A0A096MG09_POEFO Loading...

RGS domain-containing protein

AlphaFold DB , UniProt , Accession A0A096MG09, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 182 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.9	Very low	34.6	Very low	224 Å²	224	163 Å²	163	100%	1.103	85%	0.848	S	S	*	*				0	124.1	0	-88.3	-156.4	-84.8	0	0	108.5
2	Y	26.1	Very low	35	Very low	227 Å²	227	160.5 Å²	160.5	89%	0.89	84%	0.844	S	S	*	*			trans	34.5	135.2	151.2	-59	-85.5	0	0	0	119.7
3	G	31.9	Very low	35	Very low	73 Å²	73	161.5 Å²	161.5	75%	0.753	84%	0.837	S	S	*	*			cis	178.7	-154.6	25.9	0	0	0	0	0	114.3
4	F	34.1	Very low	35.4	Very low	201 Å²	201	160.1 Å²	160.1	88%	0.882	83%	0.831	S	S	*	*			trans	-106.5	159.3	-136.9	-126.4	-108	0	0	0	114.2
5	L	33	Very low	35.5	Very low	129 Å²	129	159.3 Å²	159.3	68%	0.675	84%	0.837	S	S	*	*			trans	82.5	115.5	141.5	-143.5	76.7	0	0	0	120.7
6	K	35.1	Very low	36	Very low	192 Å²	192	160.4 Å²	160.4	84%	0.835	84%	0.839	S	S	*	*				-178	143.4	94.5	-94.8	-176.2	-176.6	176.4	0	113.1
7	K	38.8	Very low	36.1	Very low	202 Å²	202	161.4 Å²	161.4	88%	0.878	84%	0.835	S	S	*	*			trans	-66.4	151.6	178.9	-63.2	173.8	175	179.4	0	112.2
8	S	32.1	Very low	36.6	Very low	123 Å²	123	160.5 Å²	160.5	86%	0.86	83%	0.83	S	S	*	*			trans	-133.8	139.7	152.8	-169.3	0	0	0	0	111.2
9	K	40.7	Very low	36.8	Very low	193 Å²	193	159.7 Å²	159.7	84%	0.839	82%	0.822	S	S	*	*			trans	-102.1	138.8	-176.1	-72.9	174.7	171.4	179.2	0	109.4
10	T	31.1	Very low	37.3	Very low	134 Å²	134	159.4 Å²	159.4	82%	0.822	82%	0.817	S	S	*	*			trans	-169.2	99.3	151.4	21.6	0	0	0	0	106.2
11	A	42.3	Very low	37.4	Very low	95 Å²	95	157 Å²	157	79%	0.785	81%	0.81	S	S	*	*				73.4	94.2	81.4	0	0	0	0	0	113.9
12	V	39.4	Very low	37.8	Very low	133 Å²	133	154.9 Å²	154.9	81%	0.806	79%	0.791	S	S	*	*			trans	-150.1	88.5	153.4	-148.4	0	0	0	0	105.6
13	K	34.6	Very low	38.6	Very low	174 Å²	174	152.1 Å²	152.1	76%	0.757	79%	0.786	S	S	*	*				89.2	117.2	94.9	-79.5	-178.3	-178.4	-175.8	0	113.4
14	D	40.5	Very low	39.1	Very low	141 Å²	141	154.3 Å²	154.3	75%	0.754	79%	0.785	S	S	*	*			trans	71.1	70.4	140.5	-50	-23.1	0	0	0	118.2	M16	D14-M16 PolarHBondContact O-N 2.91Å
15	T	36.8	Very low	39.8	Very low	149 Å²	149	148.7 Å²	148.7	91%	0.914	76%	0.764	S	S	*	*			trans	-84.5	89.6	147.1	0.7	0	0	0	0	108.3	K17	T15-K17 PolarHBondContact O-N 3.46Å
16	M	43.3	Very low	40.6	Very low	177 Å²	177	147.8 Å²	147.8	87%	0.872	77%	0.766	S	S	*	*			trans	-56.1	119.5	162.7	-106.3	173.5	152	0	0	108.4	D14 I18	D14-M16 PolarHBondContact O-N 2.91Å; M16-I18 PolarHBondContact O-N 3.01Å; M16-I18 VanDerWaalsContact O-N 3.12Å
17	K	37.8	Very low	41.4	Very low	176 Å²	176	146.2 Å²	146.2	77%	0.765	76%	0.755	S	S	*	*			trans	-55.5	110.5	163.4	-89.9	174.9	168.6	-177.9	0	108.4	T15 Q19	T15-K17 PolarHBondContact O-N 3.46Å; K17-Q19 VanDerWaalsContact C-N 3.27Å; K17-Q19 PolarHBondContact O-N 3.03Å; K17-Q19 VanDerWaalsContact O-N 3.14Å
18	I	45.4	Very low	42.3	Very low	146 Å²	146	137.1 Å²	137.1	75%	0.749	72%	0.718	S	S	*	*			trans	-77.6	92.1	154.5	-59.5	174.8	0	0	0	105	M16 E20	M16-I18 PolarHBondContact O-N 3.01Å; M16-I18 VanDerWaalsContact O-N 3.12Å; I18-E20 VanDerWaalsContact C-N 3.31Å; I18-E20 HydrophobicContact CG2-CG 3.98Å; I18-E20 PolarHBondContact O-N 3.42Å
19	Q	41	Very low	44.1	Very low	146 Å²	146	134.9 Å²	134.9	68%	0.682	70%	0.697	S	S	*	*			trans	-77.8	94.2	156.6	-77.2	-178.5	-83	0	0	105.8	K17 T21	K17-Q19 VanDerWaalsContact C-N 3.27Å; K17-Q19 PolarHBondContact O-N 3.03Å; K17-Q19 VanDerWaalsContact O-N 3.14Å; Q19-T21 PolarHBondContact O-N 3.45Å
20	E	45.7	Very low	46.4	Very low	153 Å²	153	127.6 Å²	127.6	72%	0.715	67%	0.67	S	S	*	*			trans	-66.1	88	164.5	-103.6	170.9	-172.7	0	0	108	I18 Y22	I18-E20 VanDerWaalsContact C-N 3.31Å; I18-E20 HydrophobicContact CG2-CG 3.98Å; I18-E20 PolarHBondContact O-N 3.42Å; E20-Y22 VanDerWaalsContact C-N 3.32Å; E20-Y22 HydrophobicContact CB-CD1 4.22Å; E20-Y22 HydrophobicContact CB-CE1 4.37Å; E20-Y22 PolarHBondContact O-N 2.91Å
21	T	38.7	Very low	49.5	Very low	110 Å²	110	121.2 Å²	121.2	68%	0.675	63%	0.631	S	S	*	*			trans	-85.1	83.8	158.9	52.4	0	0	0	0	107.1	Q19 E23	Q19-T21 PolarHBondContact O-N 3.45Å; T21-E23 PolarHBondContact O-N 3.38Å
22	Y	45.5	Very low	51.9	Low	178 Å²	178	123.2 Å²	123.2	70%	0.698	62%	0.624	S	S	*	*			trans	-71.4	87.9	152.8	43.9	-91.3	0	0	0	106.1	E20 T24	E20-Y22 VanDerWaalsContact C-N 3.32Å; E20-Y22 HydrophobicContact CB-CD1 4.22Å; E20-Y22 HydrophobicContact CB-CE1 4.37Å; E20-Y22 PolarHBondContact O-N 2.91Å; Y22-T24 VanDerWaalsContact C-N 3.29Å; Y22-T24 HydrophobicContact CD2-CG2 4.25Å; Y22-T24 PolarHBondContact O-N 3.48Å
23	E	41.9	Very low	54.4	Low	169 Å²	169	119.2 Å²	119.2	79%	0.79	60%	0.6	S	S	*	*			trans	-59.6	102	162.6	-72	-174.5	169.4	0	0	106.3	T21 N25	T21-E23 PolarHBondContact O-N 3.38Å; E23-N25 VanDerWaalsContact C-N 3.33Å; E23-N25 PolarHBondContact O-N 3.19Å
24	T	43.9	Very low	57.2	Low	120 Å²	120	111 Å²	111	74%	0.736	56%	0.564	S	S	*	*			trans	-67.1	95.9	176.5	32.6	0	0	0	0	108.1	Y22 P26	Y22-T24 VanDerWaalsContact C-N 3.29Å; Y22-T24 HydrophobicContact CD2-CG2 4.25Å; Y22-T24 PolarHBondContact O-N 3.48Å; T24-P26 VanDerWaalsContact O-CD 3.24Å; T24-P26 WeakPolarHBondContact O-CD 3.41Å
25	N	48.8	Very low	59.8	Low	83 Å²	83	104.5 Å²	104.5	44%	0.444	53%	0.529	S	S	.	.			trans	-67.4	119.8	167.1	-162.5	14.6	0	0	0	107.3	E23 W27 D29	E23-N25 VanDerWaalsContact C-N 3.33Å; E23-N25 PolarHBondContact O-N 3.19Å; N25-W27 PolarHBondContact O-N 3.38Å; N25-D29 WeakPolarHBondContact CB-OD2 3.48Å
26	P	49.5	Very low	62.5	Low	110 Å²	110	100.8 Å²	100.8	71%	0.714	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	17.6	-178.9	19.1	-23.9	0	0	0	114.6	T24	T24-P26 VanDerWaalsContact O-CD 3.24Å; T24-P26 WeakPolarHBondContact O-CD 3.41Å
27	W	50.5	Low	64.9	Low	159 Å²	159	95.6 Å²	95.6	60%	0.602	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121	-0.6	-163	-57	85.3	0	0	0	115.5	N25	N25-W27 PolarHBondContact O-N 3.38Å
28	G	58.9	Low	67.6	Low	10 Å²	10	95.6 Å²	95.6	10%	0.103	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	134	45.9	164.7	0	0	0	0	0	116.9	Y142	G28-Y142 PolarHBondContact O-OH 3.48Å
29	D	69.7	Low	69.9	Low	76 Å²	76	91.5 Å²	91.5	41%	0.406	47%	0.467	S	S	.	.			trans	-96.3	12.7	-176.9	-68.4	-12.7	0	0	0	114.3	N25 F133 Y142	N25-D29 WeakPolarHBondContact CB-OD2 3.48Å; D29-F133 VanDerWaalsContact O-CE1 3.26Å; D29-F133 WeakPolarHBondContact O-CE1 3.39Å; D29-Y142 PolarHBondContact OD1-OH 3.21Å
30	S	89.7	Confident	72.5	Confident	40 Å²	40	84.5 Å²	84.5	28%	0.28	44%	0.435	S	S	.	.	S	Bend	trans	-99.2	141.3	176	72.6	0	0	0	0	111.8	E32 T33 V34	S30-E32 PolarHBondContact O-N 2.97Å; S30-T33 WeakPolarHBondContact O-CB 3.19Å; S30-T33 PolarHBondContact O-N 3.48Å; S30-T33 PolarHBondContact OG-N 3.32Å; S30-T33 VanDerWaalsContact OG-N 3.12Å; S30-T33 PolarHBondContact OG-OG1 3.43Å; S30-V34 PolarHBondContact O-N 3.41Å
31	L	94.6	Very high	74.9	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-53.5	-38.1	169.2	177.3	59.2	0	0	0	110.2	T33 V34 L35 F44 F125 M128 E129 F133	L31-T33 VanDerWaalsContact C-N 3.31Å; L31-T33 PolarHBondContact O-N 3.11Å; L31-V34 WeakPolarHBondContact O-CB 3.3Å; L31-V34 PolarHBondContact O-N 3.05Å; L31-V34 VanDerWaalsContact O-N 3.14Å; L31-L35 HydrophobicContact CD1-CD1 3.98Å; L31-L35 HydrophobicContact CD1-CD2 4.07Å; L31-L35 HydrophobicContact CD1-CG 3.79Å; L31-L35 HydrophobicContact CD2-CD1 4.28Å; L31-L35 HydrophobicContact CG-CD1 3.8Å; L31-L35 HydrophobicContact CG-CG 4.01Å; L31-L35 VanDerWaalsContact O-CG 3.29Å; L31-L35 WeakPolarHBondContact O-CG 3.32Å; L31-L35 PolarHBondContact O-N 2.86Å; L31-F44 HydrophobicContact CD1-CD1 3.97Å; L31-F44 HydrophobicContact CD1-CE1 3.55Å; L31-F44 HydrophobicContact CD1-CZ 3.89Å; L31-F125 HydrophobicContact CB-CE2 4.22Å; L31-F125 HydrophobicContact CB-CZ 3.98Å; L31-F125 HydrophobicContact CD2-CD2 4.01Å; L31-F125 HydrophobicContact CD2-CE2 3.76Å; L31-F125 HydrophobicContact CD2-CZ 4.05Å; L31-F125 HydrophobicContact CG-CE2 3.84Å; L31-F125 HydrophobicContact CG-CZ 4.1Å; L31-M128 HydrophobicContact CD2-CB 3.75Å; L31-E129 HydrophobicContact CD2-CB 3.98Å; L31-F133 HydrophobicContact CB-CD1 4.13Å; L31-F133 HydrophobicContact CB-CD2 4.11Å; L31-F133 HydrophobicContact CB-CE1 4.34Å; L31-F133 HydrophobicContact CB-CE2 4.33Å; L31-F133 HydrophobicContact CB-CG 4.01Å; L31-F133 HydrophobicContact CB-CZ 4.44Å; L31-F133 HydrophobicContact CD1-CB 4.42Å; L31-F133 HydrophobicContact CD1-CD2 3.71Å; L31-F133 HydrophobicContact CD1-CE2 4.27Å; L31-F133 HydrophobicContact CD1-CG 4.16Å; L31-F133 HydrophobicContact CG-CD2 4.48Å
32	E	93.8	Very high	77.7	Confident	137 Å²	137	79.3 Å²	79.3	64%	0.64	41%	0.406	S	S	*	.	H	α-helix	trans	-56.8	-40.7	175.9	-170.4	171.7	-156.2	0	0	113.2	S30 V34 L35 S36 F125	S30-E32 PolarHBondContact O-N 2.97Å; E32-V34 PolarHBondContact O-N 3.43Å; E32-L35 PolarHBondContact O-N 3Å; E32-S36 WeakPolarHBondContact O-CB 3.27Å; E32-S36 PolarHBondContact O-N 3.36Å; E32-F125 HydrophobicContact CB-CZ 4.35Å
33	T	91.3	Very high	80.1	Confident	50 Å²	50	71.7 Å²	71.7	31%	0.307	38%	0.38	S	S	.	.	H	α-helix	trans	-62.4	-45.9	177.1	-60.9	0	0	0	0	110.8	S30 L31 S36	S30-T33 WeakPolarHBondContact O-CB 3.19Å; S30-T33 PolarHBondContact O-N 3.48Å; S30-T33 PolarHBondContact OG-N 3.32Å; S30-T33 VanDerWaalsContact OG-N 3.12Å; S30-T33 PolarHBondContact OG-OG1 3.43Å; L31-T33 VanDerWaalsContact C-N 3.31Å; L31-T33 PolarHBondContact O-N 3.11Å; T33-S36 PolarHBondContact O-N 2.98Å; T33-S36 PolarHBondContact O-OG 2.88Å
34	V	94.4	Very high	82.8	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-61.4	-48.3	176.9	175.2	0	0	0	0	110.7	S30 L31 E32 S36 Q37 G40 F44 F133 F136 Y142 F145	S30-V34 PolarHBondContact O-N 3.41Å; L31-V34 WeakPolarHBondContact O-CB 3.3Å; L31-V34 PolarHBondContact O-N 3.05Å; L31-V34 VanDerWaalsContact O-N 3.14Å; E32-V34 PolarHBondContact O-N 3.43Å; V34-S36 VanDerWaalsContact C-N 3.27Å; V34-S36 PolarHBondContact O-N 2.65Å; V34-Q37 PolarHBondContact O-N 3.46Å; V34-Q37 VanDerWaalsContact O-N 3.17Å; V34-G40 WeakPolarHBondContact CG1-O 3.2Å; V34-G40 CarbonylContact O-C 3.6Å; V34-G40 WeakPolarHBondContact O-CA 3.38Å; V34-F44 HydrophobicContact CG1-CB 4.17Å; V34-F133 HydrophobicContact CG2-CE2 3.86Å; V34-F133 HydrophobicContact CG2-CZ 4.4Å; V34-F136 HydrophobicContact CG1-CE1 3.99Å; V34-F136 HydrophobicContact CG2-CE1 4.43Å; V34-Y142 HydrophobicContact CG2-CD2 4.3Å; V34-Y142 HydrophobicContact CG2-CE2 3.81Å; V34-F145 HydrophobicContact CB-CE1 4.44Å; V34-F145 HydrophobicContact CG2-CD1 4.37Å; V34-F145 HydrophobicContact CG2-CE1 3.86Å
35	L	95.5	Very high	85.4	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.026	32%	0.321	C	S	.	.	H	α-helix	trans	-69.8	-23	-176.5	-62	-172	0	0	0	113.2	L31 E32 Q37 R41 F44 L57 W60 F125	L31-L35 HydrophobicContact CD1-CD1 3.98Å; L31-L35 HydrophobicContact CD1-CD2 4.07Å; L31-L35 HydrophobicContact CD1-CG 3.79Å; L31-L35 HydrophobicContact CD2-CD1 4.28Å; L31-L35 HydrophobicContact CG-CD1 3.8Å; L31-L35 HydrophobicContact CG-CG 4.01Å; L31-L35 VanDerWaalsContact O-CG 3.29Å; L31-L35 WeakPolarHBondContact O-CG 3.32Å; L31-L35 PolarHBondContact O-N 2.86Å; E32-L35 PolarHBondContact O-N 3Å; L35-Q37 PolarHBondContact O-N 3.22Å; L35-R41 HydrophobicContact CB-CG 4.44Å; L35-R41 HydrophobicContact CD2-CG 4.1Å; L35-R41 WeakPolarHBondContact O-CD 3.31Å; L35-R41 VanDerWaalsContact O-CG 3.25Å; L35-R41 WeakPolarHBondContact O-CG 3.4Å; L35-R41 PolarHBondContact O-NE 2.96Å; L35-F44 HydrophobicContact CD2-CD1 3.91Å; L35-L57 HydrophobicContact CD1-CD1 4.35Å; L35-L57 HydrophobicContact CD2-CD1 3.55Å; L35-W60 HydrophobicContact CB-CH2 3.88Å; L35-W60 HydrophobicContact CB-CZ3 3.95Å; L35-W60 HydrophobicContact CD1-CD2 4.11Å; L35-W60 HydrophobicContact CD1-CE3 3.87Å; L35-W60 HydrophobicContact CD1-CH2 3.77Å; L35-W60 HydrophobicContact CD1-CZ2 4.02Å; L35-W60 HydrophobicContact CD1-CZ3 3.7Å; L35-W60 HydrophobicContact CG-CH2 4.49Å; L35-W60 HydrophobicContact CG-CZ3 4.38Å; L35-F125 HydrophobicContact CD1-CD2 4.28Å; L35-F125 HydrophobicContact CD1-CE2 4.04Å
36	S	92.8	Very high	87.7	Confident	71 Å²	71	61.4 Å²	61.4	50%	0.497	32%	0.321	S	S	.	.	H	α-helix	trans	-65.7	-25.1	173.6	79.6	0	0	0	0	113.2	E32 T33 V34	E32-S36 WeakPolarHBondContact O-CB 3.27Å; E32-S36 PolarHBondContact O-N 3.36Å; T33-S36 PolarHBondContact O-N 2.98Å; T33-S36 PolarHBondContact O-OG 2.88Å; V34-S36 VanDerWaalsContact C-N 3.27Å; V34-S36 PolarHBondContact O-N 2.65Å
37	Q	93.5	Very high	90	Very high	68 Å²	68	57.3 Å²	57.3	32%	0.318	29%	0.292	S	S	.	.	S	Bend	trans	-102.2	136.6	-175	-58.2	-56.9	-60.9	0	0	110.8	V34 L35 S39 G40 R41 F145 I149	V34-Q37 PolarHBondContact O-N 3.46Å; V34-Q37 VanDerWaalsContact O-N 3.17Å; L35-Q37 PolarHBondContact O-N 3.22Å; Q37-S39 VanDerWaalsContact C-N 3.31Å; Q37-S39 PolarHBondContact O-N 2.89Å; Q37-G40 PolarHBondContact O-N 2.81Å; Q37-R41 WeakPolarHBondContact O-CG 3.46Å; Q37-R41 PolarHBondContact O-N 3.47Å; Q37-F145 HydrophobicContact CB-CE2 3.68Å; Q37-F145 HydrophobicContact CB-CZ 3.93Å; Q37-F145 HydrophobicContact CG-CE2 4Å; Q37-F145 HydrophobicContact CG-CZ 3.88Å; Q37-I149 HydrophobicContact CG-CD1 3.79Å
38	K	94.2	Very high	92.3	Very high	177 Å²	177	49.7 Å²	49.7	77%	0.77	26%	0.263	S	S	*	.	H	α-helix	trans	-60.1	-41.8	177	-174.5	178.5	178.9	179.3	0	111.9	S42	K38-S42 PolarHBondContact O-N 3.44Å; K38-S42 VanDerWaalsContact O-N 3.08Å
39	S	93.9	Very high	94.2	Very high	59 Å²	59	53.7 Å²	53.7	41%	0.413	28%	0.277	S	S	.	.	H	α-helix	trans	-65.2	-40.5	176.3	48.6	0	0	0	0	112.3	Q37 S42 A43	Q37-S39 VanDerWaalsContact C-N 3.31Å; Q37-S39 PolarHBondContact O-N 2.89Å; S39-S42 PolarHBondContact O-N 3.42Å; S39-A43 PolarHBondContact O-N 3.22Å
40	G	95	Very high	95.5	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-46.7	176.4	0	0	0	0	0	112.1	V34 Q37 S42 A43 F44 F145	V34-G40 WeakPolarHBondContact CG1-O 3.2Å; V34-G40 CarbonylContact O-C 3.6Å; V34-G40 WeakPolarHBondContact O-CA 3.38Å; Q37-G40 PolarHBondContact O-N 2.81Å; G40-S42 VanDerWaalsContact C-N 3.31Å; G40-S42 PolarHBondContact O-N 2.82Å; G40-A43 PolarHBondContact O-N 2.75Å; G40-F44 WeakPolarHBondContact O-CB 3.44Å; G40-F44 PolarHBondContact O-N 3.45Å; G40-F145 VanDerWaalsContact CA-CE2 3.49Å
41	R	97	Very high	95.8	Very high	89 Å²	89	57.4 Å²	57.4	34%	0.336	29%	0.291	S	S	.	.	H	α-helix	trans	-56.9	-41.6	173	-73.3	-177.5	-77.8	174.4	-6.1	113	L35 Q37 R45	L35-R41 HydrophobicContact CB-CG 4.44Å; L35-R41 HydrophobicContact CD2-CG 4.1Å; L35-R41 WeakPolarHBondContact O-CD 3.31Å; L35-R41 VanDerWaalsContact O-CG 3.25Å; L35-R41 WeakPolarHBondContact O-CG 3.4Å; L35-R41 PolarHBondContact O-NE 2.96Å; Q37-R41 WeakPolarHBondContact O-CG 3.46Å; Q37-R41 PolarHBondContact O-N 3.47Å; R41-R45 VanDerWaalsContact O-CB 3.25Å; R41-R45 WeakPolarHBondContact O-CB 3.4Å; R41-R45 PolarHBondContact O-N 3.33Å
42	S	97	Very high	95.8	Very high	64 Å²	64	66 Å²	66	45%	0.448	33%	0.329	S	S	.	.	H	α-helix	trans	-64.9	-51.1	178.3	-164	0	0	0	0	111.3	K38 S39 G40 F44 R45 D46	K38-S42 PolarHBondContact O-N 3.44Å; K38-S42 VanDerWaalsContact O-N 3.08Å; S39-S42 PolarHBondContact O-N 3.42Å; G40-S42 VanDerWaalsContact C-N 3.31Å; G40-S42 PolarHBondContact O-N 2.82Å; S42-F44 VanDerWaalsContact C-N 3.32Å; S42-F44 PolarHBondContact O-N 3.32Å; S42-R45 PolarHBondContact O-N 2.67Å; S42-D46 PolarHBondContact O-N 2.86Å
43	A	96.7	Very high	96	Very high	19 Å²	19	60.3 Å²	60.3	16%	0.157	30%	0.304	C	S	.	.	H	α-helix	trans	-61	-42	-179.6	0	0	0	0	0	111.9	S39 G40 D46 F47 F136 P141	S39-A43 PolarHBondContact O-N 3.22Å; G40-A43 PolarHBondContact O-N 2.75Å; A43-D46 PolarHBondContact O-N 3.1Å; A43-F47 PolarHBondContact O-N 3.29Å; A43-F47 VanDerWaalsContact O-N 3.09Å; A43-F136 HydrophobicContact CB-CE2 4.31Å; A43-F136 HydrophobicContact CB-CZ 3.98Å; A43-P141 HydrophobicContact CB-CB 4.36Å
44	F	97.8	Very high	96.4	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-68.6	-40.2	177.6	-169.9	-128.8	0	0	0	112	L31 V34 L35 G40 S42 D46 F47 L48 L57 M128 F133 F136	L31-F44 HydrophobicContact CD1-CD1 3.97Å; L31-F44 HydrophobicContact CD1-CE1 3.55Å; L31-F44 HydrophobicContact CD1-CZ 3.89Å; V34-F44 HydrophobicContact CG1-CB 4.17Å; L35-F44 HydrophobicContact CD2-CD1 3.91Å; G40-F44 WeakPolarHBondContact O-CB 3.44Å; G40-F44 PolarHBondContact O-N 3.45Å; S42-F44 VanDerWaalsContact C-N 3.32Å; S42-F44 PolarHBondContact O-N 3.32Å; F44-D46 VanDerWaalsContact C-N 3.33Å; F44-D46 PolarHBondContact O-N 3.04Å; F44-F47 HydrophobicContact CD2-CD1 4.25Å; F44-F47 HydrophobicContact CE2-CD1 4.15Å; F44-F47 WeakPolarHBondContact O-CB 3.42Å; F44-F47 PolarHBondContact O-N 3.23Å; F44-L48 HydrophobicContact CD1-CD1 3.87Å; F44-L48 HydrophobicContact CD1-CG 4.34Å; F44-L48 HydrophobicContact CD2-CG 4.42Å; F44-L48 HydrophobicContact CE1-CD1 3.68Å; F44-L48 HydrophobicContact CE1-CD2 4.22Å; F44-L48 HydrophobicContact CE1-CG 4.14Å; F44-L48 HydrophobicContact CE2-CD2 4.01Å; F44-L48 HydrophobicContact CE2-CG 4.22Å; F44-L48 HydrophobicContact CG-CD1 4.45Å; F44-L48 HydrophobicContact CG-CG 4.48Å; F44-L48 HydrophobicContact CZ-CD1 4.1Å; F44-L48 HydrophobicContact CZ-CD2 3.77Å; F44-L48 HydrophobicContact CZ-CG 4.09Å; F44-L48 VanDerWaalsContact O-CG 3.31Å; F44-L48 WeakPolarHBondContact O-CG 3.35Å; F44-L48 PolarHBondContact O-N 3.1Å; F44-L57 HydrophobicContact CD1-CD2 4.14Å; F44-M128 HydrophobicContact CE1-CB 4.35Å; F44-M128 HydrophobicContact CE1-SD 3.86Å; F44-M128 HydrophobicContact CZ-CB 4.28Å; F44-F133 HydrophobicContact CE2-CB 4.49Å; F44-F133 HydrophobicContact CE2-CD2 4.45Å; F44-F133 HydrophobicContact CZ-CB 4.43Å; F44-F136 HydrophobicContact CB-CE1 4.08Å; F44-F136 HydrophobicContact CB-CE2 4.49Å; F44-F136 HydrophobicContact CB-CZ 4.07Å; F44-F136 HydrophobicContact CD2-CB 3.92Å; F44-F136 AromaticContact CD2-CD1 3.52Å; F44-F136 HydrophobicContact CD2-CD1 3.52Å; F44-F136 AromaticContact CD2-CD2 3.98Å; F44-F136 HydrophobicContact CD2-CD2 3.98Å; F44-F136 AromaticContact CD2-CE1 3.93Å; F44-F136 HydrophobicContact CD2-CE1 3.93Å; F44-F136 HydrophobicContact CD2-CE2 4.37Å; F44-F136 AromaticContact CD2-CG 3.53Å; F44-F136 HydrophobicContact CD2-CG 3.53Å; F44-F136 HydrophobicContact CD2-CZ 4.35Å; F44-F136 HydrophobicContact CE2-CB 3.87Å; F44-F136 HydrophobicContact CE2-CD1 4.11Å; F44-F136 HydrophobicContact CE2-CG 4.01Å; F44-F136 HydrophobicContact CG-CD1 4.37Å; F44-F136 HydrophobicContact CG-CE1 4.38Å
45	R	98.4	Very high	96.6	Very high	72 Å²	72	62.5 Å²	62.5	27%	0.272	31%	0.311	S	S	.	.	H	α-helix	trans	-57.8	-46.2	173.7	-176.8	179.9	-69	-122.3	1.8	111.8	R41 S42 F47 L48 K49 L57 E58	R41-R45 VanDerWaalsContact O-CB 3.25Å; R41-R45 WeakPolarHBondContact O-CB 3.4Å; R41-R45 PolarHBondContact O-N 3.33Å; S42-R45 PolarHBondContact O-N 2.67Å; R45-F47 VanDerWaalsContact C-N 3.28Å; R45-F47 PolarHBondContact O-N 2.93Å; R45-L48 PolarHBondContact O-N 2.7Å; R45-K49 WeakPolarHBondContact O-CG 3.38Å; R45-K49 PolarHBondContact O-N 3.16Å; R45-L57 HydrophobicContact CB-CD2 3.73Å; R45-L57 HydrophobicContact CG-CD2 4.45Å; R45-E58 IonicContact CZ-OE1 3.78Å; R45-E58 IonicContact NH1-OE1 2.74Å; R45-E58 PolarHBondContact NH1-OE1 3.21Å
46	D	98.1	Very high	96.7	Very high	83 Å²	83	62.7 Å²	62.7	44%	0.444	31%	0.312	S	S	.	.	H	α-helix	trans	-64.6	-36.7	-179.7	-66.4	-28.2	0	0	0	111.1	S42 A43 F44 K49 L50	S42-D46 PolarHBondContact O-N 2.86Å; A43-D46 PolarHBondContact O-N 3.1Å; F44-D46 VanDerWaalsContact C-N 3.33Å; F44-D46 PolarHBondContact O-N 3.04Å; D46-K49 IonicContact OD1-NZ 3.83Å; D46-L50 WeakPolarHBondContact O-CG 3.18Å; D46-L50 PolarHBondContact O-N 2.69Å
47	F	98	Very high	97	Very high	24 Å²	24	59.3 Å²	59.3	11%	0.105	29%	0.288	C	S	.	.	H	α-helix	trans	-62.6	-47.9	170.5	175.3	-96.5	0	0	0	112.6	A43 F44 R45 K49 L50 E51 S132 R135 F136 T139	A43-F47 PolarHBondContact O-N 3.29Å; A43-F47 VanDerWaalsContact O-N 3.09Å; F44-F47 HydrophobicContact CD2-CD1 4.25Å; F44-F47 HydrophobicContact CE2-CD1 4.15Å; F44-F47 WeakPolarHBondContact O-CB 3.42Å; F44-F47 PolarHBondContact O-N 3.23Å; R45-F47 VanDerWaalsContact C-N 3.28Å; R45-F47 PolarHBondContact O-N 2.93Å; F47-K49 VanDerWaalsContact C-N 3.27Å; F47-K49 PolarHBondContact O-N 3.11Å; F47-L50 WeakPolarHBondContact O-CB 3.2Å; F47-L50 PolarHBondContact O-N 3.26Å; F47-E51 HydrophobicContact CE1-CG 4.04Å; F47-E51 VanDerWaalsContact CE1-OE2 3.32Å; F47-E51 WeakPolarHBondContact CE1-OE2 2.96Å; F47-E51 HydrophobicContact CZ-CG 4Å; F47-E51 VanDerWaalsContact CZ-OE1 3.24Å; F47-E51 WeakPolarHBondContact CZ-OE1 3.32Å; F47-E51 PolarHBondContact O-N 2.99Å; F47-S132 VanDerWaalsContact CE1-O 3.31Å; F47-S132 WeakPolarHBondContact CE1-O 3.37Å; F47-R135 HydrophobicContact CZ-CB 3.8Å; F47-F136 HydrophobicContact CB-CD2 3.6Å; F47-F136 HydrophobicContact CB-CE2 4.02Å; F47-F136 HydrophobicContact CD1-CB 3.77Å; F47-F136 HydrophobicContact CD1-CD2 4.04Å; F47-F136 HydrophobicContact CD1-CG 4.26Å; F47-F136 HydrophobicContact CD2-CB 4.49Å; F47-F136 HydrophobicContact CD2-CD2 4.06Å; F47-F136 HydrophobicContact CE1-CB 3.81Å; F47-F136 HydrophobicContact CG-CB 4.13Å; F47-F136 AromaticContact CG-CD2 3.62Å; F47-F136 HydrophobicContact CG-CD2 3.62Å; F47-F136 HydrophobicContact CG-CG 4.29Å; F47-F136 HydrophobicContact CZ-CB 4.2Å; F47-T139 HydrophobicContact CD2-CG2 3.82Å; F47-T139 HydrophobicContact CE2-CG2 3.7Å
48	L	98.1	Very high	97.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-32.5	-179.5	-66.2	173.8	0	0	0	112.8	F44 R45 L50 E51 F52 C53 E54 L57 M128 S132	F44-L48 HydrophobicContact CD1-CD1 3.87Å; F44-L48 HydrophobicContact CD1-CG 4.34Å; F44-L48 HydrophobicContact CD2-CG 4.42Å; F44-L48 HydrophobicContact CE1-CD1 3.68Å; F44-L48 HydrophobicContact CE1-CD2 4.22Å; F44-L48 HydrophobicContact CE1-CG 4.14Å; F44-L48 HydrophobicContact CE2-CD2 4.01Å; F44-L48 HydrophobicContact CE2-CG 4.22Å; F44-L48 HydrophobicContact CG-CD1 4.45Å; F44-L48 HydrophobicContact CG-CG 4.48Å; F44-L48 HydrophobicContact CZ-CD1 4.1Å; F44-L48 HydrophobicContact CZ-CD2 3.77Å; F44-L48 HydrophobicContact CZ-CG 4.09Å; F44-L48 VanDerWaalsContact O-CG 3.31Å; F44-L48 WeakPolarHBondContact O-CG 3.35Å; F44-L48 PolarHBondContact O-N 3.1Å; R45-L48 PolarHBondContact O-N 2.7Å; L48-L50 VanDerWaalsContact C-N 3.29Å; L48-L50 PolarHBondContact O-N 3.2Å; L48-E51 CarbonylContact O-C 3.3Å; L48-E51 VanDerWaalsContact O-C 3.3Å; L48-E51 WeakPolarHBondContact O-CA 3.37Å; L48-E51 PolarHBondContact O-N 3.14Å; L48-E51 VanDerWaalsContact O-N 3.08Å; L48-F52 PolarHBondContact O-N 2.92Å; L48-C53 WeakPolarHBondContact CD2-SG 3.45Å; L48-C53 PolarHBondContact O-N 2.8Å; L48-E54 HydrophobicContact CB-CB 3.99Å; L48-L57 HydrophobicContact CD1-CB 3.49Å; L48-L57 VanDerWaalsContact CD1-CB 3.49Å; L48-L57 HydrophobicContact CD1-CD2 4.13Å; L48-L57 HydrophobicContact CD1-CG 4.44Å; L48-M128 HydrophobicContact CD1-SD 4.17Å; L48-S132 VanDerWaalsContact CD2-CB 3.48Å
49	K	97.9	Very high	97.4	Very high	94 Å²	94	49.3 Å²	49.3	41%	0.409	25%	0.245	S	C	.	.	H	α-helix	trans	-62.4	-35.7	172.3	-74.1	174.7	179.7	170.7	0	112.7	R45 D46 F47 E51 F52 E54	R45-K49 WeakPolarHBondContact O-CG 3.38Å; R45-K49 PolarHBondContact O-N 3.16Å; D46-K49 IonicContact OD1-NZ 3.83Å; F47-K49 VanDerWaalsContact C-N 3.27Å; F47-K49 PolarHBondContact O-N 3.11Å; K49-E51 PolarHBondContact O-N 2.66Å; K49-F52 PolarHBondContact O-N 2.93Å; K49-E54 HydrophobicContact CG-CB 3.91Å; K49-E54 HydrophobicContact CG-CG 3.93Å
50	L	97.1	Very high	97.7	Very high	137 Å²	137	47.8 Å²	47.8	72%	0.717	23%	0.23	S	C	*	.	H	α-helix	trans	-68.6	-27.2	175	-59.9	173	0	0	0	111.4	D46 F47 L48	D46-L50 WeakPolarHBondContact O-CG 3.18Å; D46-L50 PolarHBondContact O-N 2.69Å; F47-L50 WeakPolarHBondContact O-CB 3.2Å; F47-L50 PolarHBondContact O-N 3.26Å; L48-L50 VanDerWaalsContact C-N 3.29Å; L48-L50 PolarHBondContact O-N 3.2Å
51	E	96.1	Very high	97.8	Very high	56 Å²	56	49.3 Å²	49.3	26%	0.262	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	4.3	175.5	-61.8	-159.2	142.4	0	0	113.4	F47 L48 K49 C53 S132 R135	F47-E51 HydrophobicContact CE1-CG 4.04Å; F47-E51 VanDerWaalsContact CE1-OE2 3.32Å; F47-E51 WeakPolarHBondContact CE1-OE2 2.96Å; F47-E51 HydrophobicContact CZ-CG 4Å; F47-E51 VanDerWaalsContact CZ-OE1 3.24Å; F47-E51 WeakPolarHBondContact CZ-OE1 3.32Å; F47-E51 PolarHBondContact O-N 2.99Å; L48-E51 CarbonylContact O-C 3.3Å; L48-E51 VanDerWaalsContact O-C 3.3Å; L48-E51 WeakPolarHBondContact O-CA 3.37Å; L48-E51 PolarHBondContact O-N 3.14Å; L48-E51 VanDerWaalsContact O-N 3.08Å; K49-E51 PolarHBondContact O-N 2.66Å; E51-C53 VanDerWaalsContact C-N 3.27Å; E51-C53 VanDerWaalsContact CB-SG 3.56Å; E51-C53 PolarHBondContact O-N 3.03Å; E51-S132 WeakPolarHBondContact OE2-CB 3.32Å; E51-S132 PolarHBondContact OE2-OG 2.74Å; E51-R135 VanDerWaalsContact CD-NH2 3.27Å; E51-R135 IonicContact OE1-CZ 3.79Å; E51-R135 VanDerWaalsContact OE1-CZ 3.28Å; E51-R135 IonicContact OE1-NE 2.62Å; E51-R135 PolarHBondContact OE1-NE 3.08Å; E51-R135 IonicContact OE1-NH2 3.07Å; E51-R135 PolarHBondContact OE1-NH2 3.03Å; E51-R135 IonicContact OE2-CZ 3.62Å; E51-R135 IonicContact OE2-NE 2.93Å; E51-R135 IonicContact OE2-NH2 3.85Å; E51-R135 PolarHBondContact OE2-NH2 3.18Å
52	F	96	Very high	97.9	Very high	182 Å²	182	46.1 Å²	46.1	80%	0.798	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	42.9	-177.3	-53.9	-88.3	0	0	0	113.3	L48 K49	L48-F52 PolarHBondContact O-N 2.92Å; K49-F52 PolarHBondContact O-N 2.93Å
53	C	97.9	Very high	97.9	Very high	17 Å²	17	43.1 Å²	43.1	12%	0.115	21%	0.209	C	C	.	.			trans	-140.1	24.4	-177	66.2	0	0	0	0	113.2	L48 E51 E55 N56	L48-C53 WeakPolarHBondContact CD2-SG 3.45Å; L48-C53 PolarHBondContact O-N 2.8Å; E51-C53 VanDerWaalsContact C-N 3.27Å; E51-C53 VanDerWaalsContact CB-SG 3.56Å; E51-C53 PolarHBondContact O-N 3.03Å; C53-E55 WeakPolarHBondContact CA-OE1 3.43Å; C53-E55 WeakPolarHBondContact CA-OE2 3.42Å; C53-E55 PolarHBondContact O-N 2.86Å; C53-N56 PolarHBondContact O-N 3.24Å; C53-N56 PolarHBondContact O-ND2 3.14Å
54	E	98.2	Very high	97.9	Very high	56 Å²	56	46.7 Å²	46.7	26%	0.262	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-22	-179	71.3	-86.5	-154.5	0	0	113.9	L48 K49 N56 L57 E58	L48-E54 HydrophobicContact CB-CB 3.99Å; K49-E54 HydrophobicContact CG-CB 3.91Å; K49-E54 HydrophobicContact CG-CG 3.93Å; E54-N56 PolarHBondContact O-N 3.08Å; E54-N56 VanDerWaalsContact O-N 3.16Å; E54-L57 PolarHBondContact O-N 3.34Å; E54-L57 VanDerWaalsContact O-N 3.09Å; E54-E58 PolarHBondContact O-N 3.33Å; E54-E58 VanDerWaalsContact O-N 3.11Å
55	E	98.6	Very high	97.8	Very high	39 Å²	39	52.6 Å²	52.6	18%	0.182	25%	0.249	C	C	.	.	H	α-helix	trans	-56.9	-30.3	176.4	72.1	-66.2	156	0	0	112	C53 L57 E58 F59 K93 V95	C53-E55 WeakPolarHBondContact CA-OE1 3.43Å; C53-E55 WeakPolarHBondContact CA-OE2 3.42Å; C53-E55 PolarHBondContact O-N 2.86Å; E55-L57 PolarHBondContact O-N 3.33Å; E55-E58 PolarHBondContact O-N 3.24Å; E55-F59 VanDerWaalsContact O-CB 3.24Å; E55-F59 WeakPolarHBondContact O-CB 3.4Å; E55-F59 PolarHBondContact O-N 2.86Å; E55-K93 HydrophobicContact CB-CB 3.86Å; E55-V95 HydrophobicContact CG-CG1 4.03Å
56	N	98.5	Very high	97.7	Very high	9 Å²	9	49.2 Å²	49.2	5%	0.048	24%	0.236	C	C	.	.	H	α-helix	trans	-63.4	-41.6	178.2	-64.3	-62.7	0	0	0	112.1	C53 E54 W60 I124 M128	C53-N56 PolarHBondContact O-N 3.24Å; C53-N56 PolarHBondContact O-ND2 3.14Å; E54-N56 PolarHBondContact O-N 3.08Å; E54-N56 VanDerWaalsContact O-N 3.16Å; N56-W60 WeakPolarHBondContact O-CB 3.42Å; N56-W60 PolarHBondContact O-N 2.92Å; N56-W60 VanDerWaalsContact O-N 3.09Å; N56-I124 HydrophobicContact CB-CG2 3.63Å; N56-I124 VanDerWaalsContact O-CG2 3.27Å; N56-I124 WeakPolarHBondContact O-CG2 3.47Å; N56-M128 HydrophobicContact CB-CG 3.67Å; N56-M128 HydrophobicContact CB-SD 3.75Å
57	L	98.6	Very high	97.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-74.7	-38.3	177.1	175.5	60.8	0	0	0	111.4	L35 F44 R45 L48 E54 E55 W60 L61 M128	L35-L57 HydrophobicContact CD1-CD1 4.35Å; L35-L57 HydrophobicContact CD2-CD1 3.55Å; F44-L57 HydrophobicContact CD1-CD2 4.14Å; R45-L57 HydrophobicContact CB-CD2 3.73Å; R45-L57 HydrophobicContact CG-CD2 4.45Å; L48-L57 HydrophobicContact CD1-CB 3.49Å; L48-L57 VanDerWaalsContact CD1-CB 3.49Å; L48-L57 HydrophobicContact CD1-CD2 4.13Å; L48-L57 HydrophobicContact CD1-CG 4.44Å; E54-L57 PolarHBondContact O-N 3.34Å; E54-L57 VanDerWaalsContact O-N 3.09Å; E55-L57 PolarHBondContact O-N 3.33Å; L57-W60 HydrophobicContact CD1-CE3 4.41Å; L57-W60 PolarHBondContact O-N 2.92Å; L57-L61 HydrophobicContact CD1-CD1 4.06Å; L57-L61 HydrophobicContact CD1-CG 4.1Å; L57-L61 HydrophobicContact CG-CD1 4.05Å; L57-L61 WeakPolarHBondContact O-CB 3.15Å; L57-L61 VanDerWaalsContact O-CG 3.28Å; L57-L61 WeakPolarHBondContact O-CG 3.09Å; L57-L61 PolarHBondContact O-N 2.74Å; L57-M128 HydrophobicContact CB-SD 3.94Å
58	E	98.6	Very high	97.3	Very high	36 Å²	36	52.1 Å²	52.1	17%	0.168	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-47.9	177.1	-67.9	-172.4	166.9	0	0	111.5	R45 E54 E55 L61 A62 F86 K93	R45-E58 IonicContact CZ-OE1 3.78Å; R45-E58 IonicContact NH1-OE1 2.74Å; R45-E58 PolarHBondContact NH1-OE1 3.21Å; E54-E58 PolarHBondContact O-N 3.33Å; E54-E58 VanDerWaalsContact O-N 3.11Å; E55-E58 PolarHBondContact O-N 3.24Å; E58-L61 PolarHBondContact O-N 3Å; E58-A62 WeakPolarHBondContact O-CB 3.39Å; E58-A62 PolarHBondContact O-N 2.97Å; E58-F86 HydrophobicContact CB-CE1 3.89Å; E58-F86 HydrophobicContact CB-CZ 4Å; E58-K93 WeakPolarHBondContact OE2-CD 3.38Å; E58-K93 WeakPolarHBondContact OE2-CE 3.48Å; E58-K93 IonicContact OE2-NZ 2.7Å; E58-K93 PolarHBondContact OE2-NZ 3.41Å
59	F	98.8	Very high	97	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.8	-49.1	174.3	173.6	-107.6	0	0	0	111.9	E55 L61 A62 C63 I82 F86 I87 V95 A120 I124	E55-F59 VanDerWaalsContact O-CB 3.24Å; E55-F59 WeakPolarHBondContact O-CB 3.4Å; E55-F59 PolarHBondContact O-N 2.86Å; F59-L61 VanDerWaalsContact C-N 3.3Å; F59-L61 PolarHBondContact O-N 3.43Å; F59-A62 WeakPolarHBondContact O-CB 3.47Å; F59-A62 PolarHBondContact O-N 3.37Å; F59-A62 VanDerWaalsContact O-N 3.14Å; F59-C63 WeakPolarHBondContact CE2-SG 3.46Å; F59-C63 WeakPolarHBondContact CZ-SG 3.37Å; F59-C63 PolarHBondContact O-N 3.13Å; F59-C63 PolarHBondContact O-SG 2.94Å; F59-C63 VanDerWaalsContact O-SG 3.33Å; F59-I82 HydrophobicContact CD2-CG2 4.16Å; F59-I82 HydrophobicContact CE2-CG2 3.83Å; F59-F86 HydrophobicContact CB-CB 4.35Å; F59-F86 HydrophobicContact CB-CD1 3.7Å; F59-F86 HydrophobicContact CB-CE1 4.1Å; F59-F86 HydrophobicContact CB-CG 3.96Å; F59-F86 HydrophobicContact CD2-CB 3.53Å; F59-F86 HydrophobicContact CD2-CD1 4.36Å; F59-F86 HydrophobicContact CD2-CD2 4.06Å; F59-F86 AromaticContact CD2-CG 3.74Å; F59-F86 HydrophobicContact CD2-CG 3.74Å; F59-F86 HydrophobicContact CE2-CB 4.24Å; F59-F86 HydrophobicContact CG-CB 4.24Å; F59-F86 HydrophobicContact CG-CD1 4.48Å; F59-F86 HydrophobicContact CG-CG 4.29Å; F59-I87 HydrophobicContact CD2-CD1 4.35Å; F59-I87 HydrophobicContact CE2-CD1 3.52Å; F59-I87 HydrophobicContact CE2-CG1 4.18Å; F59-I87 HydrophobicContact CZ-CD1 3.73Å; F59-V95 HydrophobicContact CB-CG1 3.66Å; F59-V95 HydrophobicContact CD1-CG1 4.22Å; F59-V95 HydrophobicContact CD1-CG2 4.25Å; F59-V95 HydrophobicContact CE1-CG2 4.44Å; F59-V95 HydrophobicContact CG-CG1 3.92Å; F59-V95 HydrophobicContact CG-CG2 4.27Å; F59-A120 HydrophobicContact CE1-CB 3.97Å; F59-A120 HydrophobicContact CZ-CB 3.7Å; F59-I124 HydrophobicContact CD1-CB 3.96Å; F59-I124 HydrophobicContact CD1-CG1 3.66Å; F59-I124 HydrophobicContact CD1-CG2 4.07Å; F59-I124 HydrophobicContact CE1-CB 4.22Å; F59-I124 HydrophobicContact CE1-CG1 3.73Å
60	W	98.5	Very high	96.6	Very high	27 Å²	27	55.7 Å²	55.7	10%	0.102	28%	0.275	C	S	.	.	H	α-helix	trans	-58.4	-42.9	179.9	-178.1	87.4	0	0	0	111.9	L35 N56 L57 C63 K64 E121 F125 M128	L35-W60 HydrophobicContact CB-CH2 3.88Å; L35-W60 HydrophobicContact CB-CZ3 3.95Å; L35-W60 HydrophobicContact CD1-CD2 4.11Å; L35-W60 HydrophobicContact CD1-CE3 3.87Å; L35-W60 HydrophobicContact CD1-CH2 3.77Å; L35-W60 HydrophobicContact CD1-CZ2 4.02Å; L35-W60 HydrophobicContact CD1-CZ3 3.7Å; L35-W60 HydrophobicContact CG-CH2 4.49Å; L35-W60 HydrophobicContact CG-CZ3 4.38Å; N56-W60 WeakPolarHBondContact O-CB 3.42Å; N56-W60 PolarHBondContact O-N 2.92Å; N56-W60 VanDerWaalsContact O-N 3.09Å; L57-W60 HydrophobicContact CD1-CE3 4.41Å; L57-W60 PolarHBondContact O-N 2.92Å; W60-C63 PolarHBondContact O-N 3.08Å; W60-K64 HydrophobicContact CD2-CD 4.38Å; W60-K64 HydrophobicContact CD2-CG 4.16Å; W60-K64 HydrophobicContact CE3-CD 4.48Å; W60-K64 HydrophobicContact CE3-CG 3.9Å; W60-K64 HydrophobicContact CH2-CD 3.77Å; W60-K64 HydrophobicContact CH2-CG 3.84Å; W60-K64 HydrophobicContact CZ2-CD 3.63Å; W60-K64 HydrophobicContact CZ2-CG 4.09Å; W60-K64 HydrophobicContact CZ3-CD 4.19Å; W60-K64 HydrophobicContact CZ3-CG 3.73Å; W60-K64 WeakPolarHBondContact O-CG 3.28Å; W60-K64 PolarHBondContact O-N 3.39Å; W60-E121 VanDerWaalsContact CD1-CG 3.44Å; W60-E121 HydrophobicContact CG-CG 4.32Å; W60-F125 AromaticContact CE2-CD2 3.87Å; W60-F125 HydrophobicContact CZ2-CD2 4.18Å; W60-F125 HydrophobicContact CZ2-CE2 4.38Å; W60-F125 AromaticContact NE1-CD2 3.48Å; W60-M128 HydrophobicContact CB-CE 3.84Å; W60-M128 HydrophobicContact CG-CE 4.09Å
61	L	98.2	Very high	96.5	Very high	32 Å²	32	52.2 Å²	52.2	17%	0.168	26%	0.261	C	S	.	.	H	α-helix	trans	-65.3	-42.2	175.9	-71.6	170.2	0	0	0	112.1	L57 E58 F59 C63 K64 E65	L57-L61 HydrophobicContact CD1-CD1 4.06Å; L57-L61 HydrophobicContact CD1-CG 4.1Å; L57-L61 HydrophobicContact CG-CD1 4.05Å; L57-L61 WeakPolarHBondContact O-CB 3.15Å; L57-L61 VanDerWaalsContact O-CG 3.28Å; L57-L61 WeakPolarHBondContact O-CG 3.09Å; L57-L61 PolarHBondContact O-N 2.74Å; E58-L61 PolarHBondContact O-N 3Å; F59-L61 VanDerWaalsContact C-N 3.3Å; F59-L61 PolarHBondContact O-N 3.43Å; L61-C63 VanDerWaalsContact C-N 3.28Å; L61-C63 PolarHBondContact O-N 3.4Å; L61-K64 WeakPolarHBondContact O-CB 3.45Å; L61-K64 PolarHBondContact O-N 3.28Å; L61-K64 VanDerWaalsContact O-N 3.08Å; L61-E65 PolarHBondContact O-N 3.03Å
62	A	98.3	Very high	96.3	Very high	21 Å²	21	54.7 Å²	54.7	17%	0.174	28%	0.276	C	S	.	.	H	α-helix	trans	-59.4	-39.7	175.1	0	0	0	0	0	111.3	E58 F59 E65 Y66 I82 F86	E58-A62 WeakPolarHBondContact O-CB 3.39Å; E58-A62 PolarHBondContact O-N 2.97Å; F59-A62 WeakPolarHBondContact O-CB 3.47Å; F59-A62 PolarHBondContact O-N 3.37Å; F59-A62 VanDerWaalsContact O-N 3.14Å; A62-E65 PolarHBondContact O-N 3.33Å; A62-Y66 VanDerWaalsContact O-CB 3.23Å; A62-Y66 WeakPolarHBondContact O-CB 3.47Å; A62-Y66 PolarHBondContact O-N 3.11Å; A62-I82 HydrophobicContact CB-CD1 4.12Å; A62-I82 HydrophobicContact CB-CG1 4.14Å; A62-F86 HydrophobicContact CB-CE2 4.42Å
63	C	97.9	Very high	96.2	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.007	27%	0.268	C	S	.	.	H	α-helix	trans	-66.9	-35.8	173.1	-62.8	0	0	0	0	113.4	F59 W60 L61 F117 E121	F59-C63 WeakPolarHBondContact CE2-SG 3.46Å; F59-C63 WeakPolarHBondContact CZ-SG 3.37Å; F59-C63 PolarHBondContact O-N 3.13Å; F59-C63 PolarHBondContact O-SG 2.94Å; F59-C63 VanDerWaalsContact O-SG 3.33Å; W60-C63 PolarHBondContact O-N 3.08Å; L61-C63 VanDerWaalsContact C-N 3.28Å; L61-C63 PolarHBondContact O-N 3.4Å; C63-F117 HydrophobicContact CB-CB 4.33Å; C63-F117 VanDerWaalsContact SG-CB 3.52Å; C63-E121 HydrophobicContact CB-CB 3.91Å; C63-E121 HydrophobicContact CB-CG 3.88Å
64	K	95.9	Very high	96	Very high	95 Å²	95	56 Å²	56	41%	0.413	28%	0.282	S	S	.	.	H	α-helix	trans	-60.3	-47.8	172.3	-64.2	-56.8	-50.4	179	0	110.9	W60 L61 R67 E121	W60-K64 HydrophobicContact CD2-CD 4.38Å; W60-K64 HydrophobicContact CD2-CG 4.16Å; W60-K64 HydrophobicContact CE3-CD 4.48Å; W60-K64 HydrophobicContact CE3-CG 3.9Å; W60-K64 HydrophobicContact CH2-CD 3.77Å; W60-K64 HydrophobicContact CH2-CG 3.84Å; W60-K64 HydrophobicContact CZ2-CD 3.63Å; W60-K64 HydrophobicContact CZ2-CG 4.09Å; W60-K64 HydrophobicContact CZ3-CD 4.19Å; W60-K64 HydrophobicContact CZ3-CG 3.73Å; W60-K64 WeakPolarHBondContact O-CG 3.28Å; W60-K64 PolarHBondContact O-N 3.39Å; L61-K64 WeakPolarHBondContact O-CB 3.45Å; L61-K64 PolarHBondContact O-N 3.28Å; L61-K64 VanDerWaalsContact O-N 3.08Å; K64-R67 VanDerWaalsContact CE-NH2 3.27Å; K64-R67 VanDerWaalsContact NZ-NH2 3.12Å; K64-E121 WeakPolarHBondContact CD-OE1 3.46Å
65	E	95.9	Very high	95.9	Very high	123 Å²	123	54.9 Å²	54.9	58%	0.575	28%	0.276	S	S	*	.	H	α-helix	trans	-68.9	-42.1	-178.2	-175.1	167.8	-166.8	0	0	111.6	L61 A62 R67 S68 F69	L61-E65 PolarHBondContact O-N 3.03Å; A62-E65 PolarHBondContact O-N 3.33Å; E65-R67 PolarHBondContact O-N 3.22Å; E65-R67 VanDerWaalsContact O-N 3.1Å; E65-S68 WeakPolarHBondContact O-CB 3.44Å; E65-S68 PolarHBondContact O-N 3.08Å; E65-S68 PolarHBondContact O-OG 3.16Å; E65-F69 HydrophobicContact CG-CE2 4.01Å; E65-F69 HydrophobicContact CG-CZ 4.09Å
66	Y	97.1	Very high	95.8	Very high	2 Å²	2	56 Å²	56	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-49.8	-40.2	177.1	173	-99.8	0	0	0	113.4	A62 S68 F69 R75 I78 A79 I82 P112 G113 C116 F117	A62-Y66 VanDerWaalsContact O-CB 3.23Å; A62-Y66 WeakPolarHBondContact O-CB 3.47Å; A62-Y66 PolarHBondContact O-N 3.11Å; Y66-S68 PolarHBondContact O-N 2.99Å; Y66-F69 WeakPolarHBondContact O-CD2 3.16Å; Y66-F69 PolarHBondContact O-N 3.42Å; Y66-R75 HydrophobicContact CD2-CG 4.35Å; Y66-R75 HydrophobicContact CE1-CG 4.49Å; Y66-R75 HydrophobicContact CE2-CG 3.36Å; Y66-R75 VanDerWaalsContact CZ-CG 3.46Å; Y66-R75 WeakPolarHBondContact OH-CD 3.46Å; Y66-R75 WeakPolarHBondContact OH-CG 3.46Å; Y66-I78 HydrophobicContact CD2-CB 4.35Å; Y66-I78 HydrophobicContact CD2-CG2 3.92Å; Y66-A79 HydrophobicContact CE2-CB 3.77Å; Y66-I82 HydrophobicContact CD2-CD1 4.14Å; Y66-I82 HydrophobicContact CG-CD1 4.2Å; Y66-P112 WeakPolarHBondContact OH-CB 3.42Å; Y66-G113 VanDerWaalsContact CE1-O 3.28Å; Y66-G113 WeakPolarHBondContact CE1-O 3.47Å; Y66-G113 PolarHBondContact OH-O 3.19Å; Y66-C116 HydrophobicContact CE1-CB 3.96Å; Y66-F117 AromaticContact CD1-CD2 3.62Å; Y66-F117 HydrophobicContact CD1-CD2 3.62Å; Y66-F117 HydrophobicContact CD1-CE2 4.04Å; Y66-F117 HydrophobicContact CD2-CD2 4.28Å; Y66-F117 AromaticContact CD2-CE2 3.9Å; Y66-F117 HydrophobicContact CD2-CE2 3.9Å; Y66-F117 AromaticContact CE1-CD2 3.74Å; Y66-F117 HydrophobicContact CE1-CD2 3.74Å; Y66-F117 AromaticContact CE1-CE2 3.95Å; Y66-F117 HydrophobicContact CE1-CE2 3.95Å; Y66-F117 HydrophobicContact CE2-CD2 4.38Å; Y66-F117 AromaticContact CE2-CE2 3.81Å; Y66-F117 HydrophobicContact CE2-CE2 3.81Å; Y66-F117 AromaticContact CG-CD2 3.88Å; Y66-F117 HydrophobicContact CG-CD2 3.88Å; Y66-F117 AromaticContact CG-CE2 3.99Å; Y66-F117 HydrophobicContact CG-CE2 3.99Å; Y66-F117 AromaticContact CZ-CE2 3.83Å
67	R	93.9	Very high	95.7	Very high	86 Å²	86	61.3 Å²	61.3	33%	0.325	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-16.3	178.9	-80.5	-170.2	-64.7	-117.2	-16.6	114.9	K64 E65 S114 E121	K64-R67 VanDerWaalsContact CE-NH2 3.27Å; K64-R67 VanDerWaalsContact NZ-NH2 3.12Å; E65-R67 PolarHBondContact O-N 3.22Å; E65-R67 VanDerWaalsContact O-N 3.1Å; R67-S114 VanDerWaalsContact CG-O 3.28Å; R67-S114 WeakPolarHBondContact CG-O 3.42Å; R67-E121 IonicContact CZ-OE1 3.01Å; R67-E121 IonicContact CZ-OE2 3.79Å; R67-E121 IonicContact NH1-OE1 2.71Å; R67-E121 PolarHBondContact NH1-OE1 3.13Å; R67-E121 IonicContact NH1-OE2 2.83Å; R67-E121 PolarHBondContact NH1-OE2 3.32Å; R67-E121 IonicContact NH2-OE1 3.92Å; R67-E121 PolarHBondContact NH2-OE1 3.24Å; R67-E121 IonicContact NH2-OE2 3.28Å; R67-E121 PolarHBondContact NH2-OE2 2.93Å
68	S	93.4	Very high	95.7	Very high	81 Å²	81	64 Å²	64	57%	0.566	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-11.8	-179.5	72.1	0	0	0	0	113.5	E65 Y66	E65-S68 WeakPolarHBondContact O-CB 3.44Å; E65-S68 PolarHBondContact O-N 3.08Å; E65-S68 PolarHBondContact O-OG 3.16Å; Y66-S68 PolarHBondContact O-N 2.99Å
69	F	92.6	Very high	95.6	Very high	27 Å²	27	62.3 Å²	62.3	12%	0.118	32%	0.316	C	S	.	.			trans	-83.6	120.1	178.2	-59.7	-69.4	0	0	0	111	E65 Y66 E74 R75 I78	E65-F69 HydrophobicContact CG-CE2 4.01Å; E65-F69 HydrophobicContact CG-CZ 4.09Å; Y66-F69 WeakPolarHBondContact O-CD2 3.16Å; Y66-F69 PolarHBondContact O-N 3.42Å; F69-E74 HydrophobicContact CD1-CG 3.69Å; F69-E74 VanDerWaalsContact CD1-OE1 3.3Å; F69-E74 WeakPolarHBondContact CD1-OE1 3.23Å; F69-E74 WeakPolarHBondContact CD1-OE2 3.22Å; F69-E74 HydrophobicContact CE1-CG 4.09Å; F69-E74 WeakPolarHBondContact CE1-OE1 3.28Å; F69-E74 HydrophobicContact CG-CG 4.2Å; F69-R75 VanDerWaalsContact O-CZ 3.26Å; F69-R75 PolarHBondContact O-NE 3.17Å; F69-R75 PolarHBondContact O-NH2 3.26Å; F69-I78 HydrophobicContact CD2-CB 4.5Å; F69-I78 HydrophobicContact CD2-CG1 4.22Å; F69-I78 HydrophobicContact CD2-CG2 4.38Å; F69-I78 HydrophobicContact CE2-CB 4.39Å; F69-I78 HydrophobicContact CE2-CG1 3.93Å; F69-I78 HydrophobicContact CE2-CG2 4Å; F69-I78 HydrophobicContact CZ-CG1 4.17Å
70	D	89.3	Confident	95.6	Very high	143 Å²	143	64.6 Å²	64.6	77%	0.765	34%	0.335	S	S	*	.			trans	-94.9	-25.3	178.6	-68.6	-39.1	0	0	0	113.2
71	C	94.1	Very high	95.6	Very high	64 Å²	64	66.6 Å²	66.6	43%	0.432	35%	0.353	S	S	.	.			trans	-73.3	127.6	178.5	179.9	0	0	0	0	111	E73 E74 R75	C71-E73 VanDerWaalsContact C-N 3.35Å; C71-E73 PolarHBondContact O-N 3.45Å; C71-E74 HydrophobicContact CB-CB 4.02Å; C71-E74 PolarHBondContact O-N 3.1Å; C71-R75 WeakPolarHBondContact O-CB 3.37Å; C71-R75 PolarHBondContact O-N 3.44Å
72	L	92.4	Very high	95.6	Very high	108 Å²	108	65.4 Å²	65.4	57%	0.565	35%	0.347	S	S	*	.	H	α-helix	trans	-61.3	-41.5	179.5	-179.5	61.5	0	0	0	112.2	R75 T76 P112	L72-R75 PolarHBondContact O-N 3.3Å; L72-T76 WeakPolarHBondContact O-CB 3.34Å; L72-T76 PolarHBondContact O-N 3.32Å; L72-T76 PolarHBondContact O-OG1 3.45Å; L72-P112 HydrophobicContact CD1-CG 4.49Å
73	E	94.3	Very high	95.6	Very high	138 Å²	138	66.3 Å²	66.3	65%	0.645	35%	0.346	S	S	*	.	H	α-helix	trans	-63.1	-49.2	-179.2	-177.2	176.6	-175.9	0	0	111.7	C71 R75 T76 Q77	C71-E73 VanDerWaalsContact C-N 3.35Å; C71-E73 PolarHBondContact O-N 3.45Å; E73-R75 VanDerWaalsContact C-N 3.34Å; E73-R75 PolarHBondContact O-N 3.01Å; E73-T76 PolarHBondContact O-N 3.09Å; E73-Q77 WeakPolarHBondContact O-CG 3.15Å; E73-Q77 PolarHBondContact O-N 2.99Å; E73-Q77 VanDerWaalsContact O-N 3.11Å
74	E	94.1	Very high	95.6	Very high	87 Å²	87	70 Å²	70	41%	0.407	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-44.8	176.4	-173.5	173.3	-153.7	0	0	110.7	F69 C71 T76 Q77 I78	F69-E74 HydrophobicContact CD1-CG 3.69Å; F69-E74 VanDerWaalsContact CD1-OE1 3.3Å; F69-E74 WeakPolarHBondContact CD1-OE1 3.23Å; F69-E74 WeakPolarHBondContact CD1-OE2 3.22Å; F69-E74 HydrophobicContact CE1-CG 4.09Å; F69-E74 WeakPolarHBondContact CE1-OE1 3.28Å; F69-E74 HydrophobicContact CG-CG 4.2Å; C71-E74 HydrophobicContact CB-CB 4.02Å; C71-E74 PolarHBondContact O-N 3.1Å; E74-T76 VanDerWaalsContact C-N 3.33Å; E74-T76 PolarHBondContact O-N 3.26Å; E74-Q77 PolarHBondContact O-N 3.46Å; E74-I78 HydrophobicContact CG-CG1 4.39Å; E74-I78 VanDerWaalsContact O-CG1 3.32Å; E74-I78 WeakPolarHBondContact O-CG1 3.38Å; E74-I78 PolarHBondContact O-N 2.93Å
75	R	95.3	Very high	95.8	Very high	34 Å²	34	68.5 Å²	68.5	13%	0.128	36%	0.358	C	S	.	.	H	α-helix	trans	-59.8	-42.8	177.9	-170.5	-179.4	-68.6	-179.6	3.8	112.1	Y66 F69 C71 L72 E73 I78 A79 P112	Y66-R75 HydrophobicContact CD2-CG 4.35Å; Y66-R75 HydrophobicContact CE1-CG 4.49Å; Y66-R75 HydrophobicContact CE2-CG 3.36Å; Y66-R75 VanDerWaalsContact CZ-CG 3.46Å; Y66-R75 WeakPolarHBondContact OH-CD 3.46Å; Y66-R75 WeakPolarHBondContact OH-CG 3.46Å; F69-R75 VanDerWaalsContact O-CZ 3.26Å; F69-R75 PolarHBondContact O-NE 3.17Å; F69-R75 PolarHBondContact O-NH2 3.26Å; C71-R75 WeakPolarHBondContact O-CB 3.37Å; C71-R75 PolarHBondContact O-N 3.44Å; L72-R75 PolarHBondContact O-N 3.3Å; E73-R75 VanDerWaalsContact C-N 3.34Å; E73-R75 PolarHBondContact O-N 3.01Å; R75-I78 PolarHBondContact O-N 3.39Å; R75-A79 WeakPolarHBondContact O-CB 3.49Å; R75-A79 PolarHBondContact O-N 3.34Å; R75-P112 WeakPolarHBondContact CD-O 3.28Å; R75-P112 HydrophobicContact CG-CB 4.42Å
76	T	96.3	Very high	95.9	Very high	62 Å²	62	62.9 Å²	62.9	38%	0.38	33%	0.331	S	S	.	.	H	α-helix	trans	-61.8	-44.3	176.4	-62.7	0	0	0	0	111.7	L72 E73 E74 A79 A80 P112	L72-T76 WeakPolarHBondContact O-CB 3.34Å; L72-T76 PolarHBondContact O-N 3.32Å; L72-T76 PolarHBondContact O-OG1 3.45Å; E73-T76 PolarHBondContact O-N 3.09Å; E74-T76 VanDerWaalsContact C-N 3.33Å; E74-T76 PolarHBondContact O-N 3.26Å; T76-A79 PolarHBondContact O-N 3.22Å; T76-A80 WeakPolarHBondContact O-CB 3.46Å; T76-A80 PolarHBondContact O-N 3.44Å; T76-P112 VanDerWaalsContact OG1-CG 3.27Å; T76-P112 WeakPolarHBondContact OG1-CG 3.45Å
77	Q	96.5	Very high	96	Very high	121 Å²	121	62.9 Å²	62.9	57%	0.565	33%	0.331	S	S	*	.	H	α-helix	trans	-63.6	-47	178	-67.9	176.2	23.7	0	0	111.8	E73 E74 A80 S81	E73-Q77 WeakPolarHBondContact O-CG 3.15Å; E73-Q77 PolarHBondContact O-N 2.99Å; E73-Q77 VanDerWaalsContact O-N 3.11Å; E74-Q77 PolarHBondContact O-N 3.46Å; Q77-A80 PolarHBondContact O-N 3.42Å; Q77-S81 PolarHBondContact O-N 3.24Å
78	I	97.7	Very high	96.1	Very high	55 Å²	55	63.6 Å²	63.6	28%	0.282	33%	0.334	S	S	.	.	H	α-helix	trans	-67.2	-39.5	178.8	-60	-60.8	0	0	0	111.1	Y66 F69 E74 R75 A80 S81 I82	Y66-I78 HydrophobicContact CD2-CB 4.35Å; Y66-I78 HydrophobicContact CD2-CG2 3.92Å; F69-I78 HydrophobicContact CD2-CB 4.5Å; F69-I78 HydrophobicContact CD2-CG1 4.22Å; F69-I78 HydrophobicContact CD2-CG2 4.38Å; F69-I78 HydrophobicContact CE2-CB 4.39Å; F69-I78 HydrophobicContact CE2-CG1 3.93Å; F69-I78 HydrophobicContact CE2-CG2 4Å; F69-I78 HydrophobicContact CZ-CG1 4.17Å; E74-I78 HydrophobicContact CG-CG1 4.39Å; E74-I78 VanDerWaalsContact O-CG1 3.32Å; E74-I78 WeakPolarHBondContact O-CG1 3.38Å; E74-I78 PolarHBondContact O-N 2.93Å; R75-I78 PolarHBondContact O-N 3.39Å; I78-A80 PolarHBondContact O-N 2.91Å; I78-S81 PolarHBondContact O-N 3.16Å; I78-I82 HydrophobicContact CG2-CD1 3.8Å; I78-I82 HydrophobicContact CG2-CG1 4.26Å; I78-I82 WeakPolarHBondContact O-CG1 3.49Å; I78-I82 PolarHBondContact O-N 2.83Å
79	A	98.1	Very high	96.3	Very high	1 Å²	1	66.6 Å²	66.6	1%	0.008	34%	0.339	C	S	.	.	H	α-helix	trans	-60.2	-45.3	176.5	0	0	0	0	0	111.6	Y66 R75 T76 I82 Y83 L109 P112 F117	Y66-A79 HydrophobicContact CE2-CB 3.77Å; R75-A79 WeakPolarHBondContact O-CB 3.49Å; R75-A79 PolarHBondContact O-N 3.34Å; T76-A79 PolarHBondContact O-N 3.22Å; A79-I82 PolarHBondContact O-N 3.31Å; A79-Y83 WeakPolarHBondContact O-CB 3.33Å; A79-Y83 PolarHBondContact O-N 3.11Å; A79-L109 HydrophobicContact CB-CD2 3.7Å; A79-P112 HydrophobicContact CB-CB 3.98Å; A79-F117 HydrophobicContact CB-CE2 4.08Å; A79-F117 HydrophobicContact CB-CZ 4.04Å
80	A	97.9	Very high	96.5	Very high	48 Å²	48	68.2 Å²	68.2	40%	0.397	36%	0.364	S	S	.	.	H	α-helix	trans	-60.9	-45.8	174.7	0	0	0	0	0	111.2	T76 Q77 I78 I82 Y83 E84	T76-A80 WeakPolarHBondContact O-CB 3.46Å; T76-A80 PolarHBondContact O-N 3.44Å; Q77-A80 PolarHBondContact O-N 3.42Å; I78-A80 PolarHBondContact O-N 2.91Å; A80-I82 PolarHBondContact O-N 3.46Å; A80-Y83 PolarHBondContact O-N 3.09Å; A80-E84 VanDerWaalsContact O-CG 3.31Å; A80-E84 WeakPolarHBondContact O-CG 3.24Å; A80-E84 PolarHBondContact O-N 3Å
81	S	98.3	Very high	96.8	Very high	69 Å²	69	61.9 Å²	61.9	48%	0.483	33%	0.33	S	S	.	.	H	α-helix	trans	-59.2	-46.2	177.5	-168.9	0	0	0	0	112.6	Q77 I78 Y83 E84 E85	Q77-S81 PolarHBondContact O-N 3.24Å; I78-S81 PolarHBondContact O-N 3.16Å; S81-Y83 VanDerWaalsContact C-N 3.32Å; S81-Y83 PolarHBondContact O-N 3.34Å; S81-E84 PolarHBondContact O-N 3.31Å; S81-E85 WeakPolarHBondContact O-CB 3.39Å; S81-E85 PolarHBondContact O-N 3.34Å
82	I	98.6	Very high	97	Very high	7 Å²	7	64 Å²	64	4%	0.036	34%	0.343	C	S	.	.	H	α-helix	trans	-62.7	-41.9	177.9	-69.3	171.6	0	0	0	110.5	F59 A62 Y66 I78 A79 A80 F86 F117	F59-I82 HydrophobicContact CD2-CG2 4.16Å; F59-I82 HydrophobicContact CE2-CG2 3.83Å; A62-I82 HydrophobicContact CB-CD1 4.12Å; A62-I82 HydrophobicContact CB-CG1 4.14Å; Y66-I82 HydrophobicContact CD2-CD1 4.14Å; Y66-I82 HydrophobicContact CG-CD1 4.2Å; I78-I82 HydrophobicContact CG2-CD1 3.8Å; I78-I82 HydrophobicContact CG2-CG1 4.26Å; I78-I82 WeakPolarHBondContact O-CG1 3.49Å; I78-I82 PolarHBondContact O-N 2.83Å; A79-I82 PolarHBondContact O-N 3.31Å; A80-I82 PolarHBondContact O-N 3.46Å; I82-F86 HydrophobicContact CG2-CD2 4.35Å; I82-F86 PolarHBondContact O-N 3.36Å; I82-F117 HydrophobicContact CB-CE1 4.29Å; I82-F117 HydrophobicContact CB-CE2 4.26Å; I82-F117 HydrophobicContact CB-CZ 3.89Å; I82-F117 HydrophobicContact CD1-CD2 4.37Å; I82-F117 HydrophobicContact CD1-CE2 4.01Å; I82-F117 HydrophobicContact CG2-CD1 4.05Å; I82-F117 HydrophobicContact CG2-CD2 4.49Å; I82-F117 HydrophobicContact CG2-CE1 3.68Å; I82-F117 HydrophobicContact CG2-CE2 4.17Å; I82-F117 HydrophobicContact CG2-CG 4.44Å; I82-F117 HydrophobicContact CG2-CZ 3.76Å
83	Y	98.6	Very high	97.3	Very high	40 Å²	40	62.3 Å²	62.3	16%	0.157	33%	0.332	C	S	.	.	I	π-helix	trans	-60.7	-47.2	178.2	-177.2	-96	0	0	0	111.5	A79 A80 S81 I87 R88 I105 R106 L109	A79-Y83 WeakPolarHBondContact O-CB 3.33Å; A79-Y83 PolarHBondContact O-N 3.11Å; A80-Y83 PolarHBondContact O-N 3.09Å; S81-Y83 VanDerWaalsContact C-N 3.32Å; S81-Y83 PolarHBondContact O-N 3.34Å; Y83-I87 HydrophobicContact CD2-CB 3.67Å; Y83-I87 HydrophobicContact CD2-CG1 4.42Å; Y83-I87 HydrophobicContact CD2-CG2 3.61Å; Y83-I87 HydrophobicContact CE2-CB 4.13Å; Y83-I87 HydrophobicContact CE2-CG2 3.64Å; Y83-I87 HydrophobicContact CG-CB 4.26Å; Y83-I87 WeakPolarHBondContact O-CA 3.25Å; Y83-I87 PolarHBondContact O-N 2.95Å; Y83-R88 HydrophobicContact CD1-CB 4.06Å; Y83-R88 HydrophobicContact CE1-CB 3.68Å; Y83-R88 HydrophobicContact CE1-CG 4.03Å; Y83-R88 PolarHBondContact O-N 2.94Å; Y83-I105 HydrophobicContact CD2-CG2 3.91Å; Y83-I105 HydrophobicContact CE2-CG2 4.43Å; Y83-R106 HydrophobicContact CE2-CB 4.11Å; Y83-R106 HydrophobicContact CE2-CG 4.39Å; Y83-L109 HydrophobicContact CD1-CD1 4.04Å; Y83-L109 HydrophobicContact CD2-CD1 3.59Å; Y83-L109 HydrophobicContact CE2-CD1 4.14Å; Y83-L109 HydrophobicContact CG-CD1 3.53Å
84	E	98.6	Very high	97.5	Very high	80 Å²	80	59.2 Å²	59.2	37%	0.374	32%	0.317	S	S	.	.	I	π-helix	trans	-72.7	-31.6	-176.6	-60.1	-65.5	-138.5	0	0	113.8	A80 S81 R88 S91	A80-E84 VanDerWaalsContact O-CG 3.31Å; A80-E84 WeakPolarHBondContact O-CG 3.24Å; A80-E84 PolarHBondContact O-N 3Å; S81-E84 PolarHBondContact O-N 3.31Å; E84-R88 IonicContact OE1-CZ 3.9Å; E84-R88 IonicContact OE1-NH1 2.86Å; E84-R88 PolarHBondContact OE1-NH1 3Å; E84-R88 WeakPolarHBondContact OE2-CD 3.23Å; E84-R88 IonicContact OE2-CZ 2.95Å; E84-R88 IonicContact OE2-NE 3.14Å; E84-R88 PolarHBondContact OE2-NE 3.24Å; E84-R88 VanDerWaalsContact OE2-NE 3.14Å; E84-R88 IonicContact OE2-NH1 2.65Å; E84-R88 PolarHBondContact OE2-NH1 3.44Å; E84-R88 IonicContact OE2-NH2 3.81Å; E84-S91 WeakPolarHBondContact O-CB 3.39Å; E84-S91 PolarHBondContact O-OG 3.5Å
85	E	98.6	Very high	97.7	Very high	63 Å²	63	55.2 Å²	55.2	29%	0.294	30%	0.299	S	S	.	.	I	π-helix	trans	-79.8	-37.2	179.2	-172.2	172.4	-179.6	0	0	112.7	S81 S91 K93	S81-E85 WeakPolarHBondContact O-CB 3.39Å; S81-E85 PolarHBondContact O-N 3.34Å; E85-S91 WeakPolarHBondContact O-CB 3.44Å; E85-K93 HydrophobicContact CG-CB 4.38Å; E85-K93 HydrophobicContact CG-CD 4.18Å; E85-K93 CarbonylContact O-C 3.45Å; E85-K93 WeakPolarHBondContact O-CA 3.35Å; E85-K93 WeakPolarHBondContact O-CB 3.48Å; E85-K93 PolarHBondContact O-N 3.4Å; E85-K93 VanDerWaalsContact O-N 3.11Å; E85-K93 WeakPolarHBondContact OE1-CD 3.39Å; E85-K93 WeakPolarHBondContact OE1-CE 3.25Å; E85-K93 IonicContact OE1-NZ 2.8Å; E85-K93 PolarHBondContact OE1-NZ 2.91Å
86	F	98.7	Very high	97.8	Very high	5 Å²	5	59.5 Å²	59.5	2%	0.022	32%	0.324	C	S	.	.	I	π-helix	trans	-124.3	-26.9	-167.8	-58.2	-80.1	0	0	0	116	E58 F59 A62 I82 K93 Q94 V95	E58-F86 HydrophobicContact CB-CE1 3.89Å; E58-F86 HydrophobicContact CB-CZ 4Å; F59-F86 HydrophobicContact CB-CB 4.35Å; F59-F86 HydrophobicContact CB-CD1 3.7Å; F59-F86 HydrophobicContact CB-CE1 4.1Å; F59-F86 HydrophobicContact CB-CG 3.96Å; F59-F86 HydrophobicContact CD2-CB 3.53Å; F59-F86 HydrophobicContact CD2-CD1 4.36Å; F59-F86 HydrophobicContact CD2-CD2 4.06Å; F59-F86 AromaticContact CD2-CG 3.74Å; F59-F86 HydrophobicContact CD2-CG 3.74Å; F59-F86 HydrophobicContact CE2-CB 4.24Å; F59-F86 HydrophobicContact CG-CB 4.24Å; F59-F86 HydrophobicContact CG-CD1 4.48Å; F59-F86 HydrophobicContact CG-CG 4.29Å; A62-F86 HydrophobicContact CB-CE2 4.42Å; I82-F86 HydrophobicContact CG2-CD2 4.35Å; I82-F86 PolarHBondContact O-N 3.36Å; F86-K93 WeakPolarHBondContact CA-O 3.43Å; F86-K93 HydrophobicContact CD1-CB 3.79Å; F86-K93 WeakPolarHBondContact CD1-O 3.39Å; F86-K93 HydrophobicContact CE1-CB 3.84Å; F86-K93 HydrophobicContact CE1-CD 3.81Å; F86-K93 HydrophobicContact CZ-CD 4.27Å; F86-Q94 WeakPolarHBondContact O-CA 3.45Å; F86-V95 HydrophobicContact CB-CG1 4.46Å; F86-V95 HydrophobicContact CB-CG2 4.46Å; F86-V95 HydrophobicContact CD1-CG1 4.33Å; F86-V95 WeakPolarHBondContact O-CG2 3.46Å; F86-V95 PolarHBondContact O-N 2.64Å
87	I	98.4	Very high	97.8	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	31%	0.308	C	S	.	.	I	π-helix	trans	-105.6	-42.9	-167.1	-55.2	-63	0	0	0	113	F59 Y83 V95 L97 R102 I105	F59-I87 HydrophobicContact CD2-CD1 4.35Å; F59-I87 HydrophobicContact CE2-CD1 3.52Å; F59-I87 HydrophobicContact CE2-CG1 4.18Å; F59-I87 HydrophobicContact CZ-CD1 3.73Å; Y83-I87 HydrophobicContact CD2-CB 3.67Å; Y83-I87 HydrophobicContact CD2-CG1 4.42Å; Y83-I87 HydrophobicContact CD2-CG2 3.61Å; Y83-I87 HydrophobicContact CE2-CB 4.13Å; Y83-I87 HydrophobicContact CE2-CG2 3.64Å; Y83-I87 HydrophobicContact CG-CB 4.26Å; Y83-I87 WeakPolarHBondContact O-CA 3.25Å; Y83-I87 PolarHBondContact O-N 2.95Å; I87-V95 HydrophobicContact CD1-CG2 4.05Å; I87-L97 HydrophobicContact CD1-CD1 3.49Å; I87-L97 VanDerWaalsContact CD1-CD1 3.49Å; I87-R102 HydrophobicContact CG2-CB 4.34Å; I87-R102 HydrophobicContact CG2-CG 4.18Å; I87-R102 VanDerWaalsContact O-CD 3.23Å; I87-R102 WeakPolarHBondContact O-CD 3.47Å; I87-I105 HydrophobicContact CD1-CD1 3.87Å; I87-I105 HydrophobicContact CG1-CD1 4.28Å; I87-I105 HydrophobicContact CG2-CB 4.43Å; I87-I105 HydrophobicContact CG2-CD1 4.12Å; I87-I105 HydrophobicContact CG2-CG2 4.27Å
88	R	97.6	Very high	97.8	Very high	101 Å²	101	54.2 Å²	54.2	38%	0.381	30%	0.297	S	S	.	.	S	Bend	trans	-57.7	144.2	-176.8	-173.6	-174.4	58.1	-155.2	-4.6	109.7	Y83 E84 G90 S91	Y83-R88 HydrophobicContact CD1-CB 4.06Å; Y83-R88 HydrophobicContact CE1-CB 3.68Å; Y83-R88 HydrophobicContact CE1-CG 4.03Å; Y83-R88 PolarHBondContact O-N 2.94Å; E84-R88 IonicContact OE1-CZ 3.9Å; E84-R88 IonicContact OE1-NH1 2.86Å; E84-R88 PolarHBondContact OE1-NH1 3Å; E84-R88 WeakPolarHBondContact OE2-CD 3.23Å; E84-R88 IonicContact OE2-CZ 2.95Å; E84-R88 IonicContact OE2-NE 3.14Å; E84-R88 PolarHBondContact OE2-NE 3.24Å; E84-R88 VanDerWaalsContact OE2-NE 3.14Å; E84-R88 IonicContact OE2-NH1 2.65Å; E84-R88 PolarHBondContact OE2-NH1 3.44Å; E84-R88 IonicContact OE2-NH2 3.81Å; R88-G90 PolarHBondContact O-N 3.09Å; R88-S91 WeakPolarHBondContact CB-OG 3.27Å; R88-S91 PolarHBondContact N-OG 3.18Å; R88-S91 WeakPolarHBondContact O-CB 3.43Å; R88-S91 PolarHBondContact O-N 3.13Å; R88-S91 PolarHBondContact O-OG 2.96Å
89	E	96.2	Very high	97.8	Very high	144 Å²	144	55.4 Å²	55.4	67%	0.673	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	129.6	174.2	-166.8	163.7	158.8	0	0	110.2	S91 R102	E89-S91 VanDerWaalsContact C-N 3.31Å; E89-R102 IonicContact OE2-NH2 2.71Å
90	G	96.2	Very high	97.8	Very high	62 Å²	62	63.1 Å²	63.1	64%	0.639	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	12.3	-172.6	0	0	0	0	0	114.4	R88	R88-G90 PolarHBondContact O-N 3.09Å
91	S	97.5	Very high	97.8	Very high	9 Å²	9	60.8 Å²	60.8	6%	0.063	32%	0.322	C	S	.	.			trans	-57.1	145.1	170.7	-81.9	0	0	0	0	111.7	E84 E85 R88 E89 K93 Q94	E84-S91 WeakPolarHBondContact O-CB 3.39Å; E84-S91 PolarHBondContact O-OG 3.5Å; E85-S91 WeakPolarHBondContact O-CB 3.44Å; R88-S91 WeakPolarHBondContact CB-OG 3.27Å; R88-S91 PolarHBondContact N-OG 3.18Å; R88-S91 WeakPolarHBondContact O-CB 3.43Å; R88-S91 PolarHBondContact O-N 3.13Å; R88-S91 PolarHBondContact O-OG 2.96Å; E89-S91 VanDerWaalsContact C-N 3.31Å; S91-K93 PolarHBondContact O-N 3.37Å; S91-K93 VanDerWaalsContact O-N 3.16Å; S91-Q94 WeakPolarHBondContact O-CB 3.36Å; S91-Q94 PolarHBondContact O-N 3.4Å
92	P	97.6	Very high	97.7	Very high	109 Å²	109	59.6 Å²	59.6	71%	0.708	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-26.5	-177.8	26.2	-35.3	0	0	0	113.2
93	K	98.2	Very high	97.7	Very high	73 Å²	73	62.7 Å²	62.7	32%	0.317	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	41.9	176.8	-62.8	-174.2	-173.2	164.9	0	111.2	E55 E58 E85 F86 S91 V95	E55-K93 HydrophobicContact CB-CB 3.86Å; E58-K93 WeakPolarHBondContact OE2-CD 3.38Å; E58-K93 WeakPolarHBondContact OE2-CE 3.48Å; E58-K93 IonicContact OE2-NZ 2.7Å; E58-K93 PolarHBondContact OE2-NZ 3.41Å; E85-K93 HydrophobicContact CG-CB 4.38Å; E85-K93 HydrophobicContact CG-CD 4.18Å; E85-K93 CarbonylContact O-C 3.45Å; E85-K93 WeakPolarHBondContact O-CA 3.35Å; E85-K93 WeakPolarHBondContact O-CB 3.48Å; E85-K93 PolarHBondContact O-N 3.4Å; E85-K93 VanDerWaalsContact O-N 3.11Å; E85-K93 WeakPolarHBondContact OE1-CD 3.39Å; E85-K93 WeakPolarHBondContact OE1-CE 3.25Å; E85-K93 IonicContact OE1-NZ 2.8Å; E85-K93 PolarHBondContact OE1-NZ 2.91Å; F86-K93 WeakPolarHBondContact CA-O 3.43Å; F86-K93 HydrophobicContact CD1-CB 3.79Å; F86-K93 WeakPolarHBondContact CD1-O 3.39Å; F86-K93 HydrophobicContact CE1-CB 3.84Å; F86-K93 HydrophobicContact CE1-CD 3.81Å; F86-K93 HydrophobicContact CZ-CD 4.27Å; S91-K93 PolarHBondContact O-N 3.37Å; S91-K93 VanDerWaalsContact O-N 3.16Å; K93-V95 PolarHBondContact O-N 2.95Å; K93-V95 VanDerWaalsContact O-N 3.17Å
94	Q	98.2	Very high	97.6	Very high	73 Å²	73	62.7 Å²	62.7	34%	0.341	33%	0.325	S	S	.	.			trans	-55.6	120.3	-176.4	-174.5	178	-15.4	0	0	111.8	F86 S91	F86-Q94 WeakPolarHBondContact O-CA 3.45Å; S91-Q94 WeakPolarHBondContact O-CB 3.36Å; S91-Q94 PolarHBondContact O-N 3.4Å
95	V	98.3	Very high	97.6	Very high	3 Å²	3	59 Å²	59	2%	0.018	31%	0.308	C	S	.	.			trans	-83.8	153.6	175.9	-67.8	0	0	0	0	111.9	E55 F59 F86 I87 K93 L97 I124	E55-V95 HydrophobicContact CG-CG1 4.03Å; F59-V95 HydrophobicContact CB-CG1 3.66Å; F59-V95 HydrophobicContact CD1-CG1 4.22Å; F59-V95 HydrophobicContact CD1-CG2 4.25Å; F59-V95 HydrophobicContact CE1-CG2 4.44Å; F59-V95 HydrophobicContact CG-CG1 3.92Å; F59-V95 HydrophobicContact CG-CG2 4.27Å; F86-V95 HydrophobicContact CB-CG1 4.46Å; F86-V95 HydrophobicContact CB-CG2 4.46Å; F86-V95 HydrophobicContact CD1-CG1 4.33Å; F86-V95 WeakPolarHBondContact O-CG2 3.46Å; F86-V95 PolarHBondContact O-N 2.64Å; I87-V95 HydrophobicContact CD1-CG2 4.05Å; K93-V95 PolarHBondContact O-N 2.95Å; K93-V95 VanDerWaalsContact O-N 3.17Å; V95-L97 HydrophobicContact CG2-CD1 3.64Å; V95-L97 HydrophobicContact CG2-CG 3.87Å; V95-L97 PolarHBondContact O-N 3.01Å; V95-I124 HydrophobicContact CB-CD1 3.77Å; V95-I124 HydrophobicContact CB-CG1 4.16Å; V95-I124 HydrophobicContact CG1-CD1 4.5Å; V95-I124 HydrophobicContact CG2-CD1 4.12Å; V95-I124 HydrophobicContact CG2-CG1 4.2Å
96	N	97.2	Very high	97.5	Very high	123 Å²	123	61 Å²	61	66%	0.658	31%	0.313	S	S	*	.			trans	-76.1	94	-178.8	-173.3	6.2	0	0	0	112	L127	N96-L127 HydrophobicContact CB-CD2 4.09Å
97	L	97.6	Very high	97.4	Very high	8 Å²	8	65.7 Å²	65.7	4%	0.042	34%	0.335	C	S	.	.			trans	-126.7	148.7	176.8	-64.5	172.7	0	0	0	110.6	I87 V95 T101 R102 A120 K123 I124	I87-L97 HydrophobicContact CD1-CD1 3.49Å; I87-L97 VanDerWaalsContact CD1-CD1 3.49Å; V95-L97 HydrophobicContact CG2-CD1 3.64Å; V95-L97 HydrophobicContact CG2-CG 3.87Å; V95-L97 PolarHBondContact O-N 3.01Å; L97-T101 HydrophobicContact CB-CG2 4.35Å; L97-T101 HydrophobicContact CD1-CG2 4.17Å; L97-T101 HydrophobicContact CD2-CG2 4.06Å; L97-T101 HydrophobicContact CG-CG2 4.43Å; L97-R102 HydrophobicContact CB-CG 4.17Å; L97-R102 PolarHBondContact O-NH1 3.19Å; L97-A120 HydrophobicContact CD1-CB 3.63Å; L97-A120 HydrophobicContact CD2-CB 3.97Å; L97-A120 HydrophobicContact CG-CB 4.48Å; L97-K123 HydrophobicContact CD2-CB 3.92Å; L97-K123 HydrophobicContact CD2-CD 4.16Å; L97-I124 HydrophobicContact CD2-CD1 3.78Å; L97-I124 HydrophobicContact CD2-CG1 4Å; L97-I124 HydrophobicContact CG-CD1 4.19Å
98	D	96.8	Very high	97.2	Very high	65 Å²	65	67.6 Å²	67.6	35%	0.348	35%	0.348	S	S	.	.			trans	-71.3	157.4	171.3	58.5	83.1	0	0	0	112.3	Y100 T101 R102 K123	D98-Y100 VanDerWaalsContact C-N 3.26Å; D98-Y100 PolarHBondContact O-N 3.47Å; D98-Y100 WeakPolarHBondContact OD1-CB 3.11Å; D98-Y100 PolarHBondContact OD1-N 3.42Å; D98-T101 VanDerWaalsContact CG-OG1 3.26Å; D98-T101 WeakPolarHBondContact O-CB 3.41Å; D98-T101 PolarHBondContact O-N 3.17Å; D98-T101 VanDerWaalsContact O-N 3.13Å; D98-T101 WeakPolarHBondContact OD1-CB 3.25Å; D98-T101 PolarHBondContact OD1-N 2.62Å; D98-T101 PolarHBondContact OD1-OG1 2.94Å; D98-T101 PolarHBondContact OD2-OG1 3.14Å; D98-R102 PolarHBondContact O-N 3.34Å; D98-R102 VanDerWaalsContact O-N 3.12Å; D98-K123 WeakPolarHBondContact OD2-CE 3.41Å; D98-K123 IonicContact OD2-NZ 3.48Å; D98-K123 PolarHBondContact OD2-NZ 3.13Å
99	S	96.9	Very high	97.1	Very high	80 Å²	80	64.7 Å²	64.7	56%	0.559	34%	0.34	S	S	*	.	H	α-helix	trans	-59.9	-34.5	-176.8	-51.9	0	0	0	0	113.2	R102 E103	S99-R102 PolarHBondContact O-N 3.33Å; S99-R102 PolarHBondContact OG-NH2 3.02Å; S99-E103 WeakPolarHBondContact O-CB 3.45Å; S99-E103 PolarHBondContact O-N 2.92Å
100	Y	97.2	Very high	96.9	Very high	162 Å²	162	65.7 Å²	65.7	64%	0.635	35%	0.345	S	S	*	.	H	α-helix	trans	-63.2	-43.5	176.9	169.1	-98.3	0	0	0	111.4	D98 E103 T104 M119	D98-Y100 VanDerWaalsContact C-N 3.26Å; D98-Y100 PolarHBondContact O-N 3.47Å; D98-Y100 WeakPolarHBondContact OD1-CB 3.11Å; D98-Y100 PolarHBondContact OD1-N 3.42Å; Y100-E103 PolarHBondContact O-N 2.81Å; Y100-T104 WeakPolarHBondContact O-CB 3.32Å; Y100-T104 PolarHBondContact O-N 3.2Å; Y100-T104 PolarHBondContact O-OG1 2.93Å; Y100-M119 HydrophobicContact CD1-CE 4.41Å; Y100-M119 HydrophobicContact CE1-CE 4.06Å; Y100-M119 HydrophobicContact CE1-SD 4.29Å
101	T	97.6	Very high	96.7	Very high	0 Å²	0	70.7 Å²	70.7	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-63.2	-44	176.3	-59.3	0	0	0	0	111.9	L97 D98 E103 T104 I105 M119 A120 K123	L97-T101 HydrophobicContact CB-CG2 4.35Å; L97-T101 HydrophobicContact CD1-CG2 4.17Å; L97-T101 HydrophobicContact CD2-CG2 4.06Å; L97-T101 HydrophobicContact CG-CG2 4.43Å; D98-T101 VanDerWaalsContact CG-OG1 3.26Å; D98-T101 WeakPolarHBondContact O-CB 3.41Å; D98-T101 PolarHBondContact O-N 3.17Å; D98-T101 VanDerWaalsContact O-N 3.13Å; D98-T101 WeakPolarHBondContact OD1-CB 3.25Å; D98-T101 PolarHBondContact OD1-N 2.62Å; D98-T101 PolarHBondContact OD1-OG1 2.94Å; D98-T101 PolarHBondContact OD2-OG1 3.14Å; T101-E103 PolarHBondContact O-N 2.71Å; T101-T104 PolarHBondContact O-N 3.33Å; T101-I105 HydrophobicContact CG2-CD1 4.27Å; T101-I105 WeakPolarHBondContact O-CG1 3.33Å; T101-I105 PolarHBondContact O-N 2.84Å; T101-I105 VanDerWaalsContact O-N 3.13Å; T101-M119 HydrophobicContact CG2-CE 3.98Å; T101-M119 HydrophobicContact CG2-CG 4.46Å; T101-A120 HydrophobicContact CG2-CB 3.93Å; T101-K123 HydrophobicContact CG2-CD 4.11Å; T101-K123 WeakPolarHBondContact OG1-CE 3.37Å
102	R	97.9	Very high	96.5	Very high	43 Å²	43	70.5 Å²	70.5	16%	0.162	35%	0.35	C	S	.	.	H	α-helix	trans	-62	-43.4	177.2	-65.2	-163.7	-60	-88.9	9.2	112.1	I87 E89 L97 D98 S99 I105 R106	I87-R102 HydrophobicContact CG2-CB 4.34Å; I87-R102 HydrophobicContact CG2-CG 4.18Å; I87-R102 VanDerWaalsContact O-CD 3.23Å; I87-R102 WeakPolarHBondContact O-CD 3.47Å; E89-R102 IonicContact OE2-NH2 2.71Å; L97-R102 HydrophobicContact CB-CG 4.17Å; L97-R102 PolarHBondContact O-NH1 3.19Å; D98-R102 PolarHBondContact O-N 3.34Å; D98-R102 VanDerWaalsContact O-N 3.12Å; S99-R102 PolarHBondContact O-N 3.33Å; S99-R102 PolarHBondContact OG-NH2 3.02Å; R102-I105 PolarHBondContact O-N 2.98Å; R102-R106 PolarHBondContact O-N 3.23Å
103	E	97.2	Very high	96.4	Very high	72 Å²	72	66.7 Å²	66.7	34%	0.336	33%	0.331	S	S	.	.	H	α-helix	trans	-67.7	-38.9	179.5	-179	56	-159	0	0	112.1	S99 Y100 T101 I105 R106 Q107	S99-E103 WeakPolarHBondContact O-CB 3.45Å; S99-E103 PolarHBondContact O-N 2.92Å; Y100-E103 PolarHBondContact O-N 2.81Å; T101-E103 PolarHBondContact O-N 2.71Å; E103-I105 VanDerWaalsContact C-N 3.3Å; E103-I105 PolarHBondContact O-N 3.31Å; E103-R106 WeakPolarHBondContact O-CB 3.45Å; E103-R106 PolarHBondContact O-N 2.98Å; E103-R106 IonicContact OE1-CZ 3.4Å; E103-R106 IonicContact OE1-NE 3.24Å; E103-R106 PolarHBondContact OE1-NE 3.42Å; E103-R106 IonicContact OE1-NH2 2.74Å; E103-R106 PolarHBondContact OE1-NH2 3.38Å; E103-R106 IonicContact OE2-CZ 3.33Å; E103-R106 IonicContact OE2-NE 2.86Å; E103-R106 PolarHBondContact OE2-NE 3.06Å; E103-R106 IonicContact OE2-NH2 4Å; E103-Q107 WeakPolarHBondContact O-CG 3.49Å; E103-Q107 PolarHBondContact O-N 3.3Å; E103-Q107 PolarHBondContact OE1-NE2 3.43Å
104	T	97.1	Very high	96.2	Very high	41 Å²	41	66 Å²	66	25%	0.252	34%	0.335	S	S	.	.	H	α-helix	trans	-60.1	-42.2	175.4	-57.7	0	0	0	0	111.3	Y100 T101 S108 M119	Y100-T104 WeakPolarHBondContact O-CB 3.32Å; Y100-T104 PolarHBondContact O-N 3.2Å; Y100-T104 PolarHBondContact O-OG1 2.93Å; T101-T104 PolarHBondContact O-N 3.33Å; T104-S108 WeakPolarHBondContact O-CB 3.43Å; T104-S108 PolarHBondContact O-N 3.31Å; T104-S108 VanDerWaalsContact O-N 3.11Å; T104-S108 PolarHBondContact O-OG 3Å; T104-M119 HydrophobicContact CG2-CE 3.86Å
105	I	97.9	Very high	96	Very high	3 Å²	3	66.6 Å²	66.6	2%	0.015	35%	0.347	C	S	.	.	H	α-helix	trans	-64.7	-48.1	174.7	-68	167	0	0	0	110.1	Y83 I87 T101 R102 E103 Q107 S108 L109 F117 A120	Y83-I105 HydrophobicContact CD2-CG2 3.91Å; Y83-I105 HydrophobicContact CE2-CG2 4.43Å; I87-I105 HydrophobicContact CD1-CD1 3.87Å; I87-I105 HydrophobicContact CG1-CD1 4.28Å; I87-I105 HydrophobicContact CG2-CB 4.43Å; I87-I105 HydrophobicContact CG2-CD1 4.12Å; I87-I105 HydrophobicContact CG2-CG2 4.27Å; T101-I105 HydrophobicContact CG2-CD1 4.27Å; T101-I105 WeakPolarHBondContact O-CG1 3.33Å; T101-I105 PolarHBondContact O-N 2.84Å; T101-I105 VanDerWaalsContact O-N 3.13Å; R102-I105 PolarHBondContact O-N 2.98Å; E103-I105 VanDerWaalsContact C-N 3.3Å; E103-I105 PolarHBondContact O-N 3.31Å; I105-Q107 PolarHBondContact O-N 3.02Å; I105-S108 WeakPolarHBondContact O-CA 3.37Å; I105-S108 WeakPolarHBondContact O-CB 3.49Å; I105-S108 PolarHBondContact O-N 3.43Å; I105-L109 WeakPolarHBondContact O-CG 3.5Å; I105-L109 PolarHBondContact O-N 3.32Å; I105-L109 VanDerWaalsContact O-N 3.13Å; I105-F117 HydrophobicContact CD1-CD1 4.21Å; I105-F117 HydrophobicContact CG1-CD1 4.43Å; I105-F117 HydrophobicContact CG2-CD1 3.96Å; I105-F117 HydrophobicContact CG2-CE1 3.58Å; I105-A120 HydrophobicContact CD1-CB 3.6Å
106	R	97.2	Very high	95.9	Very high	103 Å²	103	67 Å²	67	39%	0.389	35%	0.35	S	S	.	.	H	α-helix	trans	-53.8	-43	-179.1	-167.4	-164.3	69.4	71	2.6	111.9	Y83 R102 E103 L109	Y83-R106 HydrophobicContact CE2-CB 4.11Å; Y83-R106 HydrophobicContact CE2-CG 4.39Å; R102-R106 PolarHBondContact O-N 3.23Å; E103-R106 WeakPolarHBondContact O-CB 3.45Å; E103-R106 PolarHBondContact O-N 2.98Å; E103-R106 IonicContact OE1-CZ 3.4Å; E103-R106 IonicContact OE1-NE 3.24Å; E103-R106 PolarHBondContact OE1-NE 3.42Å; E103-R106 IonicContact OE1-NH2 2.74Å; E103-R106 PolarHBondContact OE1-NH2 3.38Å; E103-R106 IonicContact OE2-CZ 3.33Å; E103-R106 IonicContact OE2-NE 2.86Å; E103-R106 PolarHBondContact OE2-NE 3.06Å; E103-R106 IonicContact OE2-NH2 4Å; R106-L109 PolarHBondContact O-N 2.99Å
107	Q	96.5	Very high	96	Very high	104 Å²	104	61.2 Å²	61.2	49%	0.486	32%	0.319	S	S	.	.	H	α-helix	trans	-67.8	-38.3	176.1	-67.4	172.2	3.3	0	0	112.1	E103 I105 L109 E110	E103-Q107 WeakPolarHBondContact O-CG 3.49Å; E103-Q107 PolarHBondContact O-N 3.3Å; E103-Q107 PolarHBondContact OE1-NE2 3.43Å; I105-Q107 PolarHBondContact O-N 3.02Å; Q107-L109 PolarHBondContact O-N 3.33Å; Q107-E110 PolarHBondContact O-N 3.18Å
108	S	95.1	Very high	95.9	Very high	42 Å²	42	62.8 Å²	62.8	29%	0.294	33%	0.333	S	S	.	.	H	α-helix	trans	-68.1	-14.6	178.7	-57.3	0	0	0	0	113.6	T104 I105 E110 E111 P112	T104-S108 WeakPolarHBondContact O-CB 3.43Å; T104-S108 PolarHBondContact O-N 3.31Å; T104-S108 VanDerWaalsContact O-N 3.11Å; T104-S108 PolarHBondContact O-OG 3Å; I105-S108 WeakPolarHBondContact O-CA 3.37Å; I105-S108 WeakPolarHBondContact O-CB 3.49Å; I105-S108 PolarHBondContact O-N 3.43Å; S108-E110 VanDerWaalsContact C-N 3.27Å; S108-E110 PolarHBondContact O-N 2.92Å; S108-E111 CarbonylContact O-C 3.27Å; S108-E111 VanDerWaalsContact O-C 3.27Å; S108-P112 VanDerWaalsContact O-CA 3.32Å; S108-P112 WeakPolarHBondContact O-CA 3.4Å
109	L	95.1	Very high	96	Very high	40 Å²	40	63 Å²	63	21%	0.209	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-16.1	176.8	-65.4	177.7	0	0	0	113.7	A79 Y83 I105 R106 Q107 E111 F117	A79-L109 HydrophobicContact CB-CD2 3.7Å; Y83-L109 HydrophobicContact CD1-CD1 4.04Å; Y83-L109 HydrophobicContact CD2-CD1 3.59Å; Y83-L109 HydrophobicContact CE2-CD1 4.14Å; Y83-L109 HydrophobicContact CG-CD1 3.53Å; I105-L109 WeakPolarHBondContact O-CG 3.5Å; I105-L109 PolarHBondContact O-N 3.32Å; I105-L109 VanDerWaalsContact O-N 3.13Å; R106-L109 PolarHBondContact O-N 2.99Å; Q107-L109 PolarHBondContact O-N 3.33Å; L109-E111 VanDerWaalsContact C-N 3.34Å; L109-F117 HydrophobicContact CD2-CZ 4.34Å
110	E	92.1	Very high	96	Very high	164 Å²	164	59.3 Å²	59.3	77%	0.766	31%	0.307	S	S	*	.	S	Bend	trans	-66.9	-38.1	175.6	-66.2	179.9	-169.6	0	0	111.4	Q107 S108	Q107-E110 PolarHBondContact O-N 3.18Å; S108-E110 VanDerWaalsContact C-N 3.27Å; S108-E110 PolarHBondContact O-N 2.92Å
111	E	92.2	Very high	96.1	Very high	167 Å²	167	52.4 Å²	52.4	78%	0.78	28%	0.281	S	S	*	.	S	Bend	trans	-137.7	83.1	173.8	-168.3	177.7	177.5	0	0	109.5	S108 L109 G113	S108-E111 CarbonylContact O-C 3.27Å; S108-E111 VanDerWaalsContact O-C 3.27Å; L109-E111 VanDerWaalsContact C-N 3.34Å; E111-G113 PolarHBondContact O-N 3.08Å
112	P	93.4	Very high	96.1	Very high	6 Å²	6	61 Å²	61	4%	0.039	31%	0.313	C	S	.	.			trans	-69.8	105.2	-169.4	22.8	-28.7	0	0	0	112	Y66 L72 R75 T76 A79 S108	Y66-P112 WeakPolarHBondContact OH-CB 3.42Å; L72-P112 HydrophobicContact CD1-CG 4.49Å; R75-P112 WeakPolarHBondContact CD-O 3.28Å; R75-P112 HydrophobicContact CG-CB 4.42Å; T76-P112 VanDerWaalsContact OG1-CG 3.27Å; T76-P112 WeakPolarHBondContact OG1-CG 3.45Å; A79-P112 HydrophobicContact CB-CB 3.98Å; S108-P112 VanDerWaalsContact O-CA 3.32Å; S108-P112 WeakPolarHBondContact O-CA 3.4Å
113	G	94.4	Very high	96.1	Very high	29 Å²	29	63 Å²	63	30%	0.299	32%	0.323	S	S	.	.			trans	-79	165.9	169.9	0	0	0	0	0	112.9	Y66 E111 S115 C116	Y66-G113 VanDerWaalsContact CE1-O 3.28Å; Y66-G113 WeakPolarHBondContact CE1-O 3.47Å; Y66-G113 PolarHBondContact OH-O 3.19Å; E111-G113 PolarHBondContact O-N 3.08Å; G113-S115 PolarHBondContact O-N 3.26Å; G113-C116 WeakPolarHBondContact O-CB 3.31Å; G113-C116 PolarHBondContact O-N 3.45Å; G113-C116 VanDerWaalsContact O-N 3.08Å
114	S	93.8	Very high	96.2	Very high	58 Å²	58	59.5 Å²	59.5	41%	0.406	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-21.7	175.8	56.6	0	0	0	0	112.4	R67	R67-S114 VanDerWaalsContact CG-O 3.28Å; R67-S114 WeakPolarHBondContact CG-O 3.42Å
115	S	94.9	Very high	96.2	Very high	85 Å²	85	59.2 Å²	59.2	59%	0.594	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	3.3	176.1	54.1	0	0	0	0	114.6	G113 F117 A118	G113-S115 PolarHBondContact O-N 3.26Å; S115-F117 PolarHBondContact O-N 3.01Å; S115-A118 WeakPolarHBondContact O-CB 3.5Å; S115-A118 PolarHBondContact O-N 2.88Å
116	C	96.6	Very high	96.2	Very high	11 Å²	11	62.3 Å²	62.3	7%	0.074	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-39.6	-174.8	-175.8	0	0	0	0	113.5	Y66 G113	Y66-C116 HydrophobicContact CE1-CB 3.96Å; G113-C116 WeakPolarHBondContact O-CB 3.31Å; G113-C116 PolarHBondContact O-N 3.45Å; G113-C116 VanDerWaalsContact O-N 3.08Å
117	F	98.1	Very high	96.2	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.009	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	4.2	-178.8	-55.4	-73.6	0	0	0	114.6	C63 Y66 A79 I82 I105 L109 S115 M119 A120 E121	C63-F117 HydrophobicContact CB-CB 4.33Å; C63-F117 VanDerWaalsContact SG-CB 3.52Å; Y66-F117 AromaticContact CD1-CD2 3.62Å; Y66-F117 HydrophobicContact CD1-CD2 3.62Å; Y66-F117 HydrophobicContact CD1-CE2 4.04Å; Y66-F117 HydrophobicContact CD2-CD2 4.28Å; Y66-F117 AromaticContact CD2-CE2 3.9Å; Y66-F117 HydrophobicContact CD2-CE2 3.9Å; Y66-F117 AromaticContact CE1-CD2 3.74Å; Y66-F117 HydrophobicContact CE1-CD2 3.74Å; Y66-F117 AromaticContact CE1-CE2 3.95Å; Y66-F117 HydrophobicContact CE1-CE2 3.95Å; Y66-F117 HydrophobicContact CE2-CD2 4.38Å; Y66-F117 AromaticContact CE2-CE2 3.81Å; Y66-F117 HydrophobicContact CE2-CE2 3.81Å; Y66-F117 AromaticContact CG-CD2 3.88Å; Y66-F117 HydrophobicContact CG-CD2 3.88Å; Y66-F117 AromaticContact CG-CE2 3.99Å; Y66-F117 HydrophobicContact CG-CE2 3.99Å; Y66-F117 AromaticContact CZ-CE2 3.83Å; A79-F117 HydrophobicContact CB-CE2 4.08Å; A79-F117 HydrophobicContact CB-CZ 4.04Å; I82-F117 HydrophobicContact CB-CE1 4.29Å; I82-F117 HydrophobicContact CB-CE2 4.26Å; I82-F117 HydrophobicContact CB-CZ 3.89Å; I82-F117 HydrophobicContact CD1-CD2 4.37Å; I82-F117 HydrophobicContact CD1-CE2 4.01Å; I82-F117 HydrophobicContact CG2-CD1 4.05Å; I82-F117 HydrophobicContact CG2-CD2 4.49Å; I82-F117 HydrophobicContact CG2-CE1 3.68Å; I82-F117 HydrophobicContact CG2-CE2 4.17Å; I82-F117 HydrophobicContact CG2-CG 4.44Å; I82-F117 HydrophobicContact CG2-CZ 3.76Å; I105-F117 HydrophobicContact CD1-CD1 4.21Å; I105-F117 HydrophobicContact CG1-CD1 4.43Å; I105-F117 HydrophobicContact CG2-CD1 3.96Å; I105-F117 HydrophobicContact CG2-CE1 3.58Å; L109-F117 HydrophobicContact CD2-CZ 4.34Å; S115-F117 PolarHBondContact O-N 3.01Å; F117-M119 VanDerWaalsContact C-N 3.3Å; F117-M119 PolarHBondContact O-N 2.94Å; F117-A120 PolarHBondContact O-N 3.22Å; F117-A120 VanDerWaalsContact O-N 3.14Å; F117-E121 WeakPolarHBondContact O-CB 3.45Å; F117-E121 PolarHBondContact O-N 2.97Å
118	A	96.9	Very high	96.3	Very high	42 Å²	42	54.9 Å²	54.9	35%	0.347	29%	0.289	S	S	.	.	H	α-helix	trans	-59.1	-38.1	-169.1	0	0	0	0	0	113.4	S115 R122	S115-A118 WeakPolarHBondContact O-CB 3.5Å; S115-A118 PolarHBondContact O-N 2.88Å; A118-R122 PolarHBondContact O-N 3.02Å
119	M	97.4	Very high	96.4	Very high	70 Å²	70	56 Å²	56	35%	0.345	29%	0.289	S	S	.	.	H	α-helix	trans	-68.2	-46	177.5	179.5	167.3	62.9	0	0	112.1	Y100 T101 T104 F117 R122 K123	Y100-M119 HydrophobicContact CD1-CE 4.41Å; Y100-M119 HydrophobicContact CE1-CE 4.06Å; Y100-M119 HydrophobicContact CE1-SD 4.29Å; T101-M119 HydrophobicContact CG2-CE 3.98Å; T101-M119 HydrophobicContact CG2-CG 4.46Å; T104-M119 HydrophobicContact CG2-CE 3.86Å; F117-M119 VanDerWaalsContact C-N 3.3Å; F117-M119 PolarHBondContact O-N 2.94Å; M119-R122 PolarHBondContact O-N 2.69Å; M119-K123 HydrophobicContact CG-CD 4.31Å; M119-K123 WeakPolarHBondContact O-CG 3.37Å; M119-K123 PolarHBondContact O-N 3.12Å; M119-K123 VanDerWaalsContact O-N 3.1Å
120	A	98.2	Very high	96.4	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.008	31%	0.307	C	S	.	.	H	α-helix	trans	-68.1	-42.9	178.8	0	0	0	0	0	112	F59 L97 T101 I105 F117 R122 K123 I124	F59-A120 HydrophobicContact CE1-CB 3.97Å; F59-A120 HydrophobicContact CZ-CB 3.7Å; L97-A120 HydrophobicContact CD1-CB 3.63Å; L97-A120 HydrophobicContact CD2-CB 3.97Å; L97-A120 HydrophobicContact CG-CB 4.48Å; T101-A120 HydrophobicContact CG2-CB 3.93Å; I105-A120 HydrophobicContact CD1-CB 3.6Å; F117-A120 PolarHBondContact O-N 3.22Å; F117-A120 VanDerWaalsContact O-N 3.14Å; A120-R122 VanDerWaalsContact C-N 3.26Å; A120-R122 PolarHBondContact O-N 3.31Å; A120-K123 PolarHBondContact O-N 3.34Å; A120-K123 VanDerWaalsContact O-N 3.11Å; A120-I124 WeakPolarHBondContact O-CG1 3.47Å; A120-I124 PolarHBondContact O-N 3.27Å
121	E	98.2	Very high	96.5	Very high	17 Å²	17	54.1 Å²	54.1	8%	0.079	29%	0.288	C	S	.	.	H	α-helix	trans	-53.5	-46.3	174.9	-179	-169.3	156.7	0	0	111.1	W60 C63 K64 R67 F117 I124 F125	W60-E121 VanDerWaalsContact CD1-CG 3.44Å; W60-E121 HydrophobicContact CG-CG 4.32Å; C63-E121 HydrophobicContact CB-CB 3.91Å; C63-E121 HydrophobicContact CB-CG 3.88Å; K64-E121 WeakPolarHBondContact CD-OE1 3.46Å; R67-E121 IonicContact CZ-OE1 3.01Å; R67-E121 IonicContact CZ-OE2 3.79Å; R67-E121 IonicContact NH1-OE1 2.71Å; R67-E121 PolarHBondContact NH1-OE1 3.13Å; R67-E121 IonicContact NH1-OE2 2.83Å; R67-E121 PolarHBondContact NH1-OE2 3.32Å; R67-E121 IonicContact NH2-OE1 3.92Å; R67-E121 PolarHBondContact NH2-OE1 3.24Å; R67-E121 IonicContact NH2-OE2 3.28Å; R67-E121 PolarHBondContact NH2-OE2 2.93Å; F117-E121 WeakPolarHBondContact O-CB 3.45Å; F117-E121 PolarHBondContact O-N 2.97Å; E121-I124 PolarHBondContact O-N 3.35Å; E121-F125 WeakPolarHBondContact O-CB 3.42Å; E121-F125 PolarHBondContact O-N 3.14Å
122	R	97.8	Very high	96.7	Very high	182 Å²	182	46.6 Å²	46.6	69%	0.687	26%	0.255	S	S	*	.	H	α-helix	trans	-63.6	-43.4	178.1	-173.3	176.2	-171.8	166.3	3.7	112	A118 M119 A120 F125 I126	A118-R122 PolarHBondContact O-N 3.02Å; M119-R122 PolarHBondContact O-N 2.69Å; A120-R122 VanDerWaalsContact C-N 3.26Å; A120-R122 PolarHBondContact O-N 3.31Å; R122-F125 PolarHBondContact O-N 2.96Å; R122-I126 HydrophobicContact CG-CD1 3.94Å; R122-I126 VanDerWaalsContact O-CG1 3.3Å; R122-I126 WeakPolarHBondContact O-CG1 3.49Å; R122-I126 PolarHBondContact O-N 3.46Å
123	K	98.4	Very high	96.8	Very high	83 Å²	83	46.9 Å²	46.9	36%	0.361	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-45.9	177.7	-78.2	170.5	170.8	-88.5	0	111.5	L97 D98 T101 M119 A120 I126 L127	L97-K123 HydrophobicContact CD2-CB 3.92Å; L97-K123 HydrophobicContact CD2-CD 4.16Å; D98-K123 WeakPolarHBondContact OD2-CE 3.41Å; D98-K123 IonicContact OD2-NZ 3.48Å; D98-K123 PolarHBondContact OD2-NZ 3.13Å; T101-K123 HydrophobicContact CG2-CD 4.11Å; T101-K123 WeakPolarHBondContact OG1-CE 3.37Å; M119-K123 HydrophobicContact CG-CD 4.31Å; M119-K123 WeakPolarHBondContact O-CG 3.37Å; M119-K123 PolarHBondContact O-N 3.12Å; M119-K123 VanDerWaalsContact O-N 3.1Å; A120-K123 PolarHBondContact O-N 3.34Å; A120-K123 VanDerWaalsContact O-N 3.11Å; K123-I126 PolarHBondContact O-N 3.41Å; K123-L127 WeakPolarHBondContact O-CB 3.35Å; K123-L127 PolarHBondContact O-N 2.88Å
124	I	98.5	Very high	96.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-70.3	-35.8	179.4	-62.1	-51.7	0	0	0	111.9	N56 F59 V95 L97 A120 E121 L127 M128	N56-I124 HydrophobicContact CB-CG2 3.63Å; N56-I124 VanDerWaalsContact O-CG2 3.27Å; N56-I124 WeakPolarHBondContact O-CG2 3.47Å; F59-I124 HydrophobicContact CD1-CB 3.96Å; F59-I124 HydrophobicContact CD1-CG1 3.66Å; F59-I124 HydrophobicContact CD1-CG2 4.07Å; F59-I124 HydrophobicContact CE1-CB 4.22Å; F59-I124 HydrophobicContact CE1-CG1 3.73Å; V95-I124 HydrophobicContact CB-CD1 3.77Å; V95-I124 HydrophobicContact CB-CG1 4.16Å; V95-I124 HydrophobicContact CG1-CD1 4.5Å; V95-I124 HydrophobicContact CG2-CD1 4.12Å; V95-I124 HydrophobicContact CG2-CG1 4.2Å; L97-I124 HydrophobicContact CD2-CD1 3.78Å; L97-I124 HydrophobicContact CD2-CG1 4Å; L97-I124 HydrophobicContact CG-CD1 4.19Å; A120-I124 WeakPolarHBondContact O-CG1 3.47Å; A120-I124 PolarHBondContact O-N 3.27Å; E121-I124 PolarHBondContact O-N 3.35Å; I124-L127 HydrophobicContact CD1-CD2 4.16Å; I124-L127 WeakPolarHBondContact O-CB 3.49Å; I124-L127 PolarHBondContact O-N 2.97Å; I124-M128 HydrophobicContact CG2-CE 4.3Å; I124-M128 WeakPolarHBondContact O-CG 3.49Å; I124-M128 PolarHBondContact O-N 3.37Å
125	F	98.3	Very high	96.9	Very high	34 Å²	34	50.9 Å²	50.9	15%	0.149	26%	0.26	C	S	.	.	H	α-helix	trans	-59.3	-50.4	171.5	-177.8	-89.5	0	0	0	111.6	L31 E32 L35 W60 E121 R122 L127 M128 E129	L31-F125 HydrophobicContact CB-CE2 4.22Å; L31-F125 HydrophobicContact CB-CZ 3.98Å; L31-F125 HydrophobicContact CD2-CD2 4.01Å; L31-F125 HydrophobicContact CD2-CE2 3.76Å; L31-F125 HydrophobicContact CD2-CZ 4.05Å; L31-F125 HydrophobicContact CG-CE2 3.84Å; L31-F125 HydrophobicContact CG-CZ 4.1Å; E32-F125 HydrophobicContact CB-CZ 4.35Å; L35-F125 HydrophobicContact CD1-CD2 4.28Å; L35-F125 HydrophobicContact CD1-CE2 4.04Å; W60-F125 AromaticContact CE2-CD2 3.87Å; W60-F125 HydrophobicContact CZ2-CD2 4.18Å; W60-F125 HydrophobicContact CZ2-CE2 4.38Å; W60-F125 AromaticContact NE1-CD2 3.48Å; E121-F125 WeakPolarHBondContact O-CB 3.42Å; E121-F125 PolarHBondContact O-N 3.14Å; R122-F125 PolarHBondContact O-N 2.96Å; F125-L127 VanDerWaalsContact C-N 3.29Å; F125-L127 PolarHBondContact O-N 3.04Å; F125-M128 PolarHBondContact O-N 2.88Å; F125-E129 HydrophobicContact CE1-CB 4.39Å; F125-E129 WeakPolarHBondContact O-CB 3.29Å; F125-E129 PolarHBondContact O-N 3.34Å
126	I	97.6	Very high	97	Very high	68 Å²	68	46.9 Å²	46.9	35%	0.349	23%	0.232	S	C	.	.	H	α-helix	trans	-62.2	-38	178.6	-68.8	168.6	0	0	0	111	R122 K123 E129 N130	R122-I126 HydrophobicContact CG-CD1 3.94Å; R122-I126 VanDerWaalsContact O-CG1 3.3Å; R122-I126 WeakPolarHBondContact O-CG1 3.49Å; R122-I126 PolarHBondContact O-N 3.46Å; K123-I126 PolarHBondContact O-N 3.41Å; I126-E129 PolarHBondContact O-N 2.97Å; I126-N130 VanDerWaalsContact CG2-ND2 3.32Å; I126-N130 WeakPolarHBondContact CG2-ND2 3.45Å; I126-N130 WeakPolarHBondContact O-CB 3.21Å; I126-N130 PolarHBondContact O-N 3.43Å
127	L	97.4	Very high	96.8	Very high	49 Å²	49	48.3 Å²	48.3	26%	0.257	24%	0.24	S	C	.	.	H	α-helix	trans	-59.1	-51	174.5	179.2	68	0	0	0	111	N96 K123 I124 F125 E129 C131	N96-L127 HydrophobicContact CB-CD2 4.09Å; K123-L127 WeakPolarHBondContact O-CB 3.35Å; K123-L127 PolarHBondContact O-N 2.88Å; I124-L127 HydrophobicContact CD1-CD2 4.16Å; I124-L127 WeakPolarHBondContact O-CB 3.49Å; I124-L127 PolarHBondContact O-N 2.97Å; F125-L127 VanDerWaalsContact C-N 3.29Å; F125-L127 PolarHBondContact O-N 3.04Å; L127-E129 VanDerWaalsContact C-N 3.34Å; L127-E129 PolarHBondContact O-N 3.41Å; L127-C131 WeakPolarHBondContact O-CB 3.36Å; L127-C131 PolarHBondContact O-N 3.11Å
128	M	97.8	Very high	96.6	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.01	27%	0.273	C	S	.	.	I	π-helix	trans	-61.6	-43.1	176.5	-70.7	-170.9	-70.5	0	0	111.7	L31 F44 L48 N56 L57 W60 I124 F125 N130 S132 F133	L31-M128 HydrophobicContact CD2-CB 3.75Å; F44-M128 HydrophobicContact CE1-CB 4.35Å; F44-M128 HydrophobicContact CE1-SD 3.86Å; F44-M128 HydrophobicContact CZ-CB 4.28Å; L48-M128 HydrophobicContact CD1-SD 4.17Å; N56-M128 HydrophobicContact CB-CG 3.67Å; N56-M128 HydrophobicContact CB-SD 3.75Å; L57-M128 HydrophobicContact CB-SD 3.94Å; W60-M128 HydrophobicContact CB-CE 3.84Å; W60-M128 HydrophobicContact CG-CE 4.09Å; I124-M128 HydrophobicContact CG2-CE 4.3Å; I124-M128 WeakPolarHBondContact O-CG 3.49Å; I124-M128 PolarHBondContact O-N 3.37Å; F125-M128 PolarHBondContact O-N 2.88Å; M128-N130 PolarHBondContact O-N 2.9Å; M128-S132 PolarHBondContact O-N 3.3Å; M128-S132 VanDerWaalsContact O-N 3.13Å; M128-F133 VanDerWaalsContact O-CB 3.25Å; M128-F133 WeakPolarHBondContact O-CB 3.37Å; M128-F133 PolarHBondContact O-N 2.9Å
129	E	96.9	Very high	96.4	Very high	66 Å²	66	54.9 Å²	54.9	31%	0.308	27%	0.266	S	S	.	.	I	π-helix	trans	-63.8	-38.7	-177.9	-175.4	169.5	-120.6	0	0	112.9	L31 F125 I126 L127 P134	L31-E129 HydrophobicContact CD2-CB 3.98Å; F125-E129 HydrophobicContact CE1-CB 4.39Å; F125-E129 WeakPolarHBondContact O-CB 3.29Å; F125-E129 PolarHBondContact O-N 3.34Å; I126-E129 PolarHBondContact O-N 2.97Å; L127-E129 VanDerWaalsContact C-N 3.34Å; L127-E129 PolarHBondContact O-N 3.41Å; E129-P134 VanDerWaalsContact O-CD 3.27Å; E129-P134 WeakPolarHBondContact O-CD 3.24Å
130	N	95	Very high	96.3	Very high	108 Å²	108	56.8 Å²	56.8	58%	0.578	27%	0.274	S	S	*	.	I	π-helix	trans	-92.2	-25.3	-177.1	-68.4	-20.4	0	0	0	113.3	I126 M128	I126-N130 VanDerWaalsContact CG2-ND2 3.32Å; I126-N130 WeakPolarHBondContact CG2-ND2 3.45Å; I126-N130 WeakPolarHBondContact O-CB 3.21Å; I126-N130 PolarHBondContact O-N 3.43Å; M128-N130 PolarHBondContact O-N 2.9Å
131	C	94.8	Very high	96	Very high	56 Å²	56	59.9 Å²	59.9	38%	0.378	29%	0.294	S	S	.	.	I	π-helix	trans	-101.6	-67.8	-176	-62.3	0	0	0	0	111.9	L127 R135	L127-C131 WeakPolarHBondContact O-CB 3.36Å; L127-C131 PolarHBondContact O-N 3.11Å; C131-R135 PolarHBondContact O-NH1 3.31Å; C131-R135 PolarHBondContact O-NH2 3.35Å
132	S	95.7	Very high	95.8	Very high	10 Å²	10	59.5 Å²	59.5	7%	0.07	29%	0.292	C	S	.	.	I	π-helix	trans	-85.5	-34	-169.7	-66.7	0	0	0	0	113.4	F47 L48 E51 M128 R135 F136	F47-S132 VanDerWaalsContact CE1-O 3.31Å; F47-S132 WeakPolarHBondContact CE1-O 3.37Å; L48-S132 VanDerWaalsContact CD2-CB 3.48Å; E51-S132 WeakPolarHBondContact OE2-CB 3.32Å; E51-S132 PolarHBondContact OE2-OG 2.74Å; M128-S132 PolarHBondContact O-N 3.3Å; M128-S132 VanDerWaalsContact O-N 3.13Å; S132-R135 PolarHBondContact O-N 3.01Å; S132-F136 PolarHBondContact O-N 3.32Å
133	F	96.5	Very high	95.5	Very high	12 Å²	12	55.5 Å²	55.5	5%	0.053	28%	0.28	C	S	.	.	H	α-helix	trans	-62.8	-42.5	-176.7	-176.5	-113.2	0	0	0	114	D29 L31 V34 F44 M128 R135 F136 T137 Y142	D29-F133 VanDerWaalsContact O-CE1 3.26Å; D29-F133 WeakPolarHBondContact O-CE1 3.39Å; L31-F133 HydrophobicContact CB-CD1 4.13Å; L31-F133 HydrophobicContact CB-CD2 4.11Å; L31-F133 HydrophobicContact CB-CE1 4.34Å; L31-F133 HydrophobicContact CB-CE2 4.33Å; L31-F133 HydrophobicContact CB-CG 4.01Å; L31-F133 HydrophobicContact CB-CZ 4.44Å; L31-F133 HydrophobicContact CD1-CB 4.42Å; L31-F133 HydrophobicContact CD1-CD2 3.71Å; L31-F133 HydrophobicContact CD1-CE2 4.27Å; L31-F133 HydrophobicContact CD1-CG 4.16Å; L31-F133 HydrophobicContact CG-CD2 4.48Å; V34-F133 HydrophobicContact CG2-CE2 3.86Å; V34-F133 HydrophobicContact CG2-CZ 4.4Å; F44-F133 HydrophobicContact CE2-CB 4.49Å; F44-F133 HydrophobicContact CE2-CD2 4.45Å; F44-F133 HydrophobicContact CZ-CB 4.43Å; M128-F133 VanDerWaalsContact O-CB 3.25Å; M128-F133 WeakPolarHBondContact O-CB 3.37Å; M128-F133 PolarHBondContact O-N 2.9Å; F133-R135 PolarHBondContact O-N 2.8Å; F133-F136 HydrophobicContact CD2-CD1 4.01Å; F133-F136 HydrophobicContact CE2-CD1 4.11Å; F133-F136 WeakPolarHBondContact O-CB 3.35Å; F133-F136 PolarHBondContact O-N 3.03Å; F133-F136 VanDerWaalsContact O-N 3.08Å; F133-T137 HydrophobicContact CD1-CG2 4.38Å; F133-T137 HydrophobicContact CD2-CG2 4.33Å; F133-T137 HydrophobicContact CE1-CG2 3.91Å; F133-T137 HydrophobicContact CE2-CG2 3.85Å; F133-T137 HydrophobicContact CZ-CG2 3.62Å; F133-T137 WeakPolarHBondContact O-CG2 3.48Å; F133-T137 PolarHBondContact O-N 3.49Å; F133-Y142 HydrophobicContact CE2-CE2 4.32Å; F133-Y142 HydrophobicContact CZ-CE2 4.46Å
134	P	95.3	Very high	95.2	Very high	57 Å²	57	56.4 Å²	56.4	37%	0.37	29%	0.288	S	S	.	.	H	α-helix	trans	-62.3	-32.8	178.3	-23.4	36.1	0	0	0	112.7	E129 T137	E129-P134 VanDerWaalsContact O-CD 3.27Å; E129-P134 WeakPolarHBondContact O-CD 3.24Å; P134-T137 PolarHBondContact O-OG1 2.85Å
135	R	95.1	Very high	94.8	Very high	114 Å²	114	56.8 Å²	56.8	43%	0.43	29%	0.289	S	S	.	.	H	α-helix	trans	-76.1	-37.7	174.1	-66.6	-169.6	-61.2	-76.1	-7	111.6	F47 E51 C131 S132 F133 T137 E138 T139	F47-R135 HydrophobicContact CZ-CB 3.8Å; E51-R135 VanDerWaalsContact CD-NH2 3.27Å; E51-R135 IonicContact OE1-CZ 3.79Å; E51-R135 VanDerWaalsContact OE1-CZ 3.28Å; E51-R135 IonicContact OE1-NE 2.62Å; E51-R135 PolarHBondContact OE1-NE 3.08Å; E51-R135 IonicContact OE1-NH2 3.07Å; E51-R135 PolarHBondContact OE1-NH2 3.03Å; E51-R135 IonicContact OE2-CZ 3.62Å; E51-R135 IonicContact OE2-NE 2.93Å; E51-R135 IonicContact OE2-NH2 3.85Å; E51-R135 PolarHBondContact OE2-NH2 3.18Å; C131-R135 PolarHBondContact O-NH1 3.31Å; C131-R135 PolarHBondContact O-NH2 3.35Å; S132-R135 PolarHBondContact O-N 3.01Å; F133-R135 PolarHBondContact O-N 2.8Å; R135-T137 VanDerWaalsContact C-N 3.28Å; R135-T137 PolarHBondContact O-N 3.14Å; R135-E138 PolarHBondContact O-N 3.16Å; R135-T139 WeakPolarHBondContact O-CG2 3.38Å
136	F	95.8	Very high	94.4	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59	-38.8	175.8	175.4	-118.8	0	0	0	112.3	V34 A43 F44 F47 S132 F133 E138 T139 P141 Y142	V34-F136 HydrophobicContact CG1-CE1 3.99Å; V34-F136 HydrophobicContact CG2-CE1 4.43Å; A43-F136 HydrophobicContact CB-CE2 4.31Å; A43-F136 HydrophobicContact CB-CZ 3.98Å; F44-F136 HydrophobicContact CB-CE1 4.08Å; F44-F136 HydrophobicContact CB-CE2 4.49Å; F44-F136 HydrophobicContact CB-CZ 4.07Å; F44-F136 HydrophobicContact CD2-CB 3.92Å; F44-F136 AromaticContact CD2-CD1 3.52Å; F44-F136 HydrophobicContact CD2-CD1 3.52Å; F44-F136 AromaticContact CD2-CD2 3.98Å; F44-F136 HydrophobicContact CD2-CD2 3.98Å; F44-F136 AromaticContact CD2-CE1 3.93Å; F44-F136 HydrophobicContact CD2-CE1 3.93Å; F44-F136 HydrophobicContact CD2-CE2 4.37Å; F44-F136 AromaticContact CD2-CG 3.53Å; F44-F136 HydrophobicContact CD2-CG 3.53Å; F44-F136 HydrophobicContact CD2-CZ 4.35Å; F44-F136 HydrophobicContact CE2-CB 3.87Å; F44-F136 HydrophobicContact CE2-CD1 4.11Å; F44-F136 HydrophobicContact CE2-CG 4.01Å; F44-F136 HydrophobicContact CG-CD1 4.37Å; F44-F136 HydrophobicContact CG-CE1 4.38Å; F47-F136 HydrophobicContact CB-CD2 3.6Å; F47-F136 HydrophobicContact CB-CE2 4.02Å; F47-F136 HydrophobicContact CD1-CB 3.77Å; F47-F136 HydrophobicContact CD1-CD2 4.04Å; F47-F136 HydrophobicContact CD1-CG 4.26Å; F47-F136 HydrophobicContact CD2-CB 4.49Å; F47-F136 HydrophobicContact CD2-CD2 4.06Å; F47-F136 HydrophobicContact CE1-CB 3.81Å; F47-F136 HydrophobicContact CG-CB 4.13Å; F47-F136 AromaticContact CG-CD2 3.62Å; F47-F136 HydrophobicContact CG-CD2 3.62Å; F47-F136 HydrophobicContact CG-CG 4.29Å; F47-F136 HydrophobicContact CZ-CB 4.2Å; S132-F136 PolarHBondContact O-N 3.32Å; F133-F136 HydrophobicContact CD2-CD1 4.01Å; F133-F136 HydrophobicContact CE2-CD1 4.11Å; F133-F136 WeakPolarHBondContact O-CB 3.35Å; F133-F136 PolarHBondContact O-N 3.03Å; F133-F136 VanDerWaalsContact O-N 3.08Å; F136-E138 PolarHBondContact O-N 3.36Å; F136-T139 WeakPolarHBondContact O-CB 3.46Å; F136-T139 WeakPolarHBondContact O-CG2 3.26Å; F136-T139 PolarHBondContact O-N 2.71Å; F136-T139 PolarHBondContact O-OG1 3.36Å; F136-P141 HydrophobicContact CE2-CB 4.48Å; F136-Y142 AromaticContact CD1-CD2 3.88Å; F136-Y142 HydrophobicContact CD1-CD2 3.88Å; F136-Y142 HydrophobicContact CD1-CG 4.44Å; F136-Y142 AromaticContact CE1-CD2 3.51Å; F136-Y142 HydrophobicContact CE1-CD2 3.51Å; F136-Y142 HydrophobicContact CE1-CE2 4.4Å; F136-Y142 HydrophobicContact CE1-CG 4.23Å; F136-Y142 HydrophobicContact CZ-CD2 4.19Å; F136-Y142 VanDerWaalsContact O-CB 3.26Å; F136-Y142 WeakPolarHBondContact O-CB 3.32Å
137	T	93.6	Very high	93.9	Very high	41 Å²	41	58.2 Å²	58.2	25%	0.252	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-21.1	-179.2	60.1	0	0	0	0	113.6	F133 P134 R135 T139 Y142	F133-T137 HydrophobicContact CD1-CG2 4.38Å; F133-T137 HydrophobicContact CD2-CG2 4.33Å; F133-T137 HydrophobicContact CE1-CG2 3.91Å; F133-T137 HydrophobicContact CE2-CG2 3.85Å; F133-T137 HydrophobicContact CZ-CG2 3.62Å; F133-T137 WeakPolarHBondContact O-CG2 3.48Å; F133-T137 PolarHBondContact O-N 3.49Å; P134-T137 PolarHBondContact O-OG1 2.85Å; R135-T137 VanDerWaalsContact C-N 3.28Å; R135-T137 PolarHBondContact O-N 3.14Å; T137-T139 VanDerWaalsContact C-N 3.32Å; T137-Y142 VanDerWaalsContact CA-CD1 3.42Å; T137-Y142 HydrophobicContact CG2-CD1 4.28Å; T137-Y142 HydrophobicContact CG2-CD2 4.42Å; T137-Y142 HydrophobicContact CG2-CE1 3.8Å; T137-Y142 HydrophobicContact CG2-CE2 3.98Å; T137-Y142 WeakPolarHBondContact O-CD1 3.4Å
138	E	92.6	Very high	93.4	Very high	149 Å²	149	57.9 Å²	57.9	70%	0.696	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-16.5	176.1	-61.3	-178.8	-179.2	0	0	112.8	R135 F136 K143	R135-E138 PolarHBondContact O-N 3.16Å; F136-E138 PolarHBondContact O-N 3.36Å; E138-K143 WeakPolarHBondContact O-CE 3.19Å; E138-K143 PolarHBondContact O-NZ 2.88Å
139	T	94.6	Very high	92.8	Very high	34 Å²	34	58.8 Å²	58.8	21%	0.209	31%	0.305	C	S	.	.	S	Bend	trans	-78.6	153.8	-173.6	73.9	0	0	0	0	113.6	F47 R135 F136 T137 Y142 K143	F47-T139 HydrophobicContact CD2-CG2 3.82Å; F47-T139 HydrophobicContact CE2-CG2 3.7Å; R135-T139 WeakPolarHBondContact O-CG2 3.38Å; F136-T139 WeakPolarHBondContact O-CB 3.46Å; F136-T139 WeakPolarHBondContact O-CG2 3.26Å; F136-T139 PolarHBondContact O-N 2.71Å; F136-T139 PolarHBondContact O-OG1 3.36Å; T137-T139 VanDerWaalsContact C-N 3.32Å; T139-Y142 PolarHBondContact O-N 3.45Å; T139-K143 PolarHBondContact O-N 2.88Å
140	E	94.5	Very high	92.3	Very high	110 Å²	110	58 Å²	58	51%	0.514	31%	0.308	S	S	.	.	H	α-helix	trans	-61.5	-41.7	175.7	-170.8	61.2	-161.9	0	0	113.6	Y142 K143 L144	E140-Y142 VanDerWaalsContact C-N 3.26Å; E140-Y142 PolarHBondContact O-N 3.21Å; E140-K143 PolarHBondContact O-N 3.31Å; E140-K143 VanDerWaalsContact O-N 3.13Å; E140-L144 HydrophobicContact CG-CD1 4.21Å; E140-L144 HydrophobicContact CG-CG 4.33Å; E140-L144 WeakPolarHBondContact O-CG 3.43Å; E140-L144 PolarHBondContact O-N 3.1Å
141	P	92.6	Very high	91.7	Very high	66 Å²	66	59.7 Å²	59.7	43%	0.429	31%	0.31	S	S	.	.	H	α-helix	trans	-52.8	-39.7	173.8	-29.5	37	0	0	0	114.2	A43 F136 F145	A43-P141 HydrophobicContact CB-CB 4.36Å; F136-P141 HydrophobicContact CE2-CB 4.48Å; P141-F145 WeakPolarHBondContact O-CB 3.46Å; P141-F145 PolarHBondContact O-N 2.91Å
142	Y	93.1	Very high	91.1	Very high	9 Å²	9	61.4 Å²	61.4	4%	0.035	31%	0.312	C	S	.	.	H	α-helix	trans	-67	-44.6	176.9	177.7	-104.1	0	0	0	112.3	G28 D29 V34 F133 F136 T137 T139 E140 L144 F145 L146	G28-Y142 PolarHBondContact O-OH 3.48Å; D29-Y142 PolarHBondContact OD1-OH 3.21Å; V34-Y142 HydrophobicContact CG2-CD2 4.3Å; V34-Y142 HydrophobicContact CG2-CE2 3.81Å; F133-Y142 HydrophobicContact CE2-CE2 4.32Å; F133-Y142 HydrophobicContact CZ-CE2 4.46Å; F136-Y142 AromaticContact CD1-CD2 3.88Å; F136-Y142 HydrophobicContact CD1-CD2 3.88Å; F136-Y142 HydrophobicContact CD1-CG 4.44Å; F136-Y142 AromaticContact CE1-CD2 3.51Å; F136-Y142 HydrophobicContact CE1-CD2 3.51Å; F136-Y142 HydrophobicContact CE1-CE2 4.4Å; F136-Y142 HydrophobicContact CE1-CG 4.23Å; F136-Y142 HydrophobicContact CZ-CD2 4.19Å; F136-Y142 VanDerWaalsContact O-CB 3.26Å; F136-Y142 WeakPolarHBondContact O-CB 3.32Å; T137-Y142 VanDerWaalsContact CA-CD1 3.42Å; T137-Y142 HydrophobicContact CG2-CD1 4.28Å; T137-Y142 HydrophobicContact CG2-CD2 4.42Å; T137-Y142 HydrophobicContact CG2-CE1 3.8Å; T137-Y142 HydrophobicContact CG2-CE2 3.98Å; T137-Y142 WeakPolarHBondContact O-CD1 3.4Å; T139-Y142 PolarHBondContact O-N 3.45Å; E140-Y142 VanDerWaalsContact C-N 3.26Å; E140-Y142 PolarHBondContact O-N 3.21Å; Y142-L144 VanDerWaalsContact C-N 3.32Å; Y142-L144 PolarHBondContact O-N 3.12Å; Y142-F145 HydrophobicContact CD2-CD1 4.46Å; Y142-F145 WeakPolarHBondContact O-CB 3.42Å; Y142-F145 PolarHBondContact O-N 2.83Å; Y142-F145 VanDerWaalsContact O-N 3.14Å; Y142-L146 HydrophobicContact CD1-CD1 3.89Å; Y142-L146 HydrophobicContact CD1-CG 4.21Å; Y142-L146 HydrophobicContact CE1-CD1 3.25Å; Y142-L146 HydrophobicContact CE1-CD2 4.46Å; Y142-L146 HydrophobicContact CE1-CG 3.82Å; Y142-L146 HydrophobicContact CE2-CD1 4.42Å; Y142-L146 HydrophobicContact CE2-CD2 4.23Å; Y142-L146 HydrophobicContact CE2-CG 4.17Å; Y142-L146 PolarHBondContact O-N 3.2Å
143	K	91.7	Very high	90.4	Very high	98 Å²	98	67.1 Å²	67.1	43%	0.426	33%	0.332	S	S	.	.	H	α-helix	trans	-60.5	-42.7	177.3	-64.5	171	-168.5	164	0	111.5	E138 T139 E140 L146 N147	E138-K143 WeakPolarHBondContact O-CE 3.19Å; E138-K143 PolarHBondContact O-NZ 2.88Å; T139-K143 PolarHBondContact O-N 2.88Å; E140-K143 PolarHBondContact O-N 3.31Å; E140-K143 VanDerWaalsContact O-N 3.13Å; K143-L146 PolarHBondContact O-N 3.09Å; K143-N147 WeakPolarHBondContact O-CB 3.31Å; K143-N147 VanDerWaalsContact O-CG 3.26Å; K143-N147 PolarHBondContact O-N 3.05Å; K143-N147 PolarHBondContact O-ND2 2.69Å
144	L	91.8	Very high	89.9	Confident	101 Å²	101	70.3 Å²	70.3	53%	0.529	35%	0.35	S	S	.	.	H	α-helix	trans	-62.9	-42.5	174.5	-68	176	0	0	0	111.8	E140 Y142 N147 S148	E140-L144 HydrophobicContact CG-CD1 4.21Å; E140-L144 HydrophobicContact CG-CG 4.33Å; E140-L144 WeakPolarHBondContact O-CG 3.43Å; E140-L144 PolarHBondContact O-N 3.1Å; Y142-L144 VanDerWaalsContact C-N 3.32Å; Y142-L144 PolarHBondContact O-N 3.12Å; L144-N147 PolarHBondContact O-N 2.96Å; L144-S148 PolarHBondContact O-N 3.37Å
145	F	90.6	Very high	89.3	Confident	8 Å²	8	72.8 Å²	72.8	4%	0.035	36%	0.359	C	S	.	.	H	α-helix	trans	-58.4	-52.7	174.1	167.1	-101.3	0	0	0	111.5	V34 Q37 G40 P141 Y142 N147 S148 I149	V34-F145 HydrophobicContact CB-CE1 4.44Å; V34-F145 HydrophobicContact CG2-CD1 4.37Å; V34-F145 HydrophobicContact CG2-CE1 3.86Å; Q37-F145 HydrophobicContact CB-CE2 3.68Å; Q37-F145 HydrophobicContact CB-CZ 3.93Å; Q37-F145 HydrophobicContact CG-CE2 4Å; Q37-F145 HydrophobicContact CG-CZ 3.88Å; G40-F145 VanDerWaalsContact CA-CE2 3.49Å; P141-F145 WeakPolarHBondContact O-CB 3.46Å; P141-F145 PolarHBondContact O-N 2.91Å; Y142-F145 HydrophobicContact CD2-CD1 4.46Å; Y142-F145 WeakPolarHBondContact O-CB 3.42Å; Y142-F145 PolarHBondContact O-N 2.83Å; Y142-F145 VanDerWaalsContact O-N 3.14Å; F145-N147 VanDerWaalsContact C-N 3.32Å; F145-N147 PolarHBondContact O-N 2.71Å; F145-S148 WeakPolarHBondContact O-CB 3.42Å; F145-S148 PolarHBondContact O-N 3.35Å; F145-S148 PolarHBondContact O-OG 3.21Å; F145-I149 HydrophobicContact CD2-CG1 4.24Å; F145-I149 HydrophobicContact CE1-CG1 4.06Å; F145-I149 HydrophobicContact CE2-CD1 3.78Å; F145-I149 HydrophobicContact CE2-CG1 3.71Å; F145-I149 HydrophobicContact CZ-CD1 3.96Å; F145-I149 HydrophobicContact CZ-CG1 3.63Å; F145-I149 WeakPolarHBondContact O-CG1 3.15Å; F145-I149 PolarHBondContact O-N 3.08Å; F145-I149 VanDerWaalsContact O-N 3.08Å
146	L	89.1	Confident	88.6	Confident	41 Å²	41	73.7 Å²	73.7	22%	0.215	37%	0.366	C	S	.	.	H	α-helix	trans	-57.4	-44.8	179.3	-73.9	-174.8	0	0	0	112.2	Y142 K143 S148 I149 S150	Y142-L146 HydrophobicContact CD1-CD1 3.89Å; Y142-L146 HydrophobicContact CD1-CG 4.21Å; Y142-L146 HydrophobicContact CE1-CD1 3.25Å; Y142-L146 HydrophobicContact CE1-CD2 4.46Å; Y142-L146 HydrophobicContact CE1-CG 3.82Å; Y142-L146 HydrophobicContact CE2-CD1 4.42Å; Y142-L146 HydrophobicContact CE2-CD2 4.23Å; Y142-L146 HydrophobicContact CE2-CG 4.17Å; Y142-L146 PolarHBondContact O-N 3.2Å; K143-L146 PolarHBondContact O-N 3.09Å; L146-S148 VanDerWaalsContact C-N 3.26Å; L146-S148 PolarHBondContact O-N 3.04Å; L146-I149 PolarHBondContact O-N 2.94Å; L146-I149 VanDerWaalsContact O-N 3.16Å; L146-S150 PolarHBondContact O-N 3.01Å; L146-S150 PolarHBondContact O-OG 3.29Å
147	N	87.8	Confident	87.9	Confident	92 Å²	92	79.5 Å²	79.5	49%	0.492	39%	0.392	S	S	.	.	H	α-helix	trans	-59.6	-37.5	176.4	-75.8	-29.1	0	0	0	112.2	K143 L144 F145 K151	K143-N147 WeakPolarHBondContact O-CB 3.31Å; K143-N147 VanDerWaalsContact O-CG 3.26Å; K143-N147 PolarHBondContact O-N 3.05Å; K143-N147 PolarHBondContact O-ND2 2.69Å; L144-N147 PolarHBondContact O-N 2.96Å; F145-N147 VanDerWaalsContact C-N 3.32Å; F145-N147 PolarHBondContact O-N 2.71Å; N147-K151 WeakPolarHBondContact O-CG 3.32Å; N147-K151 PolarHBondContact O-N 2.83Å
148	S	87.3	Confident	87.4	Confident	41 Å²	41	84.3 Å²	84.3	29%	0.287	41%	0.409	S	S	.	.	H	α-helix	trans	-66.7	-40.4	176.8	82.2	0	0	0	0	112.2	L144 F145 L146 K151 Q152	L144-S148 PolarHBondContact O-N 3.37Å; F145-S148 WeakPolarHBondContact O-CB 3.42Å; F145-S148 PolarHBondContact O-N 3.35Å; F145-S148 PolarHBondContact O-OG 3.21Å; L146-S148 VanDerWaalsContact C-N 3.26Å; L146-S148 PolarHBondContact O-N 3.04Å; S148-K151 PolarHBondContact O-N 3.37Å; S148-Q152 WeakPolarHBondContact O-CG 3.26Å; S148-Q152 PolarHBondContact O-N 3.01Å
149	I	85.6	Confident	86.9	Confident	21 Å²	21	85.9 Å²	85.9	11%	0.108	41%	0.409	C	S	.	.	H	α-helix	trans	-66.2	-44.7	179.1	-64.1	-59.6	0	0	0	110.9	Q37 F145 L146 K151 Q152 R153	Q37-I149 HydrophobicContact CG-CD1 3.79Å; F145-I149 HydrophobicContact CD2-CG1 4.24Å; F145-I149 HydrophobicContact CE1-CG1 4.06Å; F145-I149 HydrophobicContact CE2-CD1 3.78Å; F145-I149 HydrophobicContact CE2-CG1 3.71Å; F145-I149 HydrophobicContact CZ-CD1 3.96Å; F145-I149 HydrophobicContact CZ-CG1 3.63Å; F145-I149 WeakPolarHBondContact O-CG1 3.15Å; F145-I149 PolarHBondContact O-N 3.08Å; F145-I149 VanDerWaalsContact O-N 3.08Å; L146-I149 PolarHBondContact O-N 2.94Å; L146-I149 VanDerWaalsContact O-N 3.16Å; I149-K151 PolarHBondContact O-N 3.13Å; I149-Q152 PolarHBondContact O-N 3.02Å; I149-R153 WeakPolarHBondContact O-CG 3.25Å; I149-R153 PolarHBondContact O-N 3.21Å
150	S	84.8	Confident	86.2	Confident	51 Å²	51	90.7 Å²	90.7	36%	0.357	43%	0.43	S	S	.	.	H	α-helix	trans	-58.5	-48.8	176.4	-65.2	0	0	0	0	111.7	L146 Q152 R153 D154	L146-S150 PolarHBondContact O-N 3.01Å; L146-S150 PolarHBondContact O-OG 3.29Å; S150-Q152 PolarHBondContact O-N 3.43Å; S150-R153 PolarHBondContact O-N 2.82Å; S150-D154 PolarHBondContact O-N 3.3Å; S150-D154 VanDerWaalsContact O-N 3.09Å
151	K	83.3	Confident	85.4	Confident	142 Å²	142	87.8 Å²	87.8	62%	0.617	43%	0.425	S	S	*	.	H	α-helix	trans	-58.6	-47.8	176.6	-72.6	174.4	-177.8	177.8	0	111.9	N147 S148 I149 R153 D154 L155	N147-K151 WeakPolarHBondContact O-CG 3.32Å; N147-K151 PolarHBondContact O-N 2.83Å; S148-K151 PolarHBondContact O-N 3.37Å; I149-K151 PolarHBondContact O-N 3.13Å; K151-R153 VanDerWaalsContact C-N 3.28Å; K151-R153 PolarHBondContact O-N 2.94Å; K151-D154 PolarHBondContact O-N 3.47Å; K151-L155 HydrophobicContact CB-CD1 4.48Å; K151-L155 WeakPolarHBondContact O-CD1 3.46Å; K151-L155 PolarHBondContact O-N 3.19Å
152	Q	82.6	Confident	84.3	Confident	93 Å²	93	90.7 Å²	90.7	44%	0.435	44%	0.435	S	S	.	.	H	α-helix	trans	-59.1	-38.6	179	-75.5	-172.6	9.5	0	0	112.6	S148 I149 S150 K156	S148-Q152 WeakPolarHBondContact O-CG 3.26Å; S148-Q152 PolarHBondContact O-N 3.01Å; I149-Q152 PolarHBondContact O-N 3.02Å; S150-Q152 PolarHBondContact O-N 3.43Å; Q152-K156 WeakPolarHBondContact O-CG 3.46Å; Q152-K156 PolarHBondContact O-N 3.39Å
153	R	80.7	Confident	83.3	Confident	129 Å²	129	100.9 Å²	100.9	49%	0.487	47%	0.473	S	S	.	.	H	α-helix	trans	-65.3	-43.3	176.9	-70.8	174.8	76.5	148.6	1	111.6	I149 S150 K151 K156 K157	I149-R153 WeakPolarHBondContact O-CG 3.25Å; I149-R153 PolarHBondContact O-N 3.21Å; S150-R153 PolarHBondContact O-N 2.82Å; K151-R153 VanDerWaalsContact C-N 3.28Å; K151-R153 PolarHBondContact O-N 2.94Å; R153-K156 PolarHBondContact O-N 2.92Å; R153-K157 WeakPolarHBondContact O-CG 3.35Å; R153-K157 PolarHBondContact O-N 3.49Å
154	D	85.3	Confident	82	Confident	79 Å²	79	103.3 Å²	103.3	42%	0.422	49%	0.489	S	S	.	.	H	α-helix	trans	-65.9	-39.8	178.5	-68.3	-22.5	0	0	0	112.3	S150 K151 K157 K158	S150-D154 PolarHBondContact O-N 3.3Å; S150-D154 VanDerWaalsContact O-N 3.09Å; K151-D154 PolarHBondContact O-N 3.47Å; D154-K157 PolarHBondContact O-N 2.92Å; D154-K157 IonicContact OD1-NZ 2.69Å; D154-K158 WeakPolarHBondContact O-CG 3.4Å; D154-K158 PolarHBondContact O-N 3.36Å
155	L	82.3	Confident	80.5	Confident	109 Å²	109	106.7 Å²	106.7	57%	0.571	50%	0.5	S	S	*	.	H	α-helix	trans	-61.4	-44	171.8	-86.3	117.2	0	0	0	111.8	K151 K158 R159	K151-L155 HydrophobicContact CB-CD1 4.48Å; K151-L155 WeakPolarHBondContact O-CD1 3.46Å; K151-L155 PolarHBondContact O-N 3.19Å; L155-K158 PolarHBondContact O-N 2.85Å; L155-R159 VanDerWaalsContact O-CG 3.25Å; L155-R159 WeakPolarHBondContact O-CG 3.32Å; L155-R159 PolarHBondContact O-N 3.22Å
156	K	81.6	Confident	78.3	Confident	133 Å²	133	110.8 Å²	110.8	58%	0.578	53%	0.529	S	S	*	.	H	α-helix	trans	-61.7	-43.8	175.9	-76.4	178	-179.9	179.3	0	111.8	Q152 R153 R159 M160	Q152-K156 WeakPolarHBondContact O-CG 3.46Å; Q152-K156 PolarHBondContact O-N 3.39Å; R153-K156 PolarHBondContact O-N 2.92Å; K156-R159 PolarHBondContact O-N 2.93Å; K156-M160 PolarHBondContact O-N 3.25Å
157	K	81.6	Confident	76.7	Confident	122 Å²	122	113.8 Å²	113.8	53%	0.53	55%	0.551	S	S	.	*	H	α-helix	trans	-60	-47.9	175.9	-72.5	174	-176.9	171.9	0	111.9	R153 D154 R159 M160 A161	R153-K157 WeakPolarHBondContact O-CG 3.35Å; R153-K157 PolarHBondContact O-N 3.49Å; D154-K157 PolarHBondContact O-N 2.92Å; D154-K157 IonicContact OD1-NZ 2.69Å; K157-R159 VanDerWaalsContact C-N 3.34Å; K157-R159 PolarHBondContact O-N 3.49Å; K157-M160 PolarHBondContact O-N 3.27Å; K157-A161 PolarHBondContact O-N 3.39Å
158	K	82.5	Confident	74.8	Confident	143 Å²	143	115.6 Å²	115.6	62%	0.622	57%	0.565	S	S	*	*	H	α-helix	trans	-59.4	-43.1	176.7	-73.6	177.3	-179	-179.6	0	111.7	D154 L155 A161 M162	D154-K158 WeakPolarHBondContact O-CG 3.4Å; D154-K158 PolarHBondContact O-N 3.36Å; L155-K158 PolarHBondContact O-N 2.85Å; K158-A161 PolarHBondContact O-N 3Å; K158-M162 WeakPolarHBondContact O-CE 3.27Å; K158-M162 WeakPolarHBondContact O-CG 3.46Å; K158-M162 PolarHBondContact O-N 2.69Å
159	R	81.6	Confident	72.9	Confident	181 Å²	181	121.9 Å²	121.9	68%	0.683	59%	0.59	S	S	*	*	H	α-helix	trans	-62.4	-43.2	177.2	-71.8	172	74.1	120.5	2.3	112.6	L155 K156 K157 M162 R163	L155-R159 VanDerWaalsContact O-CG 3.25Å; L155-R159 WeakPolarHBondContact O-CG 3.32Å; L155-R159 PolarHBondContact O-N 3.22Å; K156-R159 PolarHBondContact O-N 2.93Å; K157-R159 VanDerWaalsContact C-N 3.34Å; K157-R159 PolarHBondContact O-N 3.49Å; R159-M162 HydrophobicContact CG-CE 4.47Å; R159-M162 PolarHBondContact O-N 3Å; R159-R163 PolarHBondContact O-N 2.71Å; R159-R163 VanDerWaalsContact O-N 3.16Å
160	M	80.2	Confident	70.9	Confident	135 Å²	135	127.9 Å²	127.9	67%	0.665	62%	0.622	S	S	*	*	H	α-helix	trans	-65.2	-43.2	176.2	-69.5	-158	-166.7	0	0	112	K156 K157 M162 R163 I164	K156-M160 PolarHBondContact O-N 3.25Å; K157-M160 PolarHBondContact O-N 3.27Å; M160-M162 VanDerWaalsContact C-N 3.27Å; M160-M162 PolarHBondContact O-N 2.77Å; M160-R163 PolarHBondContact O-N 3.35Å; M160-R163 VanDerWaalsContact O-N 3.1Å; M160-I164 WeakPolarHBondContact O-CG1 3.4Å; M160-I164 PolarHBondContact O-N 2.88Å
161	A	77.1	Confident	69	Low	50 Å²	50	135 Å²	135	41%	0.413	65%	0.647	S	S	.	*	H	α-helix	trans	-62.1	-33.5	177.8	0	0	0	0	0	112.9	K157 K158 K165	K157-A161 PolarHBondContact O-N 3.39Å; K158-A161 PolarHBondContact O-N 3Å; A161-K165 WeakPolarHBondContact O-CG 3.3Å
162	M	70.5	Confident	67.3	Low	127 Å²	127	137.9 Å²	137.9	63%	0.626	66%	0.66	S	S	*	*	H	α-helix	trans	-70.4	-37.4	173.1	-74.8	-175.5	-76.1	0	0	112.4	K158 R159 M160 I164 K165	K158-M162 WeakPolarHBondContact O-CE 3.27Å; K158-M162 WeakPolarHBondContact O-CG 3.46Å; K158-M162 PolarHBondContact O-N 2.69Å; R159-M162 HydrophobicContact CG-CE 4.47Å; R159-M162 PolarHBondContact O-N 3Å; M160-M162 VanDerWaalsContact C-N 3.27Å; M160-M162 PolarHBondContact O-N 2.77Å; M162-I164 VanDerWaalsContact C-N 3.34Å; M162-I164 PolarHBondContact O-N 2.89Å; M162-K165 PolarHBondContact O-N 3.03Å
163	R	71.8	Confident	65.7	Low	223 Å²	223	139.5 Å²	139.5	84%	0.842	68%	0.676	S	S	*	*	H	α-helix	trans	-69.6	-28.9	-179.2	-166.6	163.7	-179.6	119.3	-4.7	113.5	R159 M160 K165	R159-R163 PolarHBondContact O-N 2.71Å; R159-R163 VanDerWaalsContact O-N 3.16Å; M160-R163 PolarHBondContact O-N 3.35Å; M160-R163 VanDerWaalsContact O-N 3.1Å; R163-K165 VanDerWaalsContact C-N 3.33Å
164	I	64.5	Low	63.8	Low	148 Å²	148	140 Å²	140	76%	0.759	69%	0.689	S	S	*	*	H	α-helix	trans	-75.8	-21.5	176.2	-64.7	168.7	0	0	0	111.9	M160 M162	M160-I164 WeakPolarHBondContact O-CG1 3.4Å; M160-I164 PolarHBondContact O-N 2.88Å; M162-I164 VanDerWaalsContact C-N 3.34Å; M162-I164 PolarHBondContact O-N 2.89Å
165	K	61.1	Low	61.9	Low	172 Å²	172	142 Å²	142	75%	0.748	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	4.5	-173.8	-72	-177.8	-179.8	-172.2	0	115.4	A161 M162 R163 P167	A161-K165 WeakPolarHBondContact O-CG 3.3Å; M162-K165 PolarHBondContact O-N 3.03Å; R163-K165 VanDerWaalsContact C-N 3.33Å; K165-P167 WeakPolarHBondContact O-CD 3.01Å
166	S	43.8	Very low	60	Low	94 Å²	94	143.5 Å²	143.5	66%	0.657	71%	0.713	S	S	*	*			trans	-81.5	116.5	174.3	-169.3	0	0	0	0	109.9
167	P	54	Low	58.2	Low	105 Å²	105	144.8 Å²	144.8	68%	0.682	72%	0.721	S	S	*	*			trans	-70.6	135.9	172.6	-9.4	26.5	0	0	0	109.5	K165 E169	K165-P167 WeakPolarHBondContact O-CD 3.01Å; P167-E169 PolarHBondContact O-N 2.89Å
168	V	49.7	Very low	56.3	Low	129 Å²	129	147.3 Å²	147.3	78%	0.782	74%	0.739	S	S	*	*			trans	-69.4	111	156.7	-180	0	0	0	0	104.8	D170	V168-D170 PolarHBondContact O-N 2.93Å; V168-D170 VanDerWaalsContact O-N 3.1Å
169	E	45.7	Very low	54.5	Low	173 Å²	173	146.1 Å²	146.1	81%	0.808	74%	0.744	S	S	*	*			trans	-67.6	108.8	174.1	-69.7	-155.6	162	0	0	109.1	P167 F171	P167-E169 PolarHBondContact O-N 2.89Å; E169-F171 PolarHBondContact O-N 3.28Å
170	D	45.3	Very low	52.6	Low	147 Å²	147	143.2 Å²	143.2	79%	0.786	75%	0.751	S	S	*	*			trans	-65.5	112	170.5	-80.6	-36.6	0	0	0	109.5	V168 K172	V168-D170 PolarHBondContact O-N 2.93Å; V168-D170 VanDerWaalsContact O-N 3.1Å; D170-K172 PolarHBondContact O-N 3.14Å
171	F	44	Very low	50.8	Low	201 Å²	201	145.9 Å²	145.9	88%	0.882	76%	0.759	S	S	*	*			trans	-60.4	98.8	165.1	-90	-97.6	0	0	0	109.5	E169 V173	E169-F171 PolarHBondContact O-N 3.28Å; F171-V173 PolarHBondContact O-N 3.38Å
172	K	47.5	Very low	49.6	Very low	202 Å²	202	155.3 Å²	155.3	88%	0.878	80%	0.803	S	S	*	*			trans	-70.2	95.8	162.2	-91.4	-178.2	175	178.3	0	109.1	D170 N174	D170-K172 PolarHBondContact O-N 3.14Å; K172-N174 PolarHBondContact O-N 3.12Å
173	V	49.1	Very low	48.5	Very low	128 Å²	128	156.8 Å²	156.8	78%	0.776	81%	0.812	S	S	*	*			trans	-69.9	120.3	163.4	-175.6	0	0	0	0	107.7	F171 P175	F171-V173 PolarHBondContact O-N 3.38Å; V173-P175 WeakPolarHBondContact O-CD 3.24Å
174	N	40.7	Very low	47.3	Very low	140 Å²	140	153.3 Å²	153.3	75%	0.749	81%	0.81	S	S	*	*			trans	-88.6	116	-179.8	-151.3	10.7	0	0	0	108.7	K172 L176	K172-N174 PolarHBondContact O-N 3.12Å; N174-L176 PolarHBondContact O-N 3.23Å
175	P	45.2	Very low	46.3	Very low	119 Å²	119	153.6 Å²	153.6	77%	0.773	81%	0.813	S	S	*	*			trans	-92.7	99.8	177.4	29.7	-20.8	0	0	0	109.8	V173	V173-P175 WeakPolarHBondContact O-CD 3.24Å
176	L	42.6	Very low	45.5	Very low	141 Å²	141	152.5 Å²	152.5	74%	0.738	82%	0.817	S	S	*	*			trans	-104	135.1	162.2	-92.6	168.5	0	0	0	109.4	N174	N174-L176 PolarHBondContact O-N 3.23Å
177	H	44.6	Very low	45.6	Very low	161 Å²	161	156.1 Å²	156.1	75%	0.745	83%	0.827	S	S	*	*			trans	78.5	109.3	173.9	-71.8	-87.7	0	0	0	117.9
178	L	40.5	Very low	45	Very low	175 Å²	175	159.5 Å²	159.5	92%	0.916	84%	0.836	S	S	*	*				-158.3	116.9	100.7	-96.5	157.1	0	0	0	110.8
179	V	46.1	Very low	44.7	Very low	118 Å²	118	161.7 Å²	161.7	72%	0.715	84%	0.84	S	S	*	*			trans	-63.4	134	161.1	160.8	0	0	0	0	108.3
180	S	40.9	Very low	44.6	Very low	120 Å²	120	160.8 Å²	160.8	84%	0.839	84%	0.843	S	S	*	*			trans	-160.6	128	131.6	-98	0	0	0	0	110.3
181	K	42.9	Very low	44.6	Very low	191 Å²	191	162 Å²	162	83%	0.83	85%	0.847	S	S	*	*			trans	-77.9	142.4	167.7	-67.6	172	171.8	178.3	0	108
182	D	50.6	Low	44.6	Very low	248 Å²	248	158.5 Å²	158.5	100%	1.326	84%	0.844	S	S	*	*			trans	-146.3	0	138	-79.6	-41.2	0	0	0	107.6

Retrieved 182 of 182 residues in 67.4 ms (Link to these results)

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