73.5	172	-153.5	0	0	113.4	R94 K127 A128 L129 D133	R94-E131 IonicContact CZ-OE2 2.72Å; R94-E131 IonicContact NH1-OE2 3.86Å; R94-E131 PolarHBondContact NH1-OE2 3.33Å; R94-E131 VanDerWaalsContact NH2-CD 3.32Å; R94-E131 IonicContact NH2-OE1 3.12Å; R94-E131 PolarHBondContact NH2-OE1 3.3Å; R94-E131 IonicContact NH2-OE2 3.57Å; R94-E131 PolarHBondContact NH2-OE2 2.85Å; K127-E131 WeakPolarHBondContact O-CG 3.31Å; K127-E131 PolarHBondContact O-N 2.9Å; A128-E131 PolarHBondContact O-N 3.4Å; L129-E131 VanDerWaalsContact C-N 3.31Å; L129-E131 PolarHBondContact O-N 2.99Å; E131-D133 PolarHBondContact O-N 2.93Å
132	L	96.9	Very high	97.4	Very high	58 Å²	58	50.6 Å²	50.6	30%	0.304	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	16.3	174.3	-66.2	165.5	0	0	0	112.5	I93 A97 L103 A128 L129 V130 V134	I93-L132 HydrophobicContact CG2-CD1 3.98Å; A97-L132 HydrophobicContact CB-CD1 3.99Å; A97-L132 HydrophobicContact CB-CD2 3.99Å; L103-L132 HydrophobicContact CD1-CB 3.68Å; L103-L132 HydrophobicContact CD1-CD1 3.68Å; L103-L132 HydrophobicContact CD1-CG 4.21Å; A128-L132 WeakPolarHBondContact O-CD1 3.43Å; A128-L132 VanDerWaalsContact O-CG 3.23Å; A128-L132 WeakPolarHBondContact O-CG 3.44Å; A128-L132 PolarHBondContact O-N 3.02Å; A128-L132 VanDerWaalsContact O-N 3.17Å; L129-L132 CarbonylContact O-C 3.6Å; L129-L132 WeakPolarHBondContact O-CA 3.23Å; L129-L132 WeakPolarHBondContact O-CB 3.46Å; L129-L132 PolarHBondContact O-N 3.17Å; V130-L132 PolarHBondContact O-N 3.34Å; L132-V134 VanDerWaalsContact C-N 3.27Å; L132-V134 PolarHBondContact O-N 3.46Å
133	D	95	Very high	97.4	Very high	124 Å²	124	54 Å²	54	66%	0.663	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	36.9	176.7	-74	-57.3	0	0	0	113.5	V130 E131 K172	V130-D133 PolarHBondContact O-N 3.3Å; V130-D133 VanDerWaalsContact O-N 3.1Å; E131-D133 PolarHBondContact O-N 2.93Å; D133-K172 IonicContact OD1-NZ 3.99Å
134	V	96.9	Very high	97.4	Very high	12 Å²	12	53.9 Å²	53.9	7%	0.073	26%	0.261	C	S	.	.			trans	-66.4	156.7	170.6	-56.2	0	0	0	0	111.7	L103 N104 L114 L129 L132 I136	L103-V134 HydrophobicContact CB-CG1 3.62Å; L103-V134 HydrophobicContact CD1-CG1 4.15Å; N104-V134 WeakPolarHBondContact OD1-CA 3.41Å; N104-V134 WeakPolarHBondContact OD1-CB 3.33Å; L114-V134 HydrophobicContact CD1-CG2 4.02Å; L114-V134 HydrophobicContact CD2-CG2 4.43Å; L129-V134 HydrophobicContact CB-CG1 4.32Å; L129-V134 HydrophobicContact CB-CG2 3.96Å; L129-V134 HydrophobicContact CD2-CG1 4.21Å; L129-V134 WeakPolarHBondContact O-CG1 3.44Å; L129-V134 WeakPolarHBondContact O-CG2 3.46Å; L129-V134 PolarHBondContact O-N 3.43Å; L132-V134 VanDerWaalsContact C-N 3.27Å; L132-V134 PolarHBondContact O-N 3.46Å; V134-I136 PolarHBondContact O-N 2.99Å; V134-I136 VanDerWaalsContact O-N 3.12Å
135	D	97.4	Very high	97.4	Very high	73 Å²	73	53.3 Å²	53.3	39%	0.39	25%	0.254	S	S	.	.			trans	-72.7	102.5	175.9	-177.5	10.5	0	0	0	111	N104 E137 A138	N104-D135 PolarHBondContact OD1-N 2.97Å; D135-E137 VanDerWaalsContact C-N 3.28Å; D135-E137 PolarHBondContact O-N 3.34Å; D135-E137 PolarHBondContact OD1-N 3.09Å; D135-A138 HydrophobicContact CB-CB 4.3Å; D135-A138 PolarHBondContact OD1-N 3.28Å
136	I	97.3	Very high	97.4	Very high	22 Å²	22	53.3 Å²	53.3	11%	0.113	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-14.7	178.1	71.4	176.8	0	0	0	113.6	L114 V130 V134 A165 L169	L114-I136 HydrophobicContact CD2-CB 3.94Å; L114-I136 HydrophobicContact CD2-CG2 3.89Å; V130-I136 HydrophobicContact CG2-CG2 3.9Å; V134-I136 PolarHBondContact O-N 2.99Å; V134-I136 VanDerWaalsContact O-N 3.12Å; I136-A165 HydrophobicContact CD1-CB 4.3Å; I136-L169 HydrophobicContact CD1-CB 3.71Å; I136-L169 HydrophobicContact CD1-CD2 3.46Å; I136-L169 VanDerWaalsContact CD1-CD2 3.46Å; I136-L169 HydrophobicContact CD1-CG 4.19Å; I136-L169 HydrophobicContact CG1-CD2 3.48Å; I136-L169 VanDerWaalsContact CG1-CD2 3.48Å
137	E	97.6	Very high	97.4	Very high	72 Å²	72	57.2 Å²	57.2	34%	0.336	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	1	-179.8	-66.9	176.1	148.5	0	0	112.6	D135 L139 L169 K173	D135-E137 VanDerWaalsContact C-N 3.28Å; D135-E137 PolarHBondContact O-N 3.34Å; D135-E137 PolarHBondContact OD1-N 3.09Å; E137-L139 PolarHBondContact O-N 3.49Å; E137-L169 HydrophobicContact CG-CD2 4.04Å; E137-K173 IonicContact OE1-NZ 2.52Å; E137-K173 PolarHBondContact OE1-NZ 3.44Å; E137-K173 IonicContact OE2-NZ 3.78Å; E137-K173 PolarHBondContact OE2-NZ 3.13Å
138	A	97.9	Very high	97.4	Very high	6 Å²	6	56.5 Å²	56.5	5%	0.05	27%	0.268	C	S	.	.			trans	-55.1	132.7	177.7	0	0	0	0	0	110.6	T112 H115 D135	T112-A138 HydrophobicContact CG2-CB 3.74Å; H115-A138 PolarHBondContact CE1-O 3.08Å; H115-A138 PolarHBondContact NE2-O 3.48Å; D135-A138 HydrophobicContact CB-CB 4.3Å; D135-A138 PolarHBondContact OD1-N 3.28Å
139	L	98.3	Very high	97.4	Very high	78 Å²	78	56.5 Å²	56.5	41%	0.408	27%	0.268	S	S	.	.			trans	-99.2	140.9	175.2	-55.8	-179	0	0	0	111.4	K106 E137 E144 R145	K106-L139 PolarHBondContact NZ-O 2.93Å; E137-L139 PolarHBondContact O-N 3.49Å; L139-E144 WeakPolarHBondContact CA-O 3.27Å; L139-R145 HydrophobicContact CD2-CG 3.42Å; L139-R145 VanDerWaalsContact CD2-CG 3.42Å
140	N	97.3	Very high	97.4	Very high	9 Å²	9	56.5 Å²	56.5	5%	0.048	27%	0.268	C	S	.	.			trans	-84.8	-174.8	167	75	7.2	0	0	0	111.6	G110 Y111 R142 E143 E144	G110-N140 WeakPolarHBondContact O-CA 3.38Å; Y111-N140 HydrophobicContact CD1-CB 4.41Å; Y111-N140 HydrophobicContact CD2-CB 4.29Å; Y111-N140 WeakPolarHBondContact CE1-ND2 3.35Å; Y111-N140 HydrophobicContact CE2-CB 4.46Å; Y111-N140 HydrophobicContact CG-CB 4.28Å; N140-R142 PolarHBondContact O-N 3.2Å; N140-R142 WeakPolarHBondContact OD1-CA 3.44Å; N140-R142 WeakPolarHBondContact OD1-CB 3.11Å; N140-R142 PolarHBondContact OD1-N 3Å; N140-E143 PolarHBondContact O-N 3.03Å; N140-E143 PolarHBondContact OD1-N 2.82Å; N140-E144 PolarHBondContact N-O 3.24Å; N140-E144 PolarHBondContact ND2-OE2 2.97Å; N140-E144 VanDerWaalsContact ND2-OE2 3.1Å; N140-E144 WeakPolarHBondContact OD1-CB 3.32Å; N140-E144 PolarHBondContact OD1-N 2.99Å
141	F	96.9	Very high	97.5	Very high	88 Å²	88	57.3 Å²	57.3	39%	0.386	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.2	179.2	81	-73.3	0	0	0	115.1	R109 Y111 E143	R109-F141 HydrophobicContact CB-CB 4.48Å; R109-F141 HydrophobicContact CB-CD1 3.66Å; R109-F141 HydrophobicContact CB-CE1 4.18Å; R109-F141 HydrophobicContact CB-CG 4.2Å; R109-F141 HydrophobicContact CG-CD1 4.33Å; R109-F141 VanDerWaalsContact O-CB 3.29Å; R109-F141 WeakPolarHBondContact O-CB 3.29Å; R109-F141 VanDerWaalsContact O-CD1 3.28Å; R109-F141 WeakPolarHBondContact O-CD1 3.47Å; R109-F141 PolarHBondContact O-N 2.87Å; Y111-F141 AromaticContact CE2-CD1 3.83Å; Y111-F141 HydrophobicContact CE2-CD1 3.83Å; Y111-F141 AromaticContact CE2-CE1 3.61Å; Y111-F141 HydrophobicContact CE2-CE1 3.61Å; F141-E143 VanDerWaalsContact C-N 3.3Å
142	R	95.9	Very high	97.5	Very high	81 Å²	81	55.6 Å²	55.6	31%	0.306	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	8.1	174.9	-66.5	-171.4	172.1	-155.8	-0.6	112.4	D22 N140 E144	D22-R142 IonicContact OD1-CZ 3.78Å; D22-R142 IonicContact OD1-NH1 3.34Å; D22-R142 PolarHBondContact OD1-NH1 2.9Å; D22-R142 IonicContact OD1-NH2 3.17Å; N140-R142 PolarHBondContact O-N 3.2Å; N140-R142 WeakPolarHBondContact OD1-CA 3.44Å; N140-R142 WeakPolarHBondContact OD1-CB 3.11Å; N140-R142 PolarHBondContact OD1-N 3Å; R142-E144 HydrophobicContact CB-CG 3.79Å; R142-E144 PolarHBondContact O-N 2.67Å
143	E	97.7	Very high	97.4	Very high	161 Å²	161	56.7 Å²	56.7	75%	0.752	27%	0.267	S	S	*	.	S	Bend	trans	58.7	23.2	-170.8	-53.1	-173.1	162.1	0	0	113.2	N140 F141	N140-E143 PolarHBondContact O-N 3.03Å; N140-E143 PolarHBondContact OD1-N 2.82Å; F141-E143 VanDerWaalsContact C-N 3.3Å
144	E	98	Very high	97.6	Very high	30 Å²	30	55.4 Å²	55.4	14%	0.14	27%	0.268	C	S	.	.			trans	-87.2	140.8	176.4	-64.1	175.5	138.9	0	0	110	H115 L139 N140 R142 D148 V149 R152	H115-E144 PolarHBondContact NE2-O 2.7Å; L139-E144 WeakPolarHBondContact CA-O 3.27Å; N140-E144 PolarHBondContact N-O 3.24Å; N140-E144 PolarHBondContact ND2-OE2 2.97Å; N140-E144 VanDerWaalsContact ND2-OE2 3.1Å; N140-E144 WeakPolarHBondContact OD1-CB 3.32Å; N140-E144 PolarHBondContact OD1-N 2.99Å; R142-E144 HydrophobicContact CB-CG 3.79Å; R142-E144 PolarHBondContact O-N 2.67Å; E144-D148 HydrophobicContact CB-CB 3.99Å; E144-D148 HydrophobicContact CG-CB 4.28Å; E144-V149 HydrophobicContact CB-CG2 4.06Å; E144-R152 IonicContact OE1-CZ 3.61Å; E144-R152 IonicContact OE1-NE 2.73Å; E144-R152 PolarHBondContact OE1-NE 3.37Å; E144-R152 IonicContact OE1-NH2 3.95Å; E144-R152 IonicContact OE2-CZ 3.44Å; E144-R152 IonicContact OE2-NE 2.86Å; E144-R152 IonicContact OE2-NH2 3.34Å; E144-R152 PolarHBondContact OE2-NH2 3.25Å
145	R	98.3	Very high	97.6	Very high	91 Å²	91	58 Å²	58	34%	0.343	28%	0.279	S	S	.	.			trans	-83.8	167.6	161.4	-67.8	176.1	-79.9	-173.6	-4.6	110	L139 R147 D148 V149	L139-R145 HydrophobicContact CD2-CG 3.42Å; L139-R145 VanDerWaalsContact CD2-CG 3.42Å; R145-R147 PolarHBondContact O-N 3.19Å; R145-R147 VanDerWaalsContact O-N 3.11Å; R145-D148 WeakPolarHBondContact CB-OD2 3.49Å; R145-D148 PolarHBondContact N-OD2 3.35Å; R145-D148 IonicContact NE-OD2 2.71Å; R145-D148 PolarHBondContact O-N 3.33Å; R145-V149 PolarHBondContact O-N 3.06Å; R145-V149 VanDerWaalsContact O-N 3.11Å
146	A	98.2	Very high	97.7	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.008	29%	0.287	C	S	.	.	H	α-helix	trans	-53.3	-35.1	173.1	0	0	0	0	0	112.8	L114 H115 A118 D148 V149 A150 L162	L114-A146 HydrophobicContact CB-CB 4.07Å; L114-A146 HydrophobicContact CD2-CB 3.72Å; L114-A146 HydrophobicContact CG-CB 3.69Å; H115-A146 PolarHBondContact CD2-N 3.42Å; H115-A146 PolarHBondContact NE2-N 3.45Å; A118-A146 HydrophobicContact CB-CB 4.11Å; A118-A146 WeakPolarHBondContact CB-O 3.28Å; A146-D148 PolarHBondContact O-N 3.08Å; A146-V149 PolarHBondContact O-N 2.87Å; A146-A150 PolarHBondContact O-N 3.22Å; A146-L162 HydrophobicContact CB-CD1 4.12Å
147	R	98.4	Very high	97.7	Very high	82 Å²	82	64 Å²	64	31%	0.309	31%	0.311	S	S	.	.	H	α-helix	trans	-60.4	-44.6	175.1	-177.4	-155.8	-179.2	-79.1	-12.8	112.1	R145 V149 A150 A151 V159 L162 D163	R145-R147 PolarHBondContact O-N 3.19Å; R145-R147 VanDerWaalsContact O-N 3.11Å; R147-V149 VanDerWaalsContact C-N 3.34Å; R147-A150 PolarHBondContact O-N 3.03Å; R147-A151 PolarHBondContact O-N 2.96Å; R147-V159 HydrophobicContact CG-CG1 4.33Å; R147-L162 HydrophobicContact CB-CB 4.04Å; R147-L162 HydrophobicContact CB-CD1 4.27Å; R147-L162 HydrophobicContact CG-CB 4.29Å; R147-D163 IonicContact CZ-OD1 3.75Å; R147-D163 IonicContact CZ-OD2 3.74Å; R147-D163 VanDerWaalsContact NE-CG 3.32Å; R147-D163 IonicContact NE-OD1 2.67Å; R147-D163 PolarHBondContact NE-OD1 3.07Å; R147-D163 IonicContact NE-OD2 3.85Å; R147-D163 PolarHBondContact NE-OD2 2.92Å; R147-D163 IonicContact NH2-OD1 3.01Å; R147-D163 PolarHBondContact NH2-OD1 2.87Å; R147-D163 IonicContact NH2-OD2 3.6Å; R147-D163 PolarHBondContact NH2-OD2 3.42Å
148	D	98.3	Very high	97.7	Very high	46 Å²	46	60.8 Å²	60.8	25%	0.246	30%	0.296	C	S	.	.	H	α-helix	trans	-69.1	-38.7	-176.9	-53.1	-45.9	0	0	0	109.9	E144 R145 A146 A151 R152	E144-D148 HydrophobicContact CB-CB 3.99Å; E144-D148 HydrophobicContact CG-CB 4.28Å; R145-D148 WeakPolarHBondContact CB-OD2 3.49Å; R145-D148 PolarHBondContact N-OD2 3.35Å; R145-D148 IonicContact NE-OD2 2.71Å; R145-D148 PolarHBondContact O-N 3.33Å; A146-D148 PolarHBondContact O-N 3.08Å; D148-A151 PolarHBondContact O-N 3.11Å; D148-R152 WeakPolarHBondContact O-CB 3.44Å; D148-R152 PolarHBondContact O-N 2.81Å
149	V	98.1	Very high	97.8	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.3	-47.4	170.7	177.2	0	0	0	0	111.7	Y111 A119 E144 R145 A146 R147 A151 R152 Y153	Y111-V149 HydrophobicContact CE1-CG2 4.26Å; A119-V149 HydrophobicContact CB-CG1 3.65Å; E144-V149 HydrophobicContact CB-CG2 4.06Å; R145-V149 PolarHBondContact O-N 3.06Å; R145-V149 VanDerWaalsContact O-N 3.11Å; A146-V149 PolarHBondContact O-N 2.87Å; R147-V149 VanDerWaalsContact C-N 3.34Å; V149-A151 VanDerWaalsContact C-N 3.27Å; V149-A151 PolarHBondContact O-N 3.39Å; V149-R152 PolarHBondContact O-N 3.05Å; V149-Y153 HydrophobicContact CG1-CD2 3.9Å; V149-Y153 HydrophobicContact CG1-CE2 4.01Å; V149-Y153 WeakPolarHBondContact O-CD2 3.28Å; V149-Y153 PolarHBondContact O-N 2.88Å; V149-Y153 VanDerWaalsContact O-N 3.07Å
150	A	98.3	Very high	97.8	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-56.8	-42.4	175.4	0	0	0	0	0	111.6	A118 A146 R147 Y153 S154 Q155 C158 V159 L162	A118-A150 HydrophobicContact CB-CB 3.95Å; A146-A150 PolarHBondContact O-N 3.22Å; R147-A150 PolarHBondContact O-N 3.03Å; A150-Y153 CarbonylContact O-C 3.59Å; A150-Y153 PolarHBondContact O-N 2.91Å; A150-S154 PolarHBondContact O-N 3.04Å; A150-S154 VanDerWaalsContact O-N 3.14Å; A150-Q155 HydrophobicContact CB-CB 4.17Å; A150-Q155 PolarHBondContact O-N 3.15Å; A150-C158 HydrophobicContact CB-CB 3.9Å; A150-V159 HydrophobicContact CB-CG2 3.67Å; A150-L162 HydrophobicContact CB-CD1 4.38Å
151	A	98.1	Very high	97.8	Very high	47 Å²	47	64.6 Å²	64.6	39%	0.388	31%	0.311	S	S	.	.	H	α-helix	trans	-64.8	-43.1	177.6	0	0	0	0	0	112.1	R147 D148 V149 Y153 S154 V159	R147-A151 PolarHBondContact O-N 2.96Å; D148-A151 PolarHBondContact O-N 3.11Å; V149-A151 VanDerWaalsContact C-N 3.27Å; V149-A151 PolarHBondContact O-N 3.39Å; A151-Y153 VanDerWaalsContact C-N 3.3Å; A151-Y153 PolarHBondContact O-N 2.85Å; A151-S154 PolarHBondContact O-N 3.21Å; A151-V159 HydrophobicContact CB-CG2 3.95Å
152	R	96.9	Very high	97.8	Very high	87 Å²	87	60.8 Å²	60.8	33%	0.328	30%	0.295	S	S	.	.	H	α-helix	trans	-60	-38.1	177.6	-178.1	161.8	55.9	78.1	-2.2	112.5	Y111 E144 D148 V149 S154	Y111-R152 PolarHBondContact OH-NH2 3.48Å; E144-R152 IonicContact OE1-CZ 3.61Å; E144-R152 IonicContact OE1-NE 2.73Å; E144-R152 PolarHBondContact OE1-NE 3.37Å; E144-R152 IonicContact OE1-NH2 3.95Å; E144-R152 IonicContact OE2-CZ 3.44Å; E144-R152 IonicContact OE2-NE 2.86Å; E144-R152 IonicContact OE2-NH2 3.34Å; E144-R152 PolarHBondContact OE2-NH2 3.25Å; D148-R152 WeakPolarHBondContact O-CB 3.44Å; D148-R152 PolarHBondContact O-N 2.81Å; V149-R152 PolarHBondContact O-N 3.05Å; R152-S154 VanDerWaalsContact C-N 3.33Å
153	Y	95.7	Very high	97.9	Very high	80 Å²	80	59.2 Å²	59.2	31%	0.314	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	12.6	175.1	-70.1	-82.1	0	0	0	114.1	A119 V149 A150 A151 Q155	A119-Y153 HydrophobicContact CB-CD2 3.87Å; A119-Y153 HydrophobicContact CB-CE2 3.97Å; V149-Y153 HydrophobicContact CG1-CD2 3.9Å; V149-Y153 HydrophobicContact CG1-CE2 4.01Å; V149-Y153 WeakPolarHBondContact O-CD2 3.28Å; V149-Y153 PolarHBondContact O-N 2.88Å; V149-Y153 VanDerWaalsContact O-N 3.07Å; A150-Y153 CarbonylContact O-C 3.59Å; A150-Y153 PolarHBondContact O-N 2.91Å; A151-Y153 VanDerWaalsContact C-N 3.3Å; A151-Y153 PolarHBondContact O-N 2.85Å; Y153-Q155 VanDerWaalsContact C-N 3.26Å; Y153-Q155 PolarHBondContact O-N 2.83Å
154	S	97.6	Very high	97.9	Very high	98 Å²	98	54.1 Å²	54.1	69%	0.685	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	31.9	178.5	-56.3	0	0	0	0	115	A150 A151 R152 T156	A150-S154 PolarHBondContact O-N 3.04Å; A150-S154 VanDerWaalsContact O-N 3.14Å; A151-S154 PolarHBondContact O-N 3.21Å; R152-S154 VanDerWaalsContact C-N 3.33Å; S154-T156 PolarHBondContact O-N 2.9Å; S154-T156 VanDerWaalsContact O-N 3.14Å
155	Q	98.1	Very high	97.9	Very high	65 Å²	65	52.9 Å²	52.9	30%	0.304	26%	0.261	S	S	.	.			trans	-87.2	71.4	179.4	-55.5	-63.4	-7.4	0	0	110.9	A118 A119 G121 A150 Y153 E157 C158 V159	A118-Q155 WeakPolarHBondContact O-CG 3.4Å; A119-Q155 PolarHBondContact O-NE2 2.79Å; G121-Q155 VanDerWaalsContact CA-CD 3.44Å; A150-Q155 HydrophobicContact CB-CB 4.17Å; A150-Q155 PolarHBondContact O-N 3.15Å; Y153-Q155 VanDerWaalsContact C-N 3.26Å; Y153-Q155 PolarHBondContact O-N 2.83Å; Q155-E157 PolarHBondContact O-N 3.02Å; Q155-C158 HydrophobicContact CB-CB 4Å; Q155-C158 WeakPolarHBondContact O-CB 3.45Å; Q155-C158 PolarHBondContact O-N 3.34Å; Q155-V159 PolarHBondContact O-N 3.11Å
156	T	98.1	Very high	97.8	Very high	92 Å²	92	50.7 Å²	50.7	56%	0.564	26%	0.257	S	S	*	.	H	α-helix	trans	-54.8	-46.5	-169.9	-51.4	0	0	0	0	114	S154 C158 V159 E160	S154-T156 PolarHBondContact O-N 2.9Å; S154-T156 VanDerWaalsContact O-N 3.14Å; T156-C158 PolarHBondContact O-N 3.36Å; T156-V159 WeakPolarHBondContact O-CB 3.43Å; T156-V159 PolarHBondContact O-N 2.94Å; T156-V159 VanDerWaalsContact O-N 3.11Å; T156-E160 WeakPolarHBondContact O-CG 3.47Å; T156-E160 PolarHBondContact O-N 2.88Å
157	E	98.1	Very high	97.6	Very high	131 Å²	131	51.2 Å²	51.2	61%	0.612	26%	0.261	S	S	*	.	H	α-helix	trans	-63.1	-34	-179.8	-61.1	-176.4	157	0	0	112.1	L123 Q155 F161	L123-E157 HydrophobicContact CD2-CB 4.14Å; Q155-E157 PolarHBondContact O-N 3.02Å; E157-F161 WeakPolarHBondContact O-CB 3.34Å; E157-F161 PolarHBondContact O-N 3.26Å
158	C	98.4	Very high	97.5	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.02	26%	0.255	C	S	.	.	H	α-helix	trans	-70.1	-38.9	175.7	-66.3	0	0	0	0	111.3	G121 L126 A150 Q155 T156 F161 L162	G121-C158 VanDerWaalsContact C-SG 3.59Å; L126-C158 HydrophobicContact CD1-CB 3.47Å; L126-C158 VanDerWaalsContact CD1-CB 3.47Å; L126-C158 WeakPolarHBondContact CD1-SG 3.29Å; A150-C158 HydrophobicContact CB-CB 3.9Å; Q155-C158 HydrophobicContact CB-CB 4Å; Q155-C158 WeakPolarHBondContact O-CB 3.45Å; Q155-C158 PolarHBondContact O-N 3.34Å; T156-C158 PolarHBondContact O-N 3.36Å; C158-F161 PolarHBondContact O-N 2.9Å; C158-L162 WeakPolarHBondContact O-CB 3.39Å; C158-L162 WeakPolarHBondContact O-CD1 3.31Å; C158-L162 WeakPolarHBondContact O-CG 3.32Å; C158-L162 PolarHBondContact O-N 3.08Å
159	V	98.6	Very high	97.3	Very high	21 Å²	21	49.2 Å²	49.2	13%	0.127	25%	0.253	C	S	.	.	H	α-helix	trans	-61.3	-49.6	174.1	176.7	0	0	0	0	110.5	R147 A150 A151 Q155 T156 F161 L162 D163	R147-V159 HydrophobicContact CG-CG1 4.33Å; A150-V159 HydrophobicContact CB-CG2 3.67Å; A151-V159 HydrophobicContact CB-CG2 3.95Å; Q155-V159 PolarHBondContact O-N 3.11Å; T156-V159 WeakPolarHBondContact O-CB 3.43Å; T156-V159 PolarHBondContact O-N 2.94Å; T156-V159 VanDerWaalsContact O-N 3.11Å; V159-F161 VanDerWaalsContact C-N 3.32Å; V159-F161 PolarHBondContact O-N 3.11Å; V159-L162 PolarHBondContact O-N 3.42Å; V159-D163 WeakPolarHBondContact O-CB 3.37Å; V159-D163 PolarHBondContact O-N 2.99Å
160	E	97.9	Very high	97.2	Very high	125 Å²	125	51 Å²	51	58%	0.584	26%	0.264	S	S	*	.	H	α-helix	trans	-59	-43.7	179.4	-70.5	180	176.5	0	0	111.9	T156 W164	T156-E160 WeakPolarHBondContact O-CG 3.47Å; T156-E160 PolarHBondContact O-N 2.88Å; E160-W164 WeakPolarHBondContact O-CB 3.2Å; E160-W164 PolarHBondContact O-N 3.4Å
161	F	98.3	Very high	97.1	Very high	27 Å²	27	51 Å²	51	12%	0.118	26%	0.264	C	S	.	.	H	α-helix	trans	-64.9	-41.8	176.3	174.2	-104.1	0	0	0	112.7	L123 L126 K127 V130 E157 C158 V159 W164 A165	L123-F161 HydrophobicContact CD1-CB 3.61Å; L123-F161 HydrophobicContact CD1-CD1 4.36Å; L123-F161 HydrophobicContact CD1-CG 3.95Å; L126-F161 HydrophobicContact CB-CD1 3.95Å; L126-F161 HydrophobicContact CB-CE1 3.93Å; K127-F161 HydrophobicContact CB-CE2 4.41Å; K127-F161 HydrophobicContact CB-CZ 4.11Å; K127-F161 HydrophobicContact CG-CD1 4.45Å; K127-F161 HydrophobicContact CG-CD2 3.92Å; K127-F161 HydrophobicContact CG-CE1 4.09Å; K127-F161 HydrophobicContact CG-CE2 3.53Å; K127-F161 HydrophobicContact CG-CG 4.37Å; K127-F161 HydrophobicContact CG-CZ 3.63Å; V130-F161 HydrophobicContact CB-CE1 4.24Å; V130-F161 HydrophobicContact CB-CZ 4.02Å; V130-F161 HydrophobicContact CG1-CZ 4.3Å; V130-F161 HydrophobicContact CG2-CE1 3.72Å; V130-F161 HydrophobicContact CG2-CZ 3.99Å; E157-F161 WeakPolarHBondContact O-CB 3.34Å; E157-F161 PolarHBondContact O-N 3.26Å; C158-F161 PolarHBondContact O-N 2.9Å; V159-F161 VanDerWaalsContact C-N 3.32Å; V159-F161 PolarHBondContact O-N 3.11Å; F161-W164 HydrophobicContact CD2-CE3 4Å; F161-W164 HydrophobicContact CD2-CZ3 4.4Å; F161-W164 AromaticContact CE2-CE3 3.68Å; F161-W164 HydrophobicContact CE2-CE3 3.68Å; F161-W164 AromaticContact CE2-CZ3 3.65Å; F161-W164 HydrophobicContact CE2-CZ3 3.65Å; F161-W164 HydrophobicContact CZ-CE3 4.46Å; F161-W164 HydrophobicContact CZ-CZ3 4.32Å; F161-W164 WeakPolarHBondContact O-CB 3.45Å; F161-W164 PolarHBondContact O-N 3.2Å; F161-A165 WeakPolarHBondContact O-CB 3.36Å; F161-A165 PolarHBondContact O-N 2.96Å
162	L	98	Very high	96.9	Very high	8 Å²	8	54 Å²	54	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-70.4	-35.9	179.6	-72.1	166.2	0	0	0	112	L114 A118 L126 A146 R147 A150 C158 V159 W164 A165 D166	L114-L162 HydrophobicContact CD2-CD2 4.02Å; L114-L162 HydrophobicContact CG-CD2 4.33Å; A118-L162 HydrophobicContact CB-CD1 4.26Å; L126-L162 HydrophobicContact CD1-CD1 4.15Å; L126-L162 HydrophobicContact CD1-CG 4.39Å; L126-L162 HydrophobicContact CD2-CD2 4.46Å; A146-L162 HydrophobicContact CB-CD1 4.12Å; R147-L162 HydrophobicContact CB-CB 4.04Å; R147-L162 HydrophobicContact CB-CD1 4.27Å; R147-L162 HydrophobicContact CG-CB 4.29Å; A150-L162 HydrophobicContact CB-CD1 4.38Å; C158-L162 WeakPolarHBondContact O-CB 3.39Å; C158-L162 WeakPolarHBondContact O-CD1 3.31Å; C158-L162 WeakPolarHBondContact O-CG 3.32Å; C158-L162 PolarHBondContact O-N 3.08Å; V159-L162 PolarHBondContact O-N 3.42Å; L162-W164 VanDerWaalsContact C-N 3.3Å; L162-W164 PolarHBondContact O-N 3.06Å; L162-A165 PolarHBondContact O-N 3.07Å; L162-D166 WeakPolarHBondContact O-CB 3.45Å; L162-D166 PolarHBondContact O-N 3.14Å
163	D	97.7	Very high	96.8	Very high	49 Å²	49	54 Å²	54	26%	0.262	27%	0.271	S	S	.	.	H	α-helix	trans	-60.2	-42.3	170.1	-86	-34.7	0	0	0	111.6	R147 V159 A167 I219	R147-D163 IonicContact CZ-OD1 3.75Å; R147-D163 IonicContact CZ-OD2 3.74Å; R147-D163 VanDerWaalsContact NE-CG 3.32Å; R147-D163 IonicContact NE-OD1 2.67Å; R147-D163 PolarHBondContact NE-OD1 3.07Å; R147-D163 IonicContact NE-OD2 3.85Å; R147-D163 PolarHBondContact NE-OD2 2.92Å; R147-D163 IonicContact NH2-OD1 3.01Å; R147-D163 PolarHBondContact NH2-OD1 2.87Å; R147-D163 IonicContact NH2-OD2 3.6Å; R147-D163 PolarHBondContact NH2-OD2 3.42Å; V159-D163 WeakPolarHBondContact O-CB 3.37Å; V159-D163 PolarHBondContact O-N 2.99Å; D163-A167 WeakPolarHBondContact O-CB 3.31Å; D163-A167 PolarHBondContact O-N 3.45Å; D163-I219 HydrophobicContact CB-CD1 3.91Å
164	W	97.2	Very high	96.8	Very high	53 Å²	53	51.9 Å²	51.9	20%	0.201	26%	0.262	C	S	.	.	H	α-helix	trans	-63.7	-45.8	174	174.2	88.9	0	0	0	112.9	E160 F161 L162 D166 A167 R168 T215 A217 I219	E160-W164 WeakPolarHBondContact O-CB 3.2Å; E160-W164 PolarHBondContact O-N 3.4Å; F161-W164 HydrophobicContact CD2-CE3 4Å; F161-W164 HydrophobicContact CD2-CZ3 4.4Å; F161-W164 AromaticContact CE2-CE3 3.68Å; F161-W164 HydrophobicContact CE2-CE3 3.68Å; F161-W164 AromaticContact CE2-CZ3 3.65Å; F161-W164 HydrophobicContact CE2-CZ3 3.65Å; F161-W164 HydrophobicContact CZ-CE3 4.46Å; F161-W164 HydrophobicContact CZ-CZ3 4.32Å; F161-W164 WeakPolarHBondContact O-CB 3.45Å; F161-W164 PolarHBondContact O-N 3.2Å; L162-W164 VanDerWaalsContact C-N 3.3Å; L162-W164 PolarHBondContact O-N 3.06Å; W164-D166 VanDerWaalsContact C-N 3.34Å; W164-D166 PolarHBondContact O-N 3.4Å; W164-A167 PolarHBondContact O-N 3.37Å; W164-R168 HydrophobicContact CD2-CG 4.47Å; W164-R168 HydrophobicContact CZ2-CG 4.33Å; W164-R168 WeakPolarHBondContact O-CG 3.34Å; W164-R168 PolarHBondContact O-N 3.32Å; W164-R168 VanDerWaalsContact O-N 3.09Å; W164-T215 WeakPolarHBondContact CZ2-O 3.3Å; W164-A217 VanDerWaalsContact CD1-O 3.28Å; W164-A217 PolarHBondContact NE1-O 3.06Å; W164-I219 HydrophobicContact CB-CD1 4.31Å; W164-I219 HydrophobicContact CB-CG1 4.07Å
165	A	96.9	Very high	96.6	Very high	4 Å²	4	47.3 Å²	47.3	3%	0.033	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-39.9	178.4	0	0	0	0	0	111.8	V130 I136 F161 L162 R168 L169	V130-A165 HydrophobicContact CG1-CB 4.19Å; V130-A165 HydrophobicContact CG2-CB 4.43Å; I136-A165 HydrophobicContact CD1-CB 4.3Å; F161-A165 WeakPolarHBondContact O-CB 3.36Å; F161-A165 PolarHBondContact O-N 2.96Å; L162-A165 PolarHBondContact O-N 3.07Å; A165-R168 PolarHBondContact O-N 3.3Å; A165-L169 WeakPolarHBondContact O-CB 3.37Å; A165-L169 PolarHBondContact O-N 3.49Å
166	D	96.1	Very high	96.4	Very high	46 Å²	46	47 Å²	47	25%	0.246	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-42.8	176.5	-172.1	64.2	0	0	0	112.2	L162 W164 R168 L169 T170	L162-D166 WeakPolarHBondContact O-CB 3.45Å; L162-D166 PolarHBondContact O-N 3.14Å; W164-D166 VanDerWaalsContact C-N 3.34Å; W164-D166 PolarHBondContact O-N 3.4Å; D166-R168 VanDerWaalsContact C-N 3.31Å; D166-R168 PolarHBondContact O-N 2.65Å; D166-L169 PolarHBondContact O-N 2.93Å; D166-T170 VanDerWaalsContact O-CB 3.24Å; D166-T170 WeakPolarHBondContact O-CB 3.2Å; D166-T170 PolarHBondContact O-N 3.04Å; D166-T170 PolarHBondContact O-OG1 2.98Å
167	A	95.9	Very high	96.2	Very high	12 Å²	12	49.7 Å²	49.7	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-60.2	-41.4	174.5	0	0	0	0	0	111.8	D163 W164 T170 L171 I219 L222	D163-A167 WeakPolarHBondContact O-CB 3.31Å; D163-A167 PolarHBondContact O-N 3.45Å; W164-A167 PolarHBondContact O-N 3.37Å; A167-T170 PolarHBondContact O-N 3.3Å; A167-L171 PolarHBondContact O-N 2.95Å; A167-L171 VanDerWaalsContact O-N 3.12Å; A167-I219 HydrophobicContact CB-CG2 4.17Å; A167-L222 HydrophobicContact CB-CB 4.34Å; A167-L222 HydrophobicContact CB-CD1 4.07Å
168	R	95.4	Very high	95.9	Very high	45 Å²	45	43.6 Å²	43.6	17%	0.17	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-47.1	174.8	-71.1	-178.3	67.8	87.6	-0.4	112.5	W164 A165 D166 T170 L171 K172 L211 H214 L222	W164-R168 HydrophobicContact CD2-CG 4.47Å; W164-R168 HydrophobicContact CZ2-CG 4.33Å; W164-R168 WeakPolarHBondContact O-CG 3.34Å; W164-R168 PolarHBondContact O-N 3.32Å; W164-R168 VanDerWaalsContact O-N 3.09Å; A165-R168 PolarHBondContact O-N 3.3Å; D166-R168 VanDerWaalsContact C-N 3.31Å; D166-R168 PolarHBondContact O-N 2.65Å; R168-T170 VanDerWaalsContact C-N 3.29Å; R168-T170 PolarHBondContact O-N 2.85Å; R168-L171 PolarHBondContact O-N 3.45Å; R168-K172 PolarHBondContact O-N 3.47Å; R168-L211 PolarHBondContact NH2-O 3.05Å; R168-H214 PolarHBondContact NH1-O 2.99Å; R168-L222 HydrophobicContact CB-CD1 4.49Å; R168-L222 HydrophobicContact CG-CD1 3.35Å; R168-L222 HydrophobicContact CG-CD2 3.66Å; R168-L222 HydrophobicContact CG-CG 4.16Å
169	L	95.1	Very high	95.5	Very high	41 Å²	41	45.5 Å²	45.5	22%	0.215	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-43.8	177.7	177.9	62.1	0	0	0	110.7	I136 E137 A165 D166 L171 K172 K173	I136-L169 HydrophobicContact CD1-CB 3.71Å; I136-L169 HydrophobicContact CD1-CD2 3.46Å; I136-L169 VanDerWaalsContact CD1-CD2 3.46Å; I136-L169 HydrophobicContact CD1-CG 4.19Å; I136-L169 HydrophobicContact CG1-CD2 3.48Å; I136-L169 VanDerWaalsContact CG1-CD2 3.48Å; E137-L169 HydrophobicContact CG-CD2 4.04Å; A165-L169 WeakPolarHBondContact O-CB 3.37Å; A165-L169 PolarHBondContact O-N 3.49Å; D166-L169 PolarHBondContact O-N 2.93Å; L169-L171 VanDerWaalsContact C-N 3.35Å; L169-L171 PolarHBondContact O-N 3Å; L169-K172 PolarHBondContact O-N 3.19Å; L169-K173 HydrophobicContact CD1-CD 4.32Å; L169-K173 HydrophobicContact CD1-CG 4.11Å; L169-K173 HydrophobicContact CG-CD 4.07Å; L169-K173 HydrophobicContact CG-CG 4.29Å; L169-K173 WeakPolarHBondContact O-CB 3.33Å; L169-K173 WeakPolarHBondContact O-CG 3.45Å; L169-K173 PolarHBondContact O-N 3.03Å
170	T	95.3	Very high	95.1	Very high	36 Å²	36	49.2 Å²	49.2	22%	0.221	25%	0.246	C	C	.	.	H	α-helix	trans	-59	-44.5	178.8	-69.2	0	0	0	0	111.8	D166 A167 R168 Y174	D166-T170 VanDerWaalsContact O-CB 3.24Å; D166-T170 WeakPolarHBondContact O-CB 3.2Å; D166-T170 PolarHBondContact O-N 3.04Å; D166-T170 PolarHBondContact O-OG1 2.98Å; A167-T170 PolarHBondContact O-N 3.3Å; R168-T170 VanDerWaalsContact C-N 3.29Å; R168-T170 PolarHBondContact O-N 2.85Å; T170-Y174 WeakPolarHBondContact O-CB 3.19Å; T170-Y174 PolarHBondContact O-N 3.3Å
171	L	95	Very high	94.5	Very high	1 Å²	1	45 Å²	45	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-47.7	173.9	176.5	55.3	0	0	0	111.5	A167 R168 L169 K173 Y174 I175 L211 L222 Q225 R226	A167-L171 PolarHBondContact O-N 2.95Å; A167-L171 VanDerWaalsContact O-N 3.12Å; R168-L171 PolarHBondContact O-N 3.45Å; L169-L171 VanDerWaalsContact C-N 3.35Å; L169-L171 PolarHBondContact O-N 3Å; L171-K173 VanDerWaalsContact C-N 3.34Å; L171-K173 PolarHBondContact O-N 3.31Å; L171-Y174 PolarHBondContact O-N 3.2Å; L171-Y174 VanDerWaalsContact O-N 3.14Å; L171-I175 HydrophobicContact CD1-CD1 3.94Å; L171-I175 HydrophobicContact CD1-CG1 4.09Å; L171-I175 HydrophobicContact CG-CD1 3.95Å; L171-I175 VanDerWaalsContact O-CG1 3.31Å; L171-I175 WeakPolarHBondContact O-CG1 3.4Å; L171-I175 PolarHBondContact O-N 3.43Å; L171-L211 HydrophobicContact CD2-CD1 4.2Å; L171-L211 HydrophobicContact CD2-CD2 3.91Å; L171-L211 HydrophobicContact CD2-CG 4Å; L171-L211 HydrophobicContact CG-CD1 4.07Å; L171-L211 HydrophobicContact CG-CG 4.43Å; L171-L222 HydrophobicContact CD2-CD2 4.05Å; L171-Q225 HydrophobicContact CD2-CB 3.79Å; L171-R226 HydrophobicContact CD1-CB 3.92Å
172	K	94.9	Very high	93.8	Very high	111 Å²	111	43.9 Å²	43.9	48%	0.483	23%	0.228	S	C	.	.	H	α-helix	trans	-56.3	-45.8	177.5	-173.5	178.5	-179.7	-179.2	0	111.7	D133 R168 L169 I175 A176 L211	D133-K172 IonicContact OD1-NZ 3.99Å; R168-K172 PolarHBondContact O-N 3.47Å; L169-K172 PolarHBondContact O-N 3.19Å; K172-I175 PolarHBondContact O-N 2.99Å; K172-A176 WeakPolarHBondContact O-CB 3.45Å; K172-A176 PolarHBondContact O-N 3.42Å; K172-L211 HydrophobicContact CB-CD1 4.32Å
173	K	94.9	Very high	92.8	Very high	87 Å²	87	46.6 Å²	46.6	38%	0.378	25%	0.245	S	C	.	.	H	α-helix	trans	-63.7	-41.8	175.8	-76.4	-179	173.7	-171.6	0	112.5	E137 L169 L171 A176 K177	E137-K173 IonicContact OE1-NZ 2.52Å; E137-K173 PolarHBondContact OE1-NZ 3.44Å; E137-K173 IonicContact OE2-NZ 3.78Å; E137-K173 PolarHBondContact OE2-NZ 3.13Å; L169-K173 HydrophobicContact CD1-CD 4.32Å; L169-K173 HydrophobicContact CD1-CG 4.11Å; L169-K173 HydrophobicContact CG-CD 4.07Å; L169-K173 HydrophobicContact CG-CG 4.29Å; L169-K173 WeakPolarHBondContact O-CB 3.33Å; L169-K173 WeakPolarHBondContact O-CG 3.45Å; L169-K173 PolarHBondContact O-N 3.03Å; L171-K173 VanDerWaalsContact C-N 3.34Å; L171-K173 PolarHBondContact O-N 3.31Å; K173-A176 PolarHBondContact O-N 2.91Å; K173-K177 WeakPolarHBondContact O-CB 3.49Å; K173-K177 PolarHBondContact O-N 3.25Å
174	Y	95	Very high	91.6	Very high	34 Å²	34	48.3 Å²	48.3	13%	0.133	25%	0.254	C	S	.	.	H	α-helix	trans	-63.2	-44.8	177.9	-173.2	-109.7	0	0	0	111.2	T170 L171 A176 K177 V178 R226 L229 E230	T170-Y174 WeakPolarHBondContact O-CB 3.19Å; T170-Y174 PolarHBondContact O-N 3.3Å; L171-Y174 PolarHBondContact O-N 3.2Å; L171-Y174 VanDerWaalsContact O-N 3.14Å; Y174-A176 VanDerWaalsContact C-N 3.35Å; Y174-A176 PolarHBondContact O-N 3.42Å; Y174-K177 PolarHBondContact O-N 3.3Å; Y174-V178 HydrophobicContact CD1-CG2 4.36Å; Y174-V178 HydrophobicContact CE1-CG2 3.96Å; Y174-V178 HydrophobicContact CE2-CG2 4.18Å; Y174-V178 WeakPolarHBondContact O-CG2 3.35Å; Y174-V178 PolarHBondContact O-N 3.04Å; Y174-R226 HydrophobicContact CD1-CG 4.17Å; Y174-R226 HydrophobicContact CG-CG 4.45Å; Y174-L229 HydrophobicContact CD1-CB 4.43Å; Y174-L229 HydrophobicContact CD1-CD2 3.81Å; Y174-L229 HydrophobicContact CD1-CG 4.23Å; Y174-L229 HydrophobicContact CE1-CB 4.08Å; Y174-L229 HydrophobicContact CE1-CD2 3.96Å; Y174-L229 HydrophobicContact CE1-CG 3.87Å; Y174-E230 HydrophobicContact CE1-CB 4.11Å; Y174-E230 VanDerWaalsContact OH-CA 3.27Å; Y174-E230 WeakPolarHBondContact OH-CA 3.46Å; Y174-E230 WeakPolarHBondContact OH-CB 3.31Å; Y174-E230 WeakPolarHBondContact OH-CG 3.38Å
175	I	94.3	Very high	89.9	Confident	3 Å²	3	47.2 Å²	47.2	2%	0.015	25%	0.254	C	S	.	.	H	α-helix	trans	-58.1	-47.1	173.8	-63.9	161.8	0	0	0	110.8	L171 K172 V178 S179 C204 K207 N208 L211 L229	L171-I175 HydrophobicContact CD1-CD1 3.94Å; L171-I175 HydrophobicContact CD1-CG1 4.09Å; L171-I175 HydrophobicContact CG-CD1 3.95Å; L171-I175 VanDerWaalsContact O-CG1 3.31Å; L171-I175 WeakPolarHBondContact O-CG1 3.4Å; L171-I175 PolarHBondContact O-N 3.43Å; K172-I175 PolarHBondContact O-N 2.99Å; I175-V178 PolarHBondContact O-N 3.45Å; I175-S179 VanDerWaalsContact O-CB 3.31Å; I175-S179 WeakPolarHBondContact O-CB 3.4Å; I175-S179 PolarHBondContact O-N 3.5Å; I175-C204 HydrophobicContact CG2-CB 3.85Å; I175-K207 HydrophobicContact CD1-CB 3.55Å; I175-K207 HydrophobicContact CG1-CB 4.01Å; I175-N208 WeakPolarHBondContact CD1-OD1 3.36Å; I175-N208 WeakPolarHBondContact CG2-OD1 3.5Å; I175-L211 HydrophobicContact CD1-CD1 3.88Å; I175-L229 HydrophobicContact CB-CD2 4.39Å; I175-L229 HydrophobicContact CG1-CD2 3.62Å
176	A	94.3	Very high	88.1	Confident	58 Å²	58	54.2 Å²	54.2	48%	0.479	29%	0.286	S	S	.	.	H	α-helix	trans	-61.4	-45.1	178.5	0	0	0	0	0	112.4	K172 K173 Y174 S179 L180	K172-A176 WeakPolarHBondContact O-CB 3.45Å; K172-A176 PolarHBondContact O-N 3.42Å; K173-A176 PolarHBondContact O-N 2.91Å; Y174-A176 VanDerWaalsContact C-N 3.35Å; Y174-A176 PolarHBondContact O-N 3.42Å; A176-S179 PolarHBondContact O-N 2.97Å; A176-L180 WeakPolarHBondContact O-CB 3.42Å; A176-L180 PolarHBondContact O-N 3.28Å
177	K	93.2	Very high	86.2	Confident	148 Å²	148	61.1 Å²	61.1	64%	0.643	31%	0.313	S	S	*	.	H	α-helix	trans	-59.3	-47.6	176.7	178.6	-176	176.5	-179.1	0	111.6	K173 Y174 L180 A181	K173-K177 WeakPolarHBondContact O-CB 3.49Å; K173-K177 PolarHBondContact O-N 3.25Å; Y174-K177 PolarHBondContact O-N 3.3Å; K177-L180 PolarHBondContact O-N 3.24Å; K177-A181 WeakPolarHBondContact O-CB 3.4Å; K177-A181 PolarHBondContact O-N 3.41Å
178	V	91.5	Very high	84.1	Confident	4 Å²	4	62.5 Å²	62.5	2%	0.024	33%	0.329	C	S	.	.	H	α-helix	trans	-64.1	-45.2	179.2	170.7	0	0	0	0	110.8	Y174 I175 L180 A181 V182 I200 C204 V233	Y174-V178 HydrophobicContact CD1-CG2 4.36Å; Y174-V178 HydrophobicContact CE1-CG2 3.96Å; Y174-V178 HydrophobicContact CE2-CG2 4.18Å; Y174-V178 WeakPolarHBondContact O-CG2 3.35Å; Y174-V178 PolarHBondContact O-N 3.04Å; I175-V178 PolarHBondContact O-N 3.45Å; V178-L180 PolarHBondContact O-N 3.4Å; V178-A181 PolarHBondContact O-N 3.31Å; V178-V182 WeakPolarHBondContact O-CG2 3.35Å; V178-V182 PolarHBondContact O-N 2.84Å; V178-I200 HydrophobicContact CG1-CG2 3.32Å; V178-C204 VanDerWaalsContact CG1-SG 3.6Å; V178-V233 HydrophobicContact CG1-CB 4.48Å; V178-V233 HydrophobicContact CG1-CG1 3.82Å; V178-V233 HydrophobicContact CG1-CG2 3.78Å; V178-V233 HydrophobicContact CG2-CG1 4.01Å
179	S	90.6	Very high	81.8	Confident	43 Å²	43	66.7 Å²	66.7	30%	0.301	37%	0.365	S	S	.	.	H	α-helix	trans	-58.9	-46.4	177.4	-173	0	0	0	0	111.8	I175 A176 V182 T183	I175-S179 VanDerWaalsContact O-CB 3.31Å; I175-S179 WeakPolarHBondContact O-CB 3.4Å; I175-S179 PolarHBondContact O-N 3.5Å; A176-S179 PolarHBondContact O-N 2.97Å; S179-V182 PolarHBondContact O-N 2.86Å; S179-T183 PolarHBondContact O-N 2.88Å; S179-T183 PolarHBondContact O-OG1 2.68Å
180	L	88.8	Confident	80	Confident	98 Å²	98	67 Å²	67	51%	0.513	38%	0.379	S	S	.	.	H	α-helix	trans	-64.2	-43.4	178.3	-176.5	64.7	0	0	0	112.4	A176 K177 V178 V182 T183 D184	A176-L180 WeakPolarHBondContact O-CB 3.42Å; A176-L180 PolarHBondContact O-N 3.28Å; K177-L180 PolarHBondContact O-N 3.24Å; V178-L180 PolarHBondContact O-N 3.4Å; L180-V182 PolarHBondContact O-N 2.87Å; L180-T183 WeakPolarHBondContact CA-OG1 3.31Å; L180-T183 PolarHBondContact O-N 3.43Å; L180-T183 VanDerWaalsContact O-N 3.13Å; L180-T183 PolarHBondContact O-OG1 3.49Å; L180-D184 PolarHBondContact O-N 2.75Å
181	A	85.8	Confident	78.4	Confident	37 Å²	37	74.9 Å²	74.9	31%	0.306	41%	0.409	S	S	.	.	H	α-helix	trans	-58.9	-32	177.3	0	0	0	0	0	112.2	K177 V178 T185 F237	K177-A181 WeakPolarHBondContact O-CB 3.4Å; K177-A181 PolarHBondContact O-N 3.41Å; V178-A181 PolarHBondContact O-N 3.31Å; A181-T185 WeakPolarHBondContact O-CG2 3.11Å; A181-F237 HydrophobicContact CB-CE1 4.15Å; A181-F237 HydrophobicContact CB-CZ 3.78Å
182	V	83.3	Confident	77.1	Confident	3 Å²	3	75.4 Å²	75.4	2%	0.018	41%	0.412	C	S	.	.	H	α-helix	trans	-76.1	-38.2	176.3	174.7	0	0	0	0	112.2	V178 S179 L180 T185 L192 K197 I200 L201	V178-V182 WeakPolarHBondContact O-CG2 3.35Å; V178-V182 PolarHBondContact O-N 2.84Å; S179-V182 PolarHBondContact O-N 2.86Å; L180-V182 PolarHBondContact O-N 2.87Å; V182-T185 PolarHBondContact O-OG1 3.47Å; V182-L192 HydrophobicContact CG1-CD2 4.2Å; V182-L192 HydrophobicContact CG2-CD2 4.27Å; V182-K197 HydrophobicContact CG1-CB 4.25Å; V182-K197 HydrophobicContact CG1-CD 4.44Å; V182-K197 HydrophobicContact CG1-CG 3.99Å; V182-I200 HydrophobicContact CG2-CB 4.08Å; V182-I200 HydrophobicContact CG2-CD1 3.82Å; V182-I200 HydrophobicContact CG2-CG2 3.63Å; V182-L201 HydrophobicContact CG1-CD1 4.47Å; V182-L201 HydrophobicContact CG1-CD2 4.39Å; V182-L201 HydrophobicContact CG1-CG 4.27Å
183	T	77.7	Confident	76.1	Confident	65 Å²	65	74.6 Å²	74.6	40%	0.399	41%	0.413	S	S	.	.	H	α-helix	trans	-74.8	-34.8	-179.2	54.8	0	0	0	0	112.7	S179 L180 T185 E186	S179-T183 PolarHBondContact O-N 2.88Å; S179-T183 PolarHBondContact O-OG1 2.68Å; L180-T183 WeakPolarHBondContact CA-OG1 3.31Å; L180-T183 PolarHBondContact O-N 3.43Å; L180-T183 VanDerWaalsContact O-N 3.13Å; L180-T183 PolarHBondContact O-OG1 3.49Å; T183-T185 VanDerWaalsContact C-N 3.27Å; T183-T185 PolarHBondContact O-N 2.81Å; T183-E186 WeakPolarHBondContact O-CB 3.38Å; T183-E186 WeakPolarHBondContact O-CG 3.29Å; T183-E186 PolarHBondContact O-N 3.47Å; T183-E186 VanDerWaalsContact O-N 3.15Å
184	D	72.6	Confident	75.3	Confident	85 Å²	85	78.3 Å²	78.3	46%	0.455	43%	0.429	S	S	.	.	H	α-helix	trans	-67.5	-25.9	177.3	-80.9	-25.1	0	0	0	113.3	L180 E186 K187	L180-D184 PolarHBondContact O-N 2.75Å; D184-E186 PolarHBondContact O-N 2.75Å; D184-K187 PolarHBondContact O-N 3.47Å
185	T	61.9	Low	74.7	Confident	31 Å²	31	83.8 Å²	83.8	19%	0.19	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-10.9	173.7	67.8	0	0	0	0	113.5	A181 V182 T183 K187 K197	A181-T185 WeakPolarHBondContact O-CG2 3.11Å; V182-T185 PolarHBondContact O-OG1 3.47Å; T183-T185 VanDerWaalsContact C-N 3.27Å; T183-T185 PolarHBondContact O-N 2.81Å; T185-K187 VanDerWaalsContact C-N 3.28Å; T185-K197 PolarHBondContact OG1-NZ 2.99Å
186	E	57.6	Low	74.2	Confident	151 Å²	151	84.9 Å²	84.9	71%	0.706	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-21.4	171.9	-62.2	-164.7	152.8	0	0	113.2	T183 D184 K197	T183-E186 WeakPolarHBondContact O-CB 3.38Å; T183-E186 WeakPolarHBondContact O-CG 3.29Å; T183-E186 PolarHBondContact O-N 3.47Å; T183-E186 VanDerWaalsContact O-N 3.15Å; D184-E186 PolarHBondContact O-N 2.75Å; E186-K197 IonicContact OE1-NZ 2.77Å
187	K	56.6	Low	73.7	Confident	190 Å²	190	83.7 Å²	83.7	83%	0.826	45%	0.446	S	S	*	.	S	Bend	trans	-96.1	-10.7	179	-65.1	177.4	-177.6	168.1	0	113.7	D184 T185	D184-K187 PolarHBondContact O-N 3.47Å; T185-K187 VanDerWaalsContact C-N 3.28Å
188	G	53.3	Low	73.5	Confident	41 Å²	41	80.9 Å²	80.9	42%	0.423	44%	0.438	S	S	.	.	S	Bend	trans	-116.6	156.9	-175.7	0	0	0	0	0	114.7	G190	G188-G190 PolarHBondContact O-N 3.1Å
189	S	46.3	Very low	73.4	Confident	134 Å²	134	84 Å²	84	94%	0.937	46%	0.457	S	S	*	.	S	Bend	trans	-68.4	1.6	-171	-33.2	0	0	0	0	116.4
190	G	57	Low	73.4	Confident	48 Å²	48	82 Å²	82	50%	0.495	44%	0.442	S	S	.	.			trans	-101.5	85.8	-179.7	0	0	0	0	0	111.4	G188 L192	G188-G190 PolarHBondContact O-N 3.1Å; G190-L192 PolarHBondContact O-N 3.01Å
191	K	61.8	Low	73.4	Confident	200 Å²	200	79.3 Å²	79.3	87%	0.87	43%	0.429	S	S	*	.			trans	-71	100.7	-177.1	-69.5	-177.5	179.7	179.6	0	111.2
192	L	67	Low	73.8	Confident	12 Å²	12	81.2 Å²	81.2	6%	0.063	44%	0.44	C	S	.	.			trans	-57.4	135	161.9	-176.2	64.4	0	0	0	109	V182 G190 D196 K197 I200 I236 M240	V182-L192 HydrophobicContact CG1-CD2 4.2Å; V182-L192 HydrophobicContact CG2-CD2 4.27Å; G190-L192 PolarHBondContact O-N 3.01Å; L192-D196 HydrophobicContact CD1-CB 3.69Å; L192-D196 HydrophobicContact CG-CB 4.08Å; L192-K197 HydrophobicContact CB-CD 4.39Å; L192-K197 HydrophobicContact CB-CG 3.89Å; L192-K197 HydrophobicContact CD2-CB 4.24Å; L192-K197 HydrophobicContact CD2-CD 4.44Å; L192-K197 HydrophobicContact CD2-CG 3.34Å; L192-K197 HydrophobicContact CG-CG 3.55Å; L192-I200 HydrophobicContact CD2-CD1 4.15Å; L192-I236 HydrophobicContact CD1-CG2 3.71Å; L192-M240 HydrophobicContact CB-SD 4.07Å; L192-M240 HydrophobicContact CD1-CE 3.82Å; L192-M240 HydrophobicContact CD1-CG 4.15Å; L192-M240 HydrophobicContact CD1-SD 3.83Å; L192-M240 HydrophobicContact CD2-CE 4.45Å; L192-M240 HydrophobicContact CG-SD 4.4Å
193	L	74.2	Confident	74.3	Confident	94 Å²	94	82 Å²	82	49%	0.492	45%	0.446	S	S	.	.			trans	-58.2	140.1	177.3	-77.3	136.1	0	0	0	109.4	E195 D196 K197	L193-E195 PolarHBondContact O-N 2.89Å; L193-E195 VanDerWaalsContact O-N 3.15Å; L193-D196 HydrophobicContact CB-CB 4.2Å; L193-D196 WeakPolarHBondContact CD1-OD2 3.33Å; L193-D196 PolarHBondContact O-N 2.77Å; L193-D196 VanDerWaalsContact O-N 3.11Å; L193-K197 WeakPolarHBondContact O-CG 3.35Å; L193-K197 PolarHBondContact O-N 2.72Å
194	K	79.4	Confident	75.1	Confident	166 Å²	166	79 Å²	79	72%	0.722	43%	0.428	S	S	*	.	H	α-helix	trans	-56	-34.2	179.5	-171.6	177.7	179.6	-178.8	0	111.8	N198	K194-N198 WeakPolarHBondContact O-CB 3.4Å; K194-N198 PolarHBondContact O-N 3.43Å; K194-N198 PolarHBondContact O-ND2 2.92Å; K194-N198 PolarHBondContact O-OD1 3.28Å
195	E	81.8	Confident	76.1	Confident	149 Å²	149	83.6 Å²	83.6	70%	0.696	44%	0.439	S	S	*	.	H	α-helix	trans	-66.9	-50.3	176.2	-66.3	172	-171.3	0	0	111.8	L193 K197 N198 T199	L193-E195 PolarHBondContact O-N 2.89Å; L193-E195 VanDerWaalsContact O-N 3.15Å; E195-K197 VanDerWaalsContact C-N 3.31Å; E195-K197 PolarHBondContact O-N 3.49Å; E195-N198 PolarHBondContact O-N 3.13Å; E195-N198 VanDerWaalsContact O-N 3.14Å; E195-T199 PolarHBondContact O-N 3.5Å; E195-T199 PolarHBondContact O-OG1 2.9Å; E195-T199 VanDerWaalsContact O-OG1 3.07Å
196	D	84.6	Confident	77.7	Confident	26 Å²	26	84.5 Å²	84.5	14%	0.139	45%	0.45	C	S	.	.	H	α-helix	trans	-60.7	-39.2	177.1	-73.6	-27.9	0	0	0	111.9	L192 L193 T199 I200 I236	L192-D196 HydrophobicContact CD1-CB 3.69Å; L192-D196 HydrophobicContact CG-CB 4.08Å; L193-D196 HydrophobicContact CB-CB 4.2Å; L193-D196 WeakPolarHBondContact CD1-OD2 3.33Å; L193-D196 PolarHBondContact O-N 2.77Å; L193-D196 VanDerWaalsContact O-N 3.11Å; D196-T199 PolarHBondContact O-N 3.39Å; D196-I200 WeakPolarHBondContact O-CG1 3.49Å; D196-I200 PolarHBondContact O-N 3.22Å; D196-I200 VanDerWaalsContact O-N 3.08Å; D196-I236 HydrophobicContact CB-CG2 3.7Å
197	K	83.8	Confident	79.4	Confident	32 Å²	32	78.6 Å²	78.6	14%	0.139	42%	0.422	C	S	.	.	H	α-helix	trans	-57.6	-51.2	171.9	-73.8	-170.1	175.3	-154.7	0	111.7	V182 T185 E186 L192 L193 E195 T199 I200 L201	V182-K197 HydrophobicContact CG1-CB 4.25Å; V182-K197 HydrophobicContact CG1-CD 4.44Å; V182-K197 HydrophobicContact CG1-CG 3.99Å; T185-K197 PolarHBondContact OG1-NZ 2.99Å; E186-K197 IonicContact OE1-NZ 2.77Å; L192-K197 HydrophobicContact CB-CD 4.39Å; L192-K197 HydrophobicContact CB-CG 3.89Å; L192-K197 HydrophobicContact CD2-CB 4.24Å; L192-K197 HydrophobicContact CD2-CD 4.44Å; L192-K197 HydrophobicContact CD2-CG 3.34Å; L192-K197 HydrophobicContact CG-CG 3.55Å; L193-K197 WeakPolarHBondContact O-CG 3.35Å; L193-K197 PolarHBondContact O-N 2.72Å; E195-K197 VanDerWaalsContact C-N 3.31Å; E195-K197 PolarHBondContact O-N 3.49Å; K197-T199 VanDerWaalsContact C-N 3.29Å; K197-T199 PolarHBondContact O-N 3.27Å; K197-I200 PolarHBondContact O-N 2.96Å; K197-L201 WeakPolarHBondContact O-CG 3.49Å; K197-L201 PolarHBondContact O-N 3.28Å
198	N	87.5	Confident	81.2	Confident	90 Å²	90	72.5 Å²	72.5	48%	0.481	40%	0.398	S	S	.	.	H	α-helix	trans	-62.7	-39.1	-178.3	-72.7	-12.8	0	0	0	111.2	K194 E195 S202	K194-N198 WeakPolarHBondContact O-CB 3.4Å; K194-N198 PolarHBondContact O-N 3.43Å; K194-N198 PolarHBondContact O-ND2 2.92Å; K194-N198 PolarHBondContact O-OD1 3.28Å; E195-N198 PolarHBondContact O-N 3.13Å; E195-N198 VanDerWaalsContact O-N 3.14Å; N198-S202 WeakPolarHBondContact O-CB 3.07Å; N198-S202 PolarHBondContact O-N 3.31Å
199	T	89.6	Confident	83.2	Confident	69 Å²	69	76.5 Å²	76.5	42%	0.423	41%	0.406	S	S	.	.	H	α-helix	trans	-60.6	-49.7	175.4	-57.8	0	0	0	0	111.6	E195 D196 K197 S202 A203 T232 I236	E195-T199 PolarHBondContact O-N 3.5Å; E195-T199 PolarHBondContact O-OG1 2.9Å; E195-T199 VanDerWaalsContact O-OG1 3.07Å; D196-T199 PolarHBondContact O-N 3.39Å; K197-T199 VanDerWaalsContact C-N 3.29Å; K197-T199 PolarHBondContact O-N 3.27Å; T199-S202 PolarHBondContact O-N 2.98Å; T199-A203 WeakPolarHBondContact O-CB 3.15Å; T199-A203 PolarHBondContact O-N 3.15Å; T199-T232 HydrophobicContact CG2-CG2 4.26Å; T199-I236 HydrophobicContact CG2-CD1 4.28Å
200	I	90.3	Very high	85.6	Confident	0 Å²	0	72 Å²	72	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-62.5	-47.6	179.5	-66.1	169.3	0	0	0	111.1	V178 V182 L192 D196 K197 S202 A203 C204 V233 I236	V178-I200 HydrophobicContact CG1-CG2 3.32Å; V182-I200 HydrophobicContact CG2-CB 4.08Å; V182-I200 HydrophobicContact CG2-CD1 3.82Å; V182-I200 HydrophobicContact CG2-CG2 3.63Å; L192-I200 HydrophobicContact CD2-CD1 4.15Å; D196-I200 WeakPolarHBondContact O-CG1 3.49Å; D196-I200 PolarHBondContact O-N 3.22Å; D196-I200 VanDerWaalsContact O-N 3.08Å; K197-I200 PolarHBondContact O-N 2.96Å; I200-S202 VanDerWaalsContact C-N 3.32Å; I200-S202 PolarHBondContact O-N 2.86Å; I200-A203 PolarHBondContact O-N 3.23Å; I200-C204 PolarHBondContact O-N 2.9Å; I200-C204 PolarHBondContact O-SG 3.06Å; I200-V233 HydrophobicContact CG1-CG2 4.31Å; I200-V233 HydrophobicContact CG2-CG2 4.16Å; I200-I236 HydrophobicContact CD1-CB 4.15Å; I200-I236 HydrophobicContact CD1-CD1 4.25Å; I200-I236 HydrophobicContact CD1-CG2 3.62Å; I200-I236 HydrophobicContact CG1-CD1 3.81Å; I200-I236 HydrophobicContact CG1-CG2 4.36Å
201	L	90.4	Very high	87.3	Confident	43 Å²	43	70.4 Å²	70.4	23%	0.225	35%	0.349	C	S	.	.	H	α-helix	trans	-65.4	-37.3	-179.2	-68.7	175.5	0	0	0	111.7	V182 K197 C204 R205	V182-L201 HydrophobicContact CG1-CD1 4.47Å; V182-L201 HydrophobicContact CG1-CD2 4.39Å; V182-L201 HydrophobicContact CG1-CG 4.27Å; K197-L201 WeakPolarHBondContact O-CG 3.49Å; K197-L201 PolarHBondContact O-N 3.28Å; L201-C204 PolarHBondContact O-N 3.37Å; L201-R205 WeakPolarHBondContact O-CB 3.36Å; L201-R205 VanDerWaalsContact O-CG 3.28Å; L201-R205 WeakPolarHBondContact O-CG 3.48Å; L201-R205 PolarHBondContact O-N 2.92Å
202	S	92.9	Very high	88.7	Confident	76 Å²	76	68.1 Å²	68.1	53%	0.531	34%	0.341	S	S	.	.	H	α-helix	trans	-64.2	-42.8	174	-169.7	0	0	0	0	111.4	N198 T199 I200 R205 A206	N198-S202 WeakPolarHBondContact O-CB 3.07Å; N198-S202 PolarHBondContact O-N 3.31Å; T199-S202 PolarHBondContact O-N 2.98Å; I200-S202 VanDerWaalsContact C-N 3.32Å; I200-S202 PolarHBondContact O-N 2.86Å; S202-R205 PolarHBondContact O-N 2.99Å; S202-A206 WeakPolarHBondContact O-CB 3.5Å; S202-A206 PolarHBondContact O-N 3.45Å
203	A	93.8	Very high	90	Very high	19 Å²	19	71.9 Å²	71.9	16%	0.157	36%	0.364	C	S	.	.	H	α-helix	trans	-63.7	-44.8	176.2	0	0	0	0	0	111.5	T199 I200 R205 A206 K207 L229 T232	T199-A203 WeakPolarHBondContact O-CB 3.15Å; T199-A203 PolarHBondContact O-N 3.15Å; I200-A203 PolarHBondContact O-N 3.23Å; A203-R205 PolarHBondContact O-N 3.02Å; A203-A206 PolarHBondContact O-N 3.18Å; A203-K207 WeakPolarHBondContact O-CG 3.41Å; A203-K207 PolarHBondContact O-N 3.34Å; A203-L229 HydrophobicContact CB-CD1 3.72Å; A203-T232 HydrophobicContact CB-CG2 4.33Å
204	C	94.4	Very high	90.8	Very high	4 Å²	4	71.2 Å²	71.2	3%	0.027	36%	0.359	C	S	.	.	H	α-helix	trans	-59.3	-44.1	176.1	-68.7	0	0	0	0	112.1	I175 V178 I200 L201 K207 N208	I175-C204 HydrophobicContact CG2-CB 3.85Å; V178-C204 VanDerWaalsContact CG1-SG 3.6Å; I200-C204 PolarHBondContact O-N 2.9Å; I200-C204 PolarHBondContact O-SG 3.06Å; L201-C204 PolarHBondContact O-N 3.37Å; C204-K207 PolarHBondContact O-N 2.98Å; C204-N208 PolarHBondContact O-N 3.2Å
205	R	94.4	Very high	91.2	Very high	181 Å²	181	67.5 Å²	67.5	68%	0.683	35%	0.35	S	S	*	.	H	α-helix	trans	-61.6	-46.7	176	-74.3	174.6	-170.8	179.6	2.4	111.6	L201 S202 A203 K207 N208 E209	L201-R205 WeakPolarHBondContact O-CB 3.36Å; L201-R205 VanDerWaalsContact O-CG 3.28Å; L201-R205 WeakPolarHBondContact O-CG 3.48Å; L201-R205 PolarHBondContact O-N 2.92Å; S202-R205 PolarHBondContact O-N 2.99Å; A203-R205 PolarHBondContact O-N 3.02Å; R205-K207 VanDerWaalsContact C-N 3.31Å; R205-K207 PolarHBondContact O-N 3.34Å; R205-N208 PolarHBondContact O-N 2.94Å; R205-E209 WeakPolarHBondContact O-CB 3.28Å; R205-E209 PolarHBondContact O-N 3.33Å
206	A	94.9	Very high	91.6	Very high	50 Å²	50	69 Å²	69	41%	0.413	36%	0.357	S	S	.	.	H	α-helix	trans	-60.5	-39.8	178	0	0	0	0	0	112.1	S202 A203 W210	S202-A206 WeakPolarHBondContact O-CB 3.5Å; S202-A206 PolarHBondContact O-N 3.45Å; A203-A206 PolarHBondContact O-N 3.18Å; A206-W210 WeakPolarHBondContact O-CB 3.17Å; A206-W210 PolarHBondContact O-N 3.11Å
207	K	94.4	Very high	91.9	Very high	26 Å²	26	68.1 Å²	68.1	11%	0.113	35%	0.353	C	S	.	.	H	α-helix	trans	-69.6	-35.9	176.6	-61.8	-43.5	-174.2	-173.3	0	113	I175 A203 C204 R205 W210 L211 Q225 L229	I175-K207 HydrophobicContact CD1-CB 3.55Å; I175-K207 HydrophobicContact CG1-CB 4.01Å; A203-K207 WeakPolarHBondContact O-CG 3.41Å; A203-K207 PolarHBondContact O-N 3.34Å; C204-K207 PolarHBondContact O-N 2.98Å; R205-K207 VanDerWaalsContact C-N 3.31Å; R205-K207 PolarHBondContact O-N 3.34Å; K207-W210 PolarHBondContact O-N 3.48Å; K207-L211 PolarHBondContact O-N 2.86Å; K207-Q225 HydrophobicContact CD-CB 4.41Å; K207-Q225 WeakPolarHBondContact CE-O 3.49Å; K207-L229 HydrophobicContact CG-CB 4.2Å; K207-L229 HydrophobicContact CG-CD1 4.37Å; K207-L229 HydrophobicContact CG-CD2 4.21Å
208	N	93.9	Very high	92.5	Very high	63 Å²	63	69 Å²	69	34%	0.337	36%	0.363	S	S	.	.	H	α-helix	trans	-65.8	-46.7	173.1	-82.5	-22.9	0	0	0	111.8	I175 C204 R205 W210 L211 E212	I175-N208 WeakPolarHBondContact CD1-OD1 3.36Å; I175-N208 WeakPolarHBondContact CG2-OD1 3.5Å; C204-N208 PolarHBondContact O-N 3.2Å; R205-N208 PolarHBondContact O-N 2.94Å; N208-W210 PolarHBondContact O-N 2.97Å; N208-L211 WeakPolarHBondContact O-CB 3.2Å; N208-L211 PolarHBondContact O-N 3.36Å; N208-L211 VanDerWaalsContact O-N 3.1Å; N208-E212 WeakPolarHBondContact O-CG 3.29Å; N208-E212 PolarHBondContact O-N 2.92Å; N208-E212 VanDerWaalsContact O-N 3.1Å
209	E	95.2	Very high	92.8	Very high	125 Å²	125	67.6 Å²	67.6	58%	0.584	36%	0.355	S	S	*	.	H	α-helix	trans	-59.4	-38.5	175.5	-178	178.3	178.3	0	0	111.4	R205 E212 T213	R205-E209 WeakPolarHBondContact O-CB 3.28Å; R205-E209 PolarHBondContact O-N 3.33Å; E209-E212 PolarHBondContact O-N 3.48Å; E209-T213 WeakPolarHBondContact O-CG2 3.2Å; E209-T213 PolarHBondContact O-N 2.87Å; E209-T213 PolarHBondContact O-OG1 3.16Å
210	W	95.9	Very high	93.1	Very high	39 Å²	39	70.2 Å²	70.2	15%	0.148	37%	0.367	C	S	.	.	H	α-helix	trans	-63.6	-42.7	174.7	-171.8	91.8	0	0	0	112.2	A206 K207 N208 E212 T213 H214 A217 E221 L222 Q225	A206-W210 WeakPolarHBondContact O-CB 3.17Å; A206-W210 PolarHBondContact O-N 3.11Å; K207-W210 PolarHBondContact O-N 3.48Å; N208-W210 PolarHBondContact O-N 2.97Å; W210-E212 VanDerWaalsContact C-N 3.28Å; W210-E212 PolarHBondContact O-N 2.97Å; W210-T213 WeakPolarHBondContact CA-OG1 3.4Å; W210-T213 PolarHBondContact O-N 3.39Å; W210-T213 PolarHBondContact O-OG1 3.29Å; W210-H214 AromaticContact CD1-CE1 3.51Å; W210-H214 AromaticContact CD1-ND1 3.5Å; W210-H214 HydrophobicContact CD2-CB 4.21Å; W210-H214 AromaticContact CE2-CD2 3.94Å; W210-H214 AromaticContact CE2-CG 3.67Å; W210-H214 AromaticContact CE2-ND1 3.86Å; W210-H214 HydrophobicContact CE3-CB 4.39Å; W210-H214 AromaticContact CG-ND1 3.86Å; W210-H214 HydrophobicContact CH2-CB 4.28Å; W210-H214 HydrophobicContact CZ2-CB 4.04Å; W210-H214 HydrophobicContact CZ3-CB 4.41Å; W210-H214 AromaticContact NE1-CD2 3.67Å; W210-H214 AromaticContact NE1-CE1 3.45Å; W210-H214 PolarHBondContact NE1-CE1 2.94Å; W210-H214 AromaticContact NE1-CG 3.63Å; W210-H214 AromaticContact NE1-ND1 3.48Å; W210-H214 PolarHBondContact NE1-ND1 3.29Å; W210-H214 AromaticContact NE1-NE2 3.56Å; W210-H214 WeakPolarHBondContact O-CB 3.41Å; W210-H214 PolarHBondContact O-N 3.01Å; W210-H214 PolarHBondContact O-ND1 3.09Å; W210-A217 HydrophobicContact CH2-CB 3.31Å; W210-A217 HydrophobicContact CZ2-CB 4Å; W210-A217 HydrophobicContact CZ3-CB 3.93Å; W210-E221 HydrophobicContact CH2-CB 3.99Å; W210-E221 HydrophobicContact CZ2-CB 4.2Å; W210-L222 HydrophobicContact CH2-CD2 4.4Å; W210-L222 HydrophobicContact CZ3-CD2 3.79Å; W210-L222 HydrophobicContact CZ3-CG 4.49Å; W210-Q225 HydrophobicContact CD2-CG 3.76Å; W210-Q225 HydrophobicContact CE3-CG 3.7Å; W210-Q225 HydrophobicContact CH2-CG 3.66Å; W210-Q225 HydrophobicContact CZ2-CG 3.77Å; W210-Q225 HydrophobicContact CZ3-CB 4.49Å; W210-Q225 HydrophobicContact CZ3-CG 3.66Å
211	L	93.4	Very high	93.4	Very high	15 Å²	15	74.1 Å²	74.1	8%	0.079	39%	0.385	C	S	.	.	H	α-helix	trans	-60.6	-35.8	175.9	-85	172.9	0	0	0	113	R168 L171 K172 I175 K207 N208 L222	R168-L211 PolarHBondContact NH2-O 3.05Å; L171-L211 HydrophobicContact CD2-CD1 4.2Å; L171-L211 HydrophobicContact CD2-CD2 3.91Å; L171-L211 HydrophobicContact CD2-CG 4Å; L171-L211 HydrophobicContact CG-CD1 4.07Å; L171-L211 HydrophobicContact CG-CG 4.43Å; K172-L211 HydrophobicContact CB-CD1 4.32Å; I175-L211 HydrophobicContact CD1-CD1 3.88Å; K207-L211 PolarHBondContact O-N 2.86Å; N208-L211 WeakPolarHBondContact O-CB 3.2Å; N208-L211 PolarHBondContact O-N 3.36Å; N208-L211 VanDerWaalsContact O-N 3.1Å; L211-L222 HydrophobicContact CD2-CD2 3.71Å
212	E	91.4	Very high	93.6	Very high	152 Å²	152	72.2 Å²	72.2	71%	0.71	38%	0.375	S	S	*	.	H	α-helix	trans	-74.5	-35.6	178.5	-69.7	172.7	-173.5	0	0	112.4	N208 E209 W210	N208-E212 WeakPolarHBondContact O-CG 3.29Å; N208-E212 PolarHBondContact O-N 2.92Å; N208-E212 VanDerWaalsContact O-N 3.1Å; E209-E212 PolarHBondContact O-N 3.48Å; W210-E212 VanDerWaalsContact C-N 3.28Å; W210-E212 PolarHBondContact O-N 2.97Å
213	T	93.4	Very high	93.6	Very high	90 Å²	90	72.7 Å²	72.7	55%	0.552	37%	0.371	S	S	*	.	H	α-helix	trans	-86.2	-27.1	-177.8	49.3	0	0	0	0	113.6	E209 W210	E209-T213 WeakPolarHBondContact O-CG2 3.2Å; E209-T213 PolarHBondContact O-N 2.87Å; E209-T213 PolarHBondContact O-OG1 3.16Å; W210-T213 WeakPolarHBondContact CA-OG1 3.4Å; W210-T213 PolarHBondContact O-N 3.39Å; W210-T213 PolarHBondContact O-OG1 3.29Å
214	H	91.9	Very high	93.7	Very high	80 Å²	80	77 Å²	77	37%	0.37	39%	0.388	S	S	.	.			trans	-111.2	67.7	-178.6	-58.9	66.8	0	0	0	109.8	R168 W210 E216 A217	R168-H214 PolarHBondContact NH1-O 2.99Å; W210-H214 AromaticContact CD1-CE1 3.51Å; W210-H214 AromaticContact CD1-ND1 3.5Å; W210-H214 HydrophobicContact CD2-CB 4.21Å; W210-H214 AromaticContact CE2-CD2 3.94Å; W210-H214 AromaticContact CE2-CG 3.67Å; W210-H214 AromaticContact CE2-ND1 3.86Å; W210-H214 HydrophobicContact CE3-CB 4.39Å; W210-H214 AromaticContact CG-ND1 3.86Å; W210-H214 HydrophobicContact CH2-CB 4.28Å; W210-H214 HydrophobicContact CZ2-CB 4.04Å; W210-H214 HydrophobicContact CZ3-CB 4.41Å; W210-H214 AromaticContact NE1-CD2 3.67Å; W210-H214 AromaticContact NE1-CE1 3.45Å; W210-H214 PolarHBondContact NE1-CE1 2.94Å; W210-H214 AromaticContact NE1-CG 3.63Å; W210-H214 AromaticContact NE1-ND1 3.48Å; W210-H214 PolarHBondContact NE1-ND1 3.29Å; W210-H214 AromaticContact NE1-NE2 3.56Å; W210-H214 WeakPolarHBondContact O-CB 3.41Å; W210-H214 PolarHBondContact O-N 3.01Å; W210-H214 PolarHBondContact O-ND1 3.09Å; H214-E216 PolarHBondContact O-N 3.22Å; H214-A217 HydrophobicContact CB-CB 4.03Å; H214-A217 PolarHBondContact O-N 3.24Å
215	T	88.3	Confident	93.8	Very high	88 Å²	88	77.9 Å²	77.9	54%	0.54	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-13.9	-179.8	54.1	0	0	0	0	113.5	W164	W164-T215 WeakPolarHBondContact CZ2-O 3.3Å
216	E	88.4	Confident	93.8	Very high	182 Å²	182	73.4 Å²	73.4	85%	0.85	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	15.5	179.5	-61	-173.5	159.8	0	0	112.9	H214 S218	H214-E216 PolarHBondContact O-N 3.22Å; E216-S218 PolarHBondContact O-N 3.15Å
217	A	92.8	Very high	93.8	Very high	6 Å²	6	75.5 Å²	75.5	5%	0.05	38%	0.376	C	S	.	.			trans	-57.2	140.7	179.3	0	0	0	0	0	112.3	W164 W210 H214 E221 L222	W164-A217 VanDerWaalsContact CD1-O 3.28Å; W164-A217 PolarHBondContact NE1-O 3.06Å; W210-A217 HydrophobicContact CH2-CB 3.31Å; W210-A217 HydrophobicContact CZ2-CB 4Å; W210-A217 HydrophobicContact CZ3-CB 3.93Å; H214-A217 HydrophobicContact CB-CB 4.03Å; H214-A217 PolarHBondContact O-N 3.24Å; A217-E221 HydrophobicContact CB-CB 4.39Å; A217-L222 HydrophobicContact CB-CG 4.43Å
218	S	95.3	Very high	93.9	Very high	51 Å²	51	77.5 Å²	77.5	36%	0.357	39%	0.386	S	S	.	.			trans	-67	160.6	176.1	66.6	0	0	0	0	112.8	E216 N220 E221 L222	E216-S218 PolarHBondContact O-N 3.15Å; S218-N220 PolarHBondContact O-N 3.33Å; S218-E221 WeakPolarHBondContact CB-OE2 3.36Å; S218-E221 PolarHBondContact N-OE2 3.05Å; S218-E221 PolarHBondContact O-N 3.05Å; S218-E221 WeakPolarHBondContact OG-CG 3.45Å; S218-E221 PolarHBondContact OG-N 2.85Å; S218-E221 PolarHBondContact OG-OE2 3.46Å; S218-L222 WeakPolarHBondContact O-CG 3.41Å; S218-L222 PolarHBondContact O-N 3.45Å; S218-L222 VanDerWaalsContact O-N 3.08Å
219	I	94.5	Very high	93.9	Very high	60 Å²	60	74.5 Å²	74.5	31%	0.308	37%	0.37	S	S	.	.	H	α-helix	trans	-54.5	-41.6	174.3	-65.9	169.3	0	0	0	111	D163 W164 A167 E221 L222 L223	D163-I219 HydrophobicContact CB-CD1 3.91Å; W164-I219 HydrophobicContact CB-CD1 4.31Å; W164-I219 HydrophobicContact CB-CG1 4.07Å; A167-I219 HydrophobicContact CB-CG2 4.17Å; I219-E221 PolarHBondContact O-N 3.34Å; I219-L222 WeakPolarHBondContact O-CB 3.47Å; I219-L222 PolarHBondContact O-N 2.92Å; I219-L223 HydrophobicContact CG2-CD1 4.1Å; I219-L223 HydrophobicContact CG2-CG 4.39Å; I219-L223 WeakPolarHBondContact O-CG 3.42Å; I219-L223 PolarHBondContact O-N 2.87Å
220	N	95.3	Very high	93.8	Very high	124 Å²	124	71.4 Å²	71.4	66%	0.663	36%	0.355	S	S	*	.	H	α-helix	trans	-63.9	-42.9	-179.6	-69.7	-32	0	0	0	112.2	S218 L222 L223 E224	S218-N220 PolarHBondContact O-N 3.33Å; N220-L222 VanDerWaalsContact C-N 3.33Å; N220-L222 PolarHBondContact O-N 2.73Å; N220-L223 PolarHBondContact O-N 2.85Å; N220-E224 PolarHBondContact O-N 2.91Å
221	E	95.8	Very high	93.7	Very high	83 Å²	83	74.2 Å²	74.2	39%	0.388	37%	0.373	S	S	.	.	H	α-helix	trans	-64	-40	176.8	-70.7	164.1	130.9	0	0	111.1	W210 A217 S218 I219 E224 Q225	W210-E221 HydrophobicContact CH2-CB 3.99Å; W210-E221 HydrophobicContact CZ2-CB 4.2Å; A217-E221 HydrophobicContact CB-CB 4.39Å; S218-E221 WeakPolarHBondContact CB-OE2 3.36Å; S218-E221 PolarHBondContact N-OE2 3.05Å; S218-E221 PolarHBondContact O-N 3.05Å; S218-E221 WeakPolarHBondContact OG-CG 3.45Å; S218-E221 PolarHBondContact OG-N 2.85Å; S218-E221 PolarHBondContact OG-OE2 3.46Å; I219-E221 PolarHBondContact O-N 3.34Å; E221-E224 PolarHBondContact O-N 2.79Å; E221-Q225 VanDerWaalsContact O-CG 3.32Å; E221-Q225 WeakPolarHBondContact O-CG 3.48Å; E221-Q225 PolarHBondContact O-N 3.34Å
222	L	95.3	Very high	93.6	Very high	2 Å²	2	76.1 Å²	76.1	1%	0.01	39%	0.385	C	S	.	.	H	α-helix	trans	-61.7	-44	176	-70.8	160.9	0	0	0	112.3	A167 R168 L171 W210 L211 A217 S218 I219 N220 E224 Q225 R226	A167-L222 HydrophobicContact CB-CB 4.34Å; A167-L222 HydrophobicContact CB-CD1 4.07Å; R168-L222 HydrophobicContact CB-CD1 4.49Å; R168-L222 HydrophobicContact CG-CD1 3.35Å; R168-L222 HydrophobicContact CG-CD2 3.66Å; R168-L222 HydrophobicContact CG-CG 4.16Å; L171-L222 HydrophobicContact CD2-CD2 4.05Å; W210-L222 HydrophobicContact CH2-CD2 4.4Å; W210-L222 HydrophobicContact CZ3-CD2 3.79Å; W210-L222 HydrophobicContact CZ3-CG 4.49Å; L211-L222 HydrophobicContact CD2-CD2 3.71Å; A217-L222 HydrophobicContact CB-CG 4.43Å; S218-L222 WeakPolarHBondContact O-CG 3.41Å; S218-L222 PolarHBondContact O-N 3.45Å; S218-L222 VanDerWaalsContact O-N 3.08Å; I219-L222 WeakPolarHBondContact O-CB 3.47Å; I219-L222 PolarHBondContact O-N 2.92Å; N220-L222 VanDerWaalsContact C-N 3.33Å; N220-L222 PolarHBondContact O-N 2.73Å; L222-E224 VanDerWaalsContact C-N 3.33Å; L222-Q225 PolarHBondContact O-N 2.92Å; L222-R226 PolarHBondContact O-N 3.28Å
223	L	93.7	Very high	93.6	Very high	86 Å²	86	68.9 Å²	68.9	45%	0.45	35%	0.352	S	S	.	.	H	α-helix	trans	-63.8	-39.6	175.2	-68.4	176.3	0	0	0	111.4	I219 N220 R226 Q227	I219-L223 HydrophobicContact CG2-CD1 4.1Å; I219-L223 HydrophobicContact CG2-CG 4.39Å; I219-L223 WeakPolarHBondContact O-CG 3.42Å; I219-L223 PolarHBondContact O-N 2.87Å; N220-L223 PolarHBondContact O-N 2.85Å; L223-R226 WeakPolarHBondContact O-CB 3.45Å; L223-R226 PolarHBondContact O-N 2.8Å; L223-Q227 PolarHBondContact O-N 3.07Å
224	E	95.7	Very high	93.5	Very high	110 Å²	110	68 Å²	68	51%	0.514	35%	0.347	S	S	.	.	H	α-helix	trans	-64.4	-45.4	175.8	-164.3	-172.6	164.8	0	0	111.5	N220 E221 L222 R226 Q227 Q228	N220-E224 PolarHBondContact O-N 2.91Å; E221-E224 PolarHBondContact O-N 2.79Å; L222-E224 VanDerWaalsContact C-N 3.33Å; E224-R226 VanDerWaalsContact C-N 3.26Å; E224-R226 PolarHBondContact O-N 3.33Å; E224-Q227 PolarHBondContact O-N 3.2Å; E224-Q227 VanDerWaalsContact O-N 3.17Å; E224-Q228 HydrophobicContact CG-CG 4.49Å; E224-Q228 VanDerWaalsContact O-CG 3.28Å; E224-Q228 WeakPolarHBondContact O-CG 3.45Å; E224-Q228 PolarHBondContact O-N 3.02Å; E224-Q228 PolarHBondContact OE1-NE2 3.49Å; E224-Q228 VanDerWaalsContact OE1-NE2 3.08Å
225	Q	96.2	Very high	93.3	Very high	22 Å²	22	67.3 Å²	67.3	10%	0.103	35%	0.349	C	S	.	.	H	α-helix	trans	-60.2	-38.3	176.6	-68.4	-48	-56	0	0	112.1	L171 K207 W210 E221 L222 L229	L171-Q225 HydrophobicContact CD2-CB 3.79Å; K207-Q225 HydrophobicContact CD-CB 4.41Å; K207-Q225 WeakPolarHBondContact CE-O 3.49Å; W210-Q225 HydrophobicContact CD2-CG 3.76Å; W210-Q225 HydrophobicContact CE3-CG 3.7Å; W210-Q225 HydrophobicContact CH2-CG 3.66Å; W210-Q225 HydrophobicContact CZ2-CG 3.77Å; W210-Q225 HydrophobicContact CZ3-CB 4.49Å; W210-Q225 HydrophobicContact CZ3-CG 3.66Å; E221-Q225 VanDerWaalsContact O-CG 3.32Å; E221-Q225 WeakPolarHBondContact O-CG 3.48Å; E221-Q225 PolarHBondContact O-N 3.34Å; L222-Q225 PolarHBondContact O-N 2.92Å; Q225-L229 PolarHBondContact O-N 3.49Å
226	R	94.7	Very high	93.2	Very high	87 Å²	87	63.7 Å²	63.7	33%	0.328	33%	0.326	S	S	.	.	H	α-helix	trans	-62.6	-50.5	173.1	-179.5	-175.5	162	174.1	-3	111.2	L171 Y174 L222 L223 E224 Q228 L229 E230	L171-R226 HydrophobicContact CD1-CB 3.92Å; Y174-R226 HydrophobicContact CD1-CG 4.17Å; Y174-R226 HydrophobicContact CG-CG 4.45Å; L222-R226 PolarHBondContact O-N 3.28Å; L223-R226 WeakPolarHBondContact O-CB 3.45Å; L223-R226 PolarHBondContact O-N 2.8Å; E224-R226 VanDerWaalsContact C-N 3.26Å; E224-R226 PolarHBondContact O-N 3.33Å; R226-Q228 VanDerWaalsContact C-N 3.33Å; R226-Q228 PolarHBondContact O-N 3.43Å; R226-L229 PolarHBondContact O-N 3.33Å; R226-L229 VanDerWaalsContact O-N 3.16Å; R226-E230 PolarHBondContact O-N 3.26Å
227	Q	95.1	Very high	93	Very high	94 Å²	94	58 Å²	58	44%	0.439	30%	0.299	S	S	.	.	H	α-helix	trans	-60.1	-43.5	-179.6	-172.8	61.8	52.7	0	0	111.5	L223 E224 L229 E230 D231	L223-Q227 PolarHBondContact O-N 3.07Å; E224-Q227 PolarHBondContact O-N 3.2Å; E224-Q227 VanDerWaalsContact O-N 3.17Å; Q227-L229 VanDerWaalsContact C-N 3.29Å; Q227-L229 PolarHBondContact O-N 2.81Å; Q227-E230 CarbonylContact O-C 3.52Å; Q227-E230 WeakPolarHBondContact O-CA 3.25Å; Q227-E230 WeakPolarHBondContact O-CB 3.28Å; Q227-E230 PolarHBondContact O-N 2.97Å; Q227-E230 VanDerWaalsContact O-N 3.08Å; Q227-D231 PolarHBondContact NE2-OD1 3.43Å; Q227-D231 VanDerWaalsContact O-CG 3.24Å; Q227-D231 PolarHBondContact O-N 3.38Å
228	Q	95.2	Very high	92.6	Very high	68 Å²	68	60 Å²	60	32%	0.318	32%	0.315	S	S	.	.	H	α-helix	trans	-60.1	-38.4	176.8	-71	174.2	11.9	0	0	112.5	E224 R226 T232	E224-Q228 HydrophobicContact CG-CG 4.49Å; E224-Q228 VanDerWaalsContact O-CG 3.28Å; E224-Q228 WeakPolarHBondContact O-CG 3.45Å; E224-Q228 PolarHBondContact O-N 3.02Å; E224-Q228 PolarHBondContact OE1-NE2 3.49Å; E224-Q228 VanDerWaalsContact OE1-NE2 3.08Å; R226-Q228 VanDerWaalsContact C-N 3.33Å; R226-Q228 PolarHBondContact O-N 3.43Å; Q228-T232 PolarHBondContact O-N 2.98Å; Q228-T232 PolarHBondContact O-OG1 3.34Å
229	L	93.8	Very high	91.8	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-67.6	-43.2	174.2	-174.3	59.1	0	0	0	110.7	Y174 I175 A203 K207 Q225 R226 Q227 D231 T232 V233	Y174-L229 HydrophobicContact CD1-CB 4.43Å; Y174-L229 HydrophobicContact CD1-CD2 3.81Å; Y174-L229 HydrophobicContact CD1-CG 4.23Å; Y174-L229 HydrophobicContact CE1-CB 4.08Å; Y174-L229 HydrophobicContact CE1-CD2 3.96Å; Y174-L229 HydrophobicContact CE1-CG 3.87Å; I175-L229 HydrophobicContact CB-CD2 4.39Å; I175-L229 HydrophobicContact CG1-CD2 3.62Å; A203-L229 HydrophobicContact CB-CD1 3.72Å; K207-L229 HydrophobicContact CG-CB 4.2Å; K207-L229 HydrophobicContact CG-CD1 4.37Å; K207-L229 HydrophobicContact CG-CD2 4.21Å; Q225-L229 PolarHBondContact O-N 3.49Å; R226-L229 PolarHBondContact O-N 3.33Å; R226-L229 VanDerWaalsContact O-N 3.16Å; Q227-L229 VanDerWaalsContact C-N 3.29Å; Q227-L229 PolarHBondContact O-N 2.81Å; L229-D231 PolarHBondContact O-N 3.27Å; L229-T232 PolarHBondContact O-N 3.14Å; L229-V233 HydrophobicContact CD1-CG2 3.8Å; L229-V233 HydrophobicContact CG-CG2 4.15Å; L229-V233 WeakPolarHBondContact O-CB 3.42Å; L229-V233 WeakPolarHBondContact O-CG2 3.46Å; L229-V233 PolarHBondContact O-N 2.83Å
230	E	94.3	Very high	90.4	Very high	61 Å²	61	64.1 Å²	64.1	29%	0.285	33%	0.326	S	S	.	.	H	α-helix	trans	-61.1	-43.2	177.9	-175.4	162.4	-172.9	0	0	112.8	Y174 R226 Q227 T232 V233 T234	Y174-E230 HydrophobicContact CE1-CB 4.11Å; Y174-E230 VanDerWaalsContact OH-CA 3.27Å; Y174-E230 WeakPolarHBondContact OH-CA 3.46Å; Y174-E230 WeakPolarHBondContact OH-CB 3.31Å; Y174-E230 WeakPolarHBondContact OH-CG 3.38Å; R226-E230 PolarHBondContact O-N 3.26Å; Q227-E230 CarbonylContact O-C 3.52Å; Q227-E230 WeakPolarHBondContact O-CA 3.25Å; Q227-E230 WeakPolarHBondContact O-CB 3.28Å; Q227-E230 PolarHBondContact O-N 2.97Å; Q227-E230 VanDerWaalsContact O-N 3.08Å; E230-T232 VanDerWaalsContact C-N 3.28Å; E230-T232 PolarHBondContact O-N 3.17Å; E230-V233 PolarHBondContact O-N 3.45Å; E230-T234 WeakPolarHBondContact O-CB 3.4Å; E230-T234 PolarHBondContact O-N 3.05Å; E230-T234 PolarHBondContact O-OG1 3.46Å
231	D	93.9	Very high	88.9	Confident	97 Å²	97	63.9 Å²	63.9	52%	0.519	33%	0.329	S	S	.	.	H	α-helix	trans	-64.2	-34	177	-68.4	-18.4	0	0	0	112.3	Q227 L229 P235	Q227-D231 PolarHBondContact NE2-OD1 3.43Å; Q227-D231 VanDerWaalsContact O-CG 3.24Å; Q227-D231 PolarHBondContact O-N 3.38Å; L229-D231 PolarHBondContact O-N 3.27Å; D231-P235 WeakPolarHBondContact O-CD 3.34Å; D231-P235 VanDerWaalsContact O-CG 3.28Å; D231-P235 WeakPolarHBondContact O-CG 3.34Å
232	T	91.8	Very high	87.2	Confident	55 Å²	55	64.3 Å²	64.3	34%	0.337	34%	0.337	S	S	.	.	H	α-helix	trans	-72	-39.9	176.4	-57.7	0	0	0	0	111.1	T199 A203 Q228 L229 E230 I236	T199-T232 HydrophobicContact CG2-CG2 4.26Å; A203-T232 HydrophobicContact CB-CG2 4.33Å; Q228-T232 PolarHBondContact O-N 2.98Å; Q228-T232 PolarHBondContact O-OG1 3.34Å; L229-T232 PolarHBondContact O-N 3.14Å; E230-T232 VanDerWaalsContact C-N 3.28Å; E230-T232 PolarHBondContact O-N 3.17Å; T232-I236 WeakPolarHBondContact O-CD1 3.31Å; T232-I236 WeakPolarHBondContact O-CG1 3.35Å
233	V	90.9	Very high	85	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-89.6	-37.7	-165.7	169.5	0	0	0	0	112.3	V178 I200 L229 E230 I236 F237	V178-V233 HydrophobicContact CG1-CB 4.48Å; V178-V233 HydrophobicContact CG1-CG1 3.82Å; V178-V233 HydrophobicContact CG1-CG2 3.78Å; V178-V233 HydrophobicContact CG2-CG1 4.01Å; I200-V233 HydrophobicContact CG1-CG2 4.31Å; I200-V233 HydrophobicContact CG2-CG2 4.16Å; L229-V233 HydrophobicContact CD1-CG2 3.8Å; L229-V233 HydrophobicContact CG-CG2 4.15Å; L229-V233 WeakPolarHBondContact O-CB 3.42Å; L229-V233 WeakPolarHBondContact O-CG2 3.46Å; L229-V233 PolarHBondContact O-N 2.83Å; E230-V233 PolarHBondContact O-N 3.45Å; V233-I236 PolarHBondContact O-N 3.35Å; V233-F237 HydrophobicContact CB-CE2 4.49Å; V233-F237 HydrophobicContact CG1-CD2 3.21Å; V233-F237 HydrophobicContact CG1-CE2 3Å; V233-F237 HydrophobicContact CG1-CG 4.41Å; V233-F237 HydrophobicContact CG1-CZ 4.06Å; V233-F237 PolarHBondContact O-N 3.06Å
234	T	90.6	Very high	82.8	Confident	73 Å²	73	76.3 Å²	76.3	45%	0.448	39%	0.392	S	S	.	.	H	α-helix	trans	-55.5	-50.8	179.3	-61.4	0	0	0	0	114.5	E230 I236 F237 A238	E230-T234 WeakPolarHBondContact O-CB 3.4Å; E230-T234 PolarHBondContact O-N 3.05Å; E230-T234 PolarHBondContact O-OG1 3.46Å; T234-I236 PolarHBondContact O-N 3.31Å; T234-F237 PolarHBondContact O-N 3.31Å; T234-A238 WeakPolarHBondContact O-CB 3.46Å; T234-A238 PolarHBondContact O-N 3.01Å
235	P	89.1	Confident	80.3	Confident	64 Å²	64	79.9 Å²	79.9	42%	0.416	41%	0.409	S	S	.	.	H	α-helix	trans	-66	-29.6	179.9	26.2	-34.7	0	0	0	112.2	D231 K239	D231-P235 WeakPolarHBondContact O-CD 3.34Å; D231-P235 VanDerWaalsContact O-CG 3.28Å; D231-P235 WeakPolarHBondContact O-CG 3.34Å; P235-K239 WeakPolarHBondContact O-CG 3.47Å; P235-K239 PolarHBondContact O-N 2.96Å
236	I	85.8	Confident	77.5	Confident	12 Å²	12	85 Å²	85	6%	0.062	44%	0.442	C	S	.	.	H	α-helix	trans	-72.3	-42.5	176.2	-60.5	174.5	0	0	0	110.1	L192 D196 T199 I200 T232 V233 T234 K239	L192-I236 HydrophobicContact CD1-CG2 3.71Å; D196-I236 HydrophobicContact CB-CG2 3.7Å; T199-I236 HydrophobicContact CG2-CD1 4.28Å; I200-I236 HydrophobicContact CD1-CB 4.15Å; I200-I236 HydrophobicContact CD1-CD1 4.25Å; I200-I236 HydrophobicContact CD1-CG2 3.62Å; I200-I236 HydrophobicContact CG1-CD1 3.81Å; I200-I236 HydrophobicContact CG1-CG2 4.36Å; T232-I236 WeakPolarHBondContact O-CD1 3.31Å; T232-I236 WeakPolarHBondContact O-CG1 3.35Å; V233-I236 PolarHBondContact O-N 3.35Å; T234-I236 PolarHBondContact O-N 3.31Å; I236-K239 PolarHBondContact O-N 2.99Å
237	F	83.9	Confident	75	Confident	63 Å²	63	90.4 Å²	90.4	28%	0.276	47%	0.467	S	S	.	.	H	α-helix	trans	-63.9	-37.9	173	-78.3	-55.9	0	0	0	112.7	A181 V233 T234 K239 M240 T241	A181-F237 HydrophobicContact CB-CE1 4.15Å; A181-F237 HydrophobicContact CB-CZ 3.78Å; V233-F237 HydrophobicContact CB-CE2 4.49Å; V233-F237 HydrophobicContact CG1-CD2 3.21Å; V233-F237 HydrophobicContact CG1-CE2 3Å; V233-F237 HydrophobicContact CG1-CG 4.41Å; V233-F237 HydrophobicContact CG1-CZ 4.06Å; V233-F237 PolarHBondContact O-N 3.06Å; T234-F237 PolarHBondContact O-N 3.31Å; F237-K239 VanDerWaalsContact C-N 3.32Å; F237-K239 PolarHBondContact O-N 3.02Å; F237-M240 HydrophobicContact CB-CE 4.33Å; F237-M240 HydrophobicContact CD1-CE 3.04Å; F237-M240 HydrophobicContact CE1-CE 3.5Å; F237-M240 VanDerWaalsContact CE1-CE 3.5Å; F237-M240 HydrophobicContact CG-CE 4Å; F237-M240 WeakPolarHBondContact O-CB 3.45Å; F237-M240 PolarHBondContact O-N 2.76Å; F237-T241 PolarHBondContact O-N 2.67Å
238	A	84.3	Confident	72.2	Confident	47 Å²	47	91.4 Å²	91.4	39%	0.388	49%	0.485	S	S	.	.	H	α-helix	trans	-65	-31.9	177.5	0	0	0	0	0	113.6	T234 M240 T241 T242	T234-A238 WeakPolarHBondContact O-CB 3.46Å; T234-A238 PolarHBondContact O-N 3.01Å; A238-M240 PolarHBondContact O-N 2.75Å; A238-T241 PolarHBondContact O-N 2.65Å; A238-T241 PolarHBondContact O-OG1 2.85Å; A238-T242 PolarHBondContact O-N 2.71Å; A238-T242 PolarHBondContact O-OG1 3.13Å; A238-T242 VanDerWaalsContact O-OG1 3.09Å
239	K	77.7	Confident	69.9	Low	130 Å²	130	92.2 Å²	92.2	57%	0.565	50%	0.503	S	S	*	.	H	α-helix	trans	-64.5	-21.1	171.5	-70.9	170.4	-173.6	173.6	0	112.7	P235 I236 F237	P235-K239 WeakPolarHBondContact O-CG 3.47Å; P235-K239 PolarHBondContact O-N 2.96Å; I236-K239 PolarHBondContact O-N 2.99Å; F237-K239 VanDerWaalsContact C-N 3.32Å; F237-K239 PolarHBondContact O-N 3.02Å
240	M	66.3	Low	67.4	Low	69 Å²	69	101 Å²	101	34%	0.34	54%	0.541	S	S	.	.	H	α-helix	trans	-82.7	-30.3	176.4	-75.3	-173.1	-83.6	0	0	113.7	L192 F237 A238	L192-M240 HydrophobicContact CB-SD 4.07Å; L192-M240 HydrophobicContact CD1-CE 3.82Å; L192-M240 HydrophobicContact CD1-CG 4.15Å; L192-M240 HydrophobicContact CD1-SD 3.83Å; L192-M240 HydrophobicContact CD2-CE 4.45Å; L192-M240 HydrophobicContact CG-SD 4.4Å; F237-M240 HydrophobicContact CB-CE 4.33Å; F237-M240 HydrophobicContact CD1-CE 3.04Å; F237-M240 HydrophobicContact CE1-CE 3.5Å; F237-M240 VanDerWaalsContact CE1-CE 3.5Å; F237-M240 HydrophobicContact CG-CE 4Å; F237-M240 WeakPolarHBondContact O-CB 3.45Å; F237-M240 PolarHBondContact O-N 2.76Å; A238-M240 PolarHBondContact O-N 2.75Å
241	T	63.3	Low	64.5	Low	118 Å²	118	104.2 Å²	104.2	72%	0.724	57%	0.571	S	S	*	*	H	α-helix	trans	-87.3	-14.3	-178.6	38.7	0	0	0	0	113.7	F237 A238	F237-T241 PolarHBondContact O-N 2.67Å; A238-T241 PolarHBondContact O-N 2.65Å; A238-T241 PolarHBondContact O-OG1 2.85Å
242	T	58.7	Low	61.9	Low	92 Å²	92	106.6 Å²	106.6	56%	0.564	58%	0.581	S	S	*	*	S	Bend	trans	-89.2	120.3	175.7	44.9	0	0	0	0	110.9	A238 R244	A238-T242 PolarHBondContact O-N 2.71Å; A238-T242 PolarHBondContact O-OG1 3.13Å; A238-T242 VanDerWaalsContact O-OG1 3.09Å; T242-R244 PolarHBondContact O-N 2.88Å
243	P	50.1	Low	59.3	Low	119 Å²	119	109.8 Å²	109.8	77%	0.773	60%	0.601	S	S	*	*			trans	-60.9	124.4	174.3	-18.3	29.6	0	0	0	109.4	Q245	P243-Q245 PolarHBondContact O-N 2.87Å
244	R	47.1	Very low	56.7	Low	221 Å²	221	115.9 Å²	115.9	83%	0.834	64%	0.644	S	S	*	*			trans	-54.1	107.1	169.4	-99.8	-178.5	170.4	-172.3	-2.3	108.4	T242 V246	T242-R244 PolarHBondContact O-N 2.88Å; R244-V246 PolarHBondContact O-N 3.03Å
245	Q	42.8	Very low	54.3	Low	186 Å²	186	120.4 Å²	120.4	87%	0.869	66%	0.66	S	S	*	*			trans	-62.6	108.4	164	-76	-158.7	-2	0	0	107.6	P243 K247	P243-Q245 PolarHBondContact O-N 2.87Å; Q245-K247 PolarHBondContact O-N 3.32Å
246	V	37.5	Very low	51.9	Low	130 Å²	130	124 Å²	124	79%	0.788	68%	0.675	S	S	*	*			trans	-60.9	106.5	168.9	-177.6	0	0	0	0	106	R244 S248	R244-V246 PolarHBondContact O-N 3.03Å; V246-S248 VanDerWaalsContact C-N 3.27Å; V246-S248 PolarHBondContact O-N 3.44Å
247	K	41.9	Very low	49.8	Very low	199 Å²	199	132.9 Å²	132.9	87%	0.865	72%	0.717	S	S	*	*			trans	-62.6	95.5	166.7	-72.4	-174.7	179	-179.2	0	107.1	Q245 A249	Q245-K247 PolarHBondContact O-N 3.32Å; K247-A249 PolarHBondContact O-N 3.14Å
248	S	37.6	Very low	47.9	Very low	115 Å²	115	139.3 Å²	139.3	80%	0.804	74%	0.744	S	S	*	*			trans	-71	84.8	166.7	-169.7	0	0	0	0	107.8	V246	V246-S248 VanDerWaalsContact C-N 3.27Å; V246-S248 PolarHBondContact O-N 3.44Å
249	A	46.1	Very low	45.8	Very low	85 Å²	85	148 Å²	148	70%	0.702	77%	0.767	S	S	*	*			trans	-87.9	99.4	163.7	0	0	0	0	0	107.6	K247	K247-A249 PolarHBondContact O-N 3.14Å
250	K	41.2	Very low	44	Very low	185 Å²	185	147.5 Å²	147.5	80%	0.804	78%	0.78	S	S	*	*			trans	177.1	103.5	146.2	-96.9	161.7	-172	-174.8	0	110.1
251	S	33.7	Very low	43	Very low	129 Å²	129	151.9 Å²	151.9	90%	0.902	80%	0.8	S	S	*	*			trans	-152.9	89.7	134.4	-90.8	0	0	0	0	107.2
252	I	39.2	Very low	42.2	Very low	146 Å²	146	153.4 Å²	153.4	75%	0.749	80%	0.803	S	S	*	*			trans	-76.5	119.6	169.9	-77.6	167.3	0	0	0	107
253	T	37.8	Very low	41.5	Very low	123 Å²	123	155.8 Å²	155.8	76%	0.755	81%	0.812	S	S	*	*			trans	45.1	114.9	147.6	63.8	0	0	0	0	120
254	S	35	Very low	41.5	Very low	128 Å²	128	156.9 Å²	156.9	90%	0.895	82%	0.817	S	S	*	*			trans	-115.4	97.4	139.3	59.4	0	0	0	0	108.3
255	H	40.2	Very low	41.7	Very low	168 Å²	168	151 Å²	151	78%	0.778	81%	0.81	S	S	*	*			trans	-86.5	158.8	165.6	-150.1	47.5	0	0	0	109
256	D	39.2	Very low	41.6	Very low	139 Å²	139	154.7 Å²	154.7	74%	0.743	83%	0.827	S	S	*	*			trans	79.7	88.5	167.4	-73.2	-60.1	0	0	0	119
257	Q	41.6	Very low	41.8	Very low	199 Å²	199	155.9 Å²	155.9	93%	0.93	83%	0.828	S	S	*	*			trans	-117.1	106.9	145.3	-136.4	160.6	1.4	0	0	109.9
258	K	45.3	Very low	41.8	Very low	198 Å²	198	153.6 Å²	153.6	86%	0.861	83%	0.827	S	S	*	*			trans	-35.2	123	173.8	-105.5	165.8	169.3	175.3	0	115.1
259	R	40.3	Very low	42.1	Very low	229 Å²	229	155.8 Å²	155.8	86%	0.864	83%	0.828	S	S	*	*				8.4	112.8	126.5	-159.5	173.2	-165.6	-127	1	115.6
260	S	39.2	Very low	41.8	Very low	119 Å²	119	159.9 Å²	159.9	83%	0.832	84%	0.835	S	S	*	*			trans	-127.5	94.7	158.8	-177.6	0	0	0	0	108.7
261	Q	45.4	Very low	41.9	Very low	162 Å²	162	158.4 Å²	158.4	76%	0.757	84%	0.837	S	S	*	*			trans	-128.2	118.1	152.5	-85	-172.5	-30	0	0	105.2
262	D	45.5	Very low	42.4	Very low	150 Å²	150	160.3 Å²	160.3	80%	0.802	83%	0.833	S	S	*	*			trans	-177.7	105.8	137.3	-83.2	-17.1	0	0	0	105.4
263	D	45.4	Very low	42.7	Very low	141 Å²	141	161.4 Å²	161.4	75%	0.754	84%	0.839	S	S	*	*				88.6	105.2	77.3	-158.7	13.8	0	0	0	111.3
264	T	50.2	Low	43	Very low	143 Å²	143	164.3 Å²	164.3	88%	0.877	85%	0.845	S	S	*	*			trans	-159.4	133.6	149	-20.7	0	0	0	0	112.4
265	S	50.3	Low	43.7	Very low	96 Å²	96	167.3 Å²	167.3	67%	0.671	84%	0.841	S	S	*	*			trans	-72.8	144.2	-174.3	-34.1	0	0	0	0	114.8
266	H	41.8	Very low	44	Very low	264 Å²	264	167.3 Å²	167.3	100%	1.222	85%	0.847	S	S	*	*				173.4	0	123.5	-101.5	30.4	0	0	0	110.6

Retrieved 266 of 266 residues in 799.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).