A0A087X2W1_POEFO Loading...

Regulator of G-protein signaling 8

AlphaFold DB , UniProt , Accession A0A087X2W1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 174 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	44.9	Very low	42.6	Very low	249 Å²	249	170.7 Å²	170.7	100%	1.227	89%	0.888	S	S	*	*				0	110.7	0	-69.9	167.9	173.1	0	0	108
2	K	42.5	Very low	42	Very low	214 Å²	214	165.2 Å²	165.2	93%	0.93	88%	0.875	S	S	*	*			trans	-132.3	112.6	-179.9	-75.2	176	177.5	168.9	0	107.8
3	T	42.8	Very low	41.7	Very low	136 Å²	136	164.1 Å²	164.1	83%	0.834	87%	0.87	S	S	*	*			trans	-72.8	133.9	176.9	42.6	0	0	0	0	110.4
4	R	45.7	Very low	41.5	Very low	248 Å²	248	158.9 Å²	158.9	94%	0.936	85%	0.853	S	S	*	*			trans	-124.6	110.1	161.9	-88.9	-171.3	163.3	-157.4	-4	109.5	G6	R4-G6 PolarHBondContact O-N 3.45Å
5	L	49.8	Very low	41.8	Very low	176 Å²	176	163.1 Å²	163.1	92%	0.921	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-56.7	121.4	160.2	-105.3	68.5	0	0	0	108.8
6	G	40	Very low	41.8	Very low	78 Å²	78	157.9 Å²	157.9	80%	0.804	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-99.2	122.8	168.6	0	0	0	0	0	110	R4	R4-G6 PolarHBondContact O-N 3.45Å
7	C	46.8	Very low	41.9	Very low	125 Å²	125	156.1 Å²	156.1	85%	0.845	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-52.1	137.2	-173.2	-168.9	0	0	0	0	115.1	S9	C7-S9 PolarHBondContact O-N 2.99Å; C7-S9 VanDerWaalsContact O-N 3.16Å
8	L	44.3	Very low	42.2	Very low	158 Å²	158	152.8 Å²	152.8	83%	0.827	80%	0.804	S	S	*	*			trans	-57.4	107.4	161.7	-83.1	150.2	0	0	0	109.8	K10	L8-K10 PolarHBondContact O-N 2.8Å
9	S	41.1	Very low	42.4	Very low	112 Å²	112	148.1 Å²	148.1	78%	0.783	79%	0.785	S	S	*	*			trans	-71.8	100.9	168.3	-163.6	0	0	0	0	108.7	C7 K11	C7-S9 PolarHBondContact O-N 2.99Å; C7-S9 VanDerWaalsContact O-N 3.16Å; S9-K11 PolarHBondContact O-N 3.43Å
10	K	37	Very low	42.6	Very low	194 Å²	194	149.2 Å²	149.2	84%	0.843	79%	0.786	S	S	*	*			trans	-63.4	103	165.5	-66.6	-175.6	178	-177.1	0	107.7	L8 S12	L8-K10 PolarHBondContact O-N 2.8Å; K10-S12 PolarHBondContact O-N 3.35Å
11	K	34.1	Very low	42.8	Very low	188 Å²	188	149.2 Å²	149.2	82%	0.817	78%	0.78	S	S	*	*			trans	-67.9	109.5	160.4	-82.7	-178.3	174.9	-179.5	0	106.6	S9 D13	S9-K11 PolarHBondContact O-N 3.43Å; K11-D13 PolarHBondContact O-N 3.15Å
12	S	35.2	Very low	42.7	Very low	104 Å²	104	140.3 Å²	140.3	73%	0.727	74%	0.737	S	S	*	*			trans	-73.3	103.9	166.4	48.2	0	0	0	0	108	K10 S14	K10-S12 PolarHBondContact O-N 3.35Å; S12-S14 PolarHBondContact O-N 3.19Å
13	D	37.6	Very low	42.6	Very low	151 Å²	151	134.3 Å²	134.3	81%	0.807	72%	0.72	S	S	*	*			trans	-70.8	81.7	164.5	-69.1	-34.1	0	0	0	108.4	K11 Y15	K11-D13 PolarHBondContact O-N 3.15Å; D13-Y15 VanDerWaalsContact C-N 3.34Å; D13-Y15 PolarHBondContact O-N 3.16Å
14	S	39.8	Very low	42.4	Very low	92 Å²	92	133 Å²	133	64%	0.643	71%	0.713	S	S	*	*			trans	-95.1	64.6	172.3	179.5	0	0	0	0	109.4	S12 S16	S12-S14 PolarHBondContact O-N 3.19Å; S14-S16 PolarHBondContact O-N 3.06Å; S14-S16 VanDerWaalsContact O-N 3.13Å
15	Y	45.7	Very low	42.3	Very low	222 Å²	222	126.6 Å²	126.6	87%	0.871	71%	0.714	S	S	*	*			trans	-81.8	73.2	164.1	-100.8	-88.6	0	0	0	108.9	D13	D13-Y15 VanDerWaalsContact C-N 3.34Å; D13-Y15 PolarHBondContact O-N 3.16Å
16	S	41.9	Very low	42	Very low	79 Å²	79	125 Å²	125	55%	0.552	70%	0.701	S	S	*	*			trans	-148.2	63.9	167.8	56.7	0	0	0	0	109.6	S14	S14-S16 PolarHBondContact O-N 3.06Å; S14-S16 VanDerWaalsContact O-N 3.13Å
17	D	42.8	Very low	41.6	Very low	128 Å²	128	129 Å²	129	68%	0.684	70%	0.699	S	S	*	*			trans	-105.1	73.2	155.7	-163	7.4	0	0	0	108.7	S19	D17-S19 VanDerWaalsContact CG-OG 3.29Å; D17-S19 PolarHBondContact O-N 3.25Å; D17-S19 WeakPolarHBondContact OD1-CB 3.38Å; D17-S19 PolarHBondContact OD1-N 3.25Å; D17-S19 PolarHBondContact OD1-OG 2.72Å
18	F	47.3	Very low	41.5	Very low	96 Å²	96	129.3 Å²	129.3	42%	0.421	70%	0.697	S	S	.	*	G	3₁₀ helix	trans	-77.7	12.9	175.2	-68.9	-78.3	0	0	0	112.1	E20 T62 M157	F18-E20 PolarHBondContact O-N 2.7Å; F18-T62 HydrophobicContact CD1-CG2 4.41Å; F18-T62 HydrophobicContact CE1-CG2 4.05Å; F18-M157 HydrophobicContact CD1-CE 4Å; F18-M157 HydrophobicContact CE1-CE 3.3Å; F18-M157 HydrophobicContact CZ-CE 3.77Å
19	S	45.8	Very low	41	Very low	64 Å²	64	128.7 Å²	128.7	45%	0.448	70%	0.7	S	S	.	*	G	3₁₀ helix	trans	-69.3	-20.4	-179.4	67.9	0	0	0	0	112.8	D17 F21 L22	D17-S19 VanDerWaalsContact CG-OG 3.29Å; D17-S19 PolarHBondContact O-N 3.25Å; D17-S19 WeakPolarHBondContact OD1-CB 3.38Å; D17-S19 PolarHBondContact OD1-N 3.25Å; D17-S19 PolarHBondContact OD1-OG 2.72Å; S19-F21 PolarHBondContact O-N 2.63Å; S19-F21 VanDerWaalsContact O-N 3.16Å; S19-L22 PolarHBondContact O-N 3.05Å; S19-L22 VanDerWaalsContact O-N 3.07Å
20	E	46.8	Very low	41.1	Very low	169 Å²	169	128 Å²	128	79%	0.79	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-64.4	-22.7	-177.2	-162.9	173.7	-173.7	0	0	113.6	F18	F18-E20 PolarHBondContact O-N 2.7Å
21	F	47.2	Very low	41.2	Very low	150 Å²	150	129 Å²	129	66%	0.658	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-104.6	1.9	177.4	-63	-76.6	0	0	0	113.8	S19	S19-F21 PolarHBondContact O-N 2.63Å; S19-F21 VanDerWaalsContact O-N 3.16Å
22	L	43.7	Very low	41.6	Very low	63 Å²	63	123.8 Å²	123.8	33%	0.33	69%	0.686	S	S	.	*	S	Bend	trans	-108.5	139.9	174.7	-69.6	158.2	0	0	0	107.9	S19 R164	S19-L22 PolarHBondContact O-N 3.05Å; S19-L22 VanDerWaalsContact O-N 3.07Å; L22-R164 VanDerWaalsContact CD1-CZ 3.47Å
23	P	40.2	Very low	42.2	Very low	88 Å²	88	124 Å²	124	57%	0.571	68%	0.678	S	S	*	*			trans	-57.6	131.8	179	-10.4	18	0	0	0	109.9
24	P	36.8	Very low	43.4	Very low	107 Å²	107	121.7 Å²	121.7	70%	0.695	66%	0.661	S	S	*	*			trans	-59.8	139.9	174	19.9	-26.6	0	0	0	109.5	H26	P24-H26 PolarHBondContact O-N 2.85Å
25	A	45.5	Very low	44.8	Very low	115 Å²	115	119.2 Å²	119.2	95%	0.95	64%	0.64	S	S	*	*	S	Bend	trans	-70.2	9.4	-171.4	0	0	0	0	0	114.8
26	H	41.6	Very low	46.3	Very low	141 Å²	141	110.5 Å²	110.5	65%	0.653	61%	0.611	S	S	*	*	S	Bend	trans	-140.5	131.4	170.8	97.7	-50.9	0	0	0	112.7	P24	P24-H26 PolarHBondContact O-N 2.85Å
27	E	32.9	Very low	48.2	Very low	164 Å²	164	108.1 Å²	108.1	77%	0.766	59%	0.594	S	S	*	*			trans	77.9	85	158.5	-65	-177.8	166.8	0	0	120.5
28	T	44.2	Very low	50	Low	131 Å²	131	107.7 Å²	107.7	80%	0.804	59%	0.591	S	S	*	*				56.2	85.6	121.1	-42.2	0	0	0	0	119.3
29	T	33.2	Very low	51.8	Low	144 Å²	144	105.8 Å²	105.8	88%	0.883	58%	0.584	S	S	*	*				-157.4	128.3	115.9	-6.3	0	0	0	0	110.5	R31	T29-R31 PolarHBondContact O-N 3.1Å; T29-R31 VanDerWaalsContact O-N 3.16Å
30	A	44.8	Very low	53.8	Low	97 Å²	97	102.8 Å²	102.8	80%	0.802	56%	0.563	S	S	*	*	S	Bend	trans	-61.1	111.1	-168.5	0	0	0	0	0	113.7
31	R	37.3	Very low	55.8	Low	217 Å²	217	97.4 Å²	97.4	82%	0.819	54%	0.542	S	S	*	.				-163.3	65	123.1	-95	170.6	-155.9	-170.7	5.5	108.3	T29 L33	T29-R31 PolarHBondContact O-N 3.1Å; T29-R31 VanDerWaalsContact O-N 3.16Å; R31-L33 HydrophobicContact CB-CG 4.47Å; R31-L33 PolarHBondContact O-N 3.32Å
32	C	43.3	Very low	57.9	Low	78 Å²	78	95.9 Å²	95.9	53%	0.527	53%	0.531	S	S	.	.			trans	-63.5	86.1	152.1	-177.5	0	0	0	0	105.7	K34	C32-K34 PolarHBondContact O-N 3.4Å
33	L	48.9	Very low	60.4	Low	107 Å²	107	93 Å²	93	56%	0.56	52%	0.516	S	S	*	.			trans	-67.7	93.3	171	-75.3	167.5	0	0	0	105	R31 L35 Y55	R31-L33 HydrophobicContact CB-CG 4.47Å; R31-L33 PolarHBondContact O-N 3.32Å; L33-L35 PolarHBondContact O-N 2.95Å; L33-Y55 HydrophobicContact CB-CE2 4.26Å; L33-Y55 HydrophobicContact CD1-CE2 4.45Å; L33-Y55 VanDerWaalsContact CD1-OH 3.29Å; L33-Y55 WeakPolarHBondContact CD1-OH 3.25Å
34	K	61.9	Low	63	Low	104 Å²	104	91.3 Å²	91.3	45%	0.452	51%	0.506	S	S	.	.			trans	-54.8	102.2	175.2	-70.6	174.1	175.6	-175.5	0	107.2	C32 S36 R172	C32-K34 PolarHBondContact O-N 3.4Å; K34-S36 PolarHBondContact O-N 3.17Å; K34-S36 VanDerWaalsContact O-N 3.08Å; K34-R172 VanDerWaalsContact CD-CZ 3.47Å
35	L	69.3	Low	65.8	Low	40 Å²	40	92 Å²	92	21%	0.209	50%	0.501	C	S	.	.			trans	-54.6	114.3	167.7	-78.5	165	0	0	0	107	L33 V40 W43 Y55 I161	L33-L35 PolarHBondContact O-N 2.95Å; L35-V40 HydrophobicContact CB-CG2 4.1Å; L35-W43 HydrophobicContact CD1-CH2 4.37Å; L35-W43 HydrophobicContact CD2-CH2 4.25Å; L35-W43 HydrophobicContact CD2-CZ2 3.89Å; L35-Y55 HydrophobicContact CD1-CG 4.49Å; L35-Y55 HydrophobicContact CD2-CD2 3.61Å; L35-Y55 HydrophobicContact CD2-CE2 4.41Å; L35-Y55 HydrophobicContact CD2-CG 3.96Å; L35-Y55 HydrophobicContact CG-CD2 4.31Å; L35-I161 HydrophobicContact CD1-CG2 4.49Å
36	S	78.1	Confident	68.2	Low	38 Å²	38	88.1 Å²	88.1	27%	0.266	47%	0.466	S	S	.	.			trans	-70.7	148.4	174.3	63.6	0	0	0	0	109.4	K34 D38 E39 V40	K34-S36 PolarHBondContact O-N 3.17Å; K34-S36 VanDerWaalsContact O-N 3.08Å; S36-D38 PolarHBondContact O-N 2.92Å; S36-E39 WeakPolarHBondContact CB-OE2 3.47Å; S36-E39 PolarHBondContact N-OE2 2.99Å; S36-E39 PolarHBondContact O-N 3.44Å; S36-E39 VanDerWaalsContact O-N 3.14Å; S36-E39 WeakPolarHBondContact OG-CB 3.24Å; S36-E39 WeakPolarHBondContact OG-CG 3.39Å; S36-E39 PolarHBondContact OG-N 3.41Å; S36-E39 PolarHBondContact OG-OE2 3.15Å; S36-V40 PolarHBondContact O-N 3.4Å
37	T	80	Confident	70.9	Confident	29 Å²	29	81.5 Å²	81.5	18%	0.178	44%	0.435	C	S	.	.	H	α-helix	trans	-51.3	-43.9	173.6	-54.8	0	0	0	0	110.9	E39 V40 V41 A165 H166	T37-E39 VanDerWaalsContact C-N 3.34Å; T37-E39 PolarHBondContact O-N 3.37Å; T37-V40 PolarHBondContact O-N 3.15Å; T37-V41 HydrophobicContact CG2-CG2 4.24Å; T37-V41 VanDerWaalsContact O-CG2 3.31Å; T37-V41 WeakPolarHBondContact O-CG2 3.45Å; T37-V41 PolarHBondContact O-N 3.03Å; T37-A165 PolarHBondContact OG1-O 3.3Å; T37-H166 WeakPolarHBondContact CG2-CE1 3.36Å; T37-H166 WeakPolarHBondContact CG2-ND1 3.44Å
38	D	81.7	Confident	74	Confident	119 Å²	119	78.1 Å²	78.1	64%	0.636	42%	0.423	S	S	*	.	H	α-helix	trans	-64.3	-36.1	-178.3	-57.8	-15.4	0	0	0	112.5	S36 R42	S36-D38 PolarHBondContact O-N 2.92Å; D38-R42 VanDerWaalsContact O-CG 3.29Å; D38-R42 WeakPolarHBondContact O-CG 3.5Å; D38-R42 PolarHBondContact O-N 3.23Å; D38-R42 VanDerWaalsContact O-N 3.15Å; D38-R42 PolarHBondContact O-NE 3.5Å
39	E	84.9	Confident	76.5	Confident	57 Å²	57	75.8 Å²	75.8	27%	0.266	40%	0.403	S	S	.	.	H	α-helix	trans	-65.9	-41.2	174.4	-76.9	164.3	141.6	0	0	112.3	S36 T37 W43 H53	S36-E39 WeakPolarHBondContact CB-OE2 3.47Å; S36-E39 PolarHBondContact N-OE2 2.99Å; S36-E39 PolarHBondContact O-N 3.44Å; S36-E39 VanDerWaalsContact O-N 3.14Å; S36-E39 WeakPolarHBondContact OG-CB 3.24Å; S36-E39 WeakPolarHBondContact OG-CG 3.39Å; S36-E39 PolarHBondContact OG-N 3.41Å; S36-E39 PolarHBondContact OG-OE2 3.15Å; T37-E39 VanDerWaalsContact C-N 3.34Å; T37-E39 PolarHBondContact O-N 3.37Å; E39-W43 PolarHBondContact O-NE1 2.92Å; E39-W43 VanDerWaalsContact O-NE1 3.12Å; E39-H53 IonicContact OE1-NE2 2.56Å
40	V	87.2	Confident	79.5	Confident	1 Å²	1	69 Å²	69	1%	0.006	36%	0.361	C	S	.	.	H	α-helix	trans	-71	-41.9	-179.9	-177.8	0	0	0	0	110.6	L35 S36 T37 R42 W43 Y158 I161 V162 A165	L35-V40 HydrophobicContact CB-CG2 4.1Å; S36-V40 PolarHBondContact O-N 3.4Å; T37-V40 PolarHBondContact O-N 3.15Å; V40-R42 VanDerWaalsContact C-N 3.28Å; V40-R42 PolarHBondContact O-N 3.32Å; V40-W43 HydrophobicContact CG1-CE3 4.23Å; V40-W43 HydrophobicContact CG1-CZ3 4.36Å; V40-W43 HydrophobicContact CG2-CH2 4.4Å; V40-W43 HydrophobicContact CG2-CZ2 4.42Å; V40-W43 VanDerWaalsContact O-CB 3.24Å; V40-W43 WeakPolarHBondContact O-CB 3.47Å; V40-W43 PolarHBondContact O-N 2.89Å; V40-Y158 HydrophobicContact CG1-CE2 3.9Å; V40-Y158 PolarHBondContact O-OH 2.7Å; V40-Y158 VanDerWaalsContact O-OH 3.06Å; V40-I161 HydrophobicContact CG1-CG2 3.84Å; V40-I161 HydrophobicContact CG2-CG2 4.01Å; V40-V162 HydrophobicContact CG1-CB 4.47Å; V40-V162 HydrophobicContact CG1-CG2 3.57Å; V40-A165 HydrophobicContact CG2-CB 4.04Å
41	V	88.7	Confident	82	Confident	56 Å²	56	64.8 Å²	64.8	34%	0.339	33%	0.325	S	S	.	.	H	α-helix	trans	-60.2	-40.3	177.6	170.9	0	0	0	0	111	T37 W43 S44	T37-V41 HydrophobicContact CG2-CG2 4.24Å; T37-V41 VanDerWaalsContact O-CG2 3.31Å; T37-V41 WeakPolarHBondContact O-CG2 3.45Å; T37-V41 PolarHBondContact O-N 3.03Å; V41-W43 PolarHBondContact O-N 2.87Å; V41-W43 VanDerWaalsContact O-N 3.13Å; V41-S44 PolarHBondContact O-N 3.24Å; V41-S44 PolarHBondContact O-OG 3.03Å
42	R	93	Very high	84.8	Confident	118 Å²	118	58.8 Å²	58.8	45%	0.445	32%	0.322	S	S	.	.	H	α-helix	trans	-57.9	-27	176	-78.5	-171.5	-69.7	176.6	-1.3	113.9	D38 V40 S44 E45 H49	D38-R42 VanDerWaalsContact O-CG 3.29Å; D38-R42 WeakPolarHBondContact O-CG 3.5Å; D38-R42 PolarHBondContact O-N 3.23Å; D38-R42 VanDerWaalsContact O-N 3.15Å; D38-R42 PolarHBondContact O-NE 3.5Å; V40-R42 VanDerWaalsContact C-N 3.28Å; V40-R42 PolarHBondContact O-N 3.32Å; R42-S44 PolarHBondContact O-N 3.1Å; R42-E45 PolarHBondContact O-N 3.42Å; R42-H49 WeakPolarHBondContact O-CB 3.43Å; R42-H49 PolarHBondContact O-ND1 3.43Å
43	W	95.1	Very high	87.2	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-64.9	-21.1	175.3	-59.3	-4.8	0	0	0	113.2	L35 E39 V40 V41 L50 H53 A59 Y149 Y158 I161	L35-W43 HydrophobicContact CD1-CH2 4.37Å; L35-W43 HydrophobicContact CD2-CH2 4.25Å; L35-W43 HydrophobicContact CD2-CZ2 3.89Å; E39-W43 PolarHBondContact O-NE1 2.92Å; E39-W43 VanDerWaalsContact O-NE1 3.12Å; V40-W43 HydrophobicContact CG1-CE3 4.23Å; V40-W43 HydrophobicContact CG1-CZ3 4.36Å; V40-W43 HydrophobicContact CG2-CH2 4.4Å; V40-W43 HydrophobicContact CG2-CZ2 4.42Å; V40-W43 VanDerWaalsContact O-CB 3.24Å; V40-W43 WeakPolarHBondContact O-CB 3.47Å; V40-W43 PolarHBondContact O-N 2.89Å; V41-W43 PolarHBondContact O-N 2.87Å; V41-W43 VanDerWaalsContact O-N 3.13Å; W43-L50 HydrophobicContact CB-CB 4.25Å; W43-L50 HydrophobicContact CB-CD1 3.76Å; W43-L50 HydrophobicContact CD2-CD1 3.88Å; W43-L50 HydrophobicContact CE3-CD1 3.89Å; W43-L50 HydrophobicContact CG-CD1 3.81Å; W43-H53 AromaticContact CE2-ND1 3.48Å; W43-H53 AromaticContact CZ2-CE1 3.63Å; W43-H53 AromaticContact CZ2-ND1 3.27Å; W43-H53 VanDerWaalsContact CZ2-ND1 3.27Å; W43-H53 WeakPolarHBondContact CZ2-ND1 3.37Å; W43-H53 AromaticContact NE1-CE1 3.87Å; W43-H53 AromaticContact NE1-CG 3.32Å; W43-H53 VanDerWaalsContact NE1-CG 3.32Å; W43-H53 AromaticContact NE1-ND1 3.23Å; W43-H53 PolarHBondContact NE1-ND1 3.25Å; W43-A59 HydrophobicContact CZ3-CB 4.34Å; W43-Y149 WeakPolarHBondContact O-CE2 3.45Å; W43-Y149 PolarHBondContact O-OH 3.37Å; W43-Y158 HydrophobicContact CB-CE2 4.27Å; W43-Y158 HydrophobicContact CE3-CD2 4.26Å; W43-Y158 AromaticContact CE3-CE2 3.96Å; W43-Y158 HydrophobicContact CE3-CE2 3.96Å; W43-I161 HydrophobicContact CH2-CG2 4.27Å; W43-I161 HydrophobicContact CZ3-CD1 4.31Å; W43-I161 HydrophobicContact CZ3-CG2 4.03Å
44	S	94.9	Very high	89.3	Confident	53 Å²	53	59.7 Å²	59.7	37%	0.371	31%	0.313	S	S	.	.	H	α-helix	trans	-89.1	-15.9	176	66.7	0	0	0	0	113.9	V41 R42 Y149 Y158	V41-S44 PolarHBondContact O-N 3.24Å; V41-S44 PolarHBondContact O-OG 3.03Å; R42-S44 PolarHBondContact O-N 3.1Å; S44-Y149 VanDerWaalsContact C-OH 3.25Å; S44-Y149 WeakPolarHBondContact CA-OH 3.49Å; S44-Y149 PolarHBondContact O-OH 3.37Å; S44-Y158 WeakPolarHBondContact CB-OH 3.46Å
45	E	95.1	Very high	90.7	Very high	122 Å²	122	58.6 Å²	58.6	57%	0.57	31%	0.306	S	S	*	.	H	α-helix	trans	-76.7	-35.8	-178.1	-63.5	174	178.7	0	0	112.3	R42 H49	R42-E45 PolarHBondContact O-N 3.42Å; E45-H49 IonicContact OE2-CE1 3.62Å; E45-H49 IonicContact OE2-ND1 2.83Å
46	S	96.8	Very high	91.9	Very high	33 Å²	33	56.7 Å²	56.7	23%	0.231	30%	0.296	C	S	.	.			trans	-154.6	143.4	179.2	175.5	0	0	0	0	111	D48 H49 L50	S46-D48 PolarHBondContact O-N 2.81Å; S46-D48 PolarHBondContact OG-N 3.01Å; S46-D48 VanDerWaalsContact OG-N 3.15Å; S46-H49 WeakPolarHBondContact O-CB 3.47Å; S46-H49 PolarHBondContact O-N 3.3Å; S46-H49 VanDerWaalsContact O-N 3.12Å; S46-L50 PolarHBondContact O-N 2.95Å
47	F	98.1	Very high	92.8	Very high	1 Å²	1	56.6 Å²	56.6	0%	0.004	29%	0.293	C	S	.	.	H	α-helix	trans	-62.9	-33	173.4	-172.2	-138.6	0	0	0	111.4	H49 L50 L51 F60 Y141 M144 E145 Y149	F47-H49 VanDerWaalsContact C-N 3.32Å; F47-H49 PolarHBondContact O-N 3.46Å; F47-L50 HydrophobicContact CD2-CB 4.45Å; F47-L50 HydrophobicContact CD2-CD2 3.93Å; F47-L50 HydrophobicContact CE2-CD2 4.02Å; F47-L50 WeakPolarHBondContact O-CB 3.27Å; F47-L50 PolarHBondContact O-N 3.11Å; F47-L51 HydrophobicContact CD1-CD1 4.18Å; F47-L51 HydrophobicContact CD2-CD2 4.33Å; F47-L51 HydrophobicContact CD2-CG 4.13Å; F47-L51 HydrophobicContact CE1-CD1 3.76Å; F47-L51 HydrophobicContact CE1-CG 4.3Å; F47-L51 HydrophobicContact CE2-CD1 4.19Å; F47-L51 HydrophobicContact CE2-CD2 3.64Å; F47-L51 HydrophobicContact CE2-CG 3.85Å; F47-L51 HydrophobicContact CG-CG 4.46Å; F47-L51 HydrophobicContact CZ-CD1 3.76Å; F47-L51 HydrophobicContact CZ-CD2 3.8Å; F47-L51 HydrophobicContact CZ-CG 3.94Å; F47-L51 WeakPolarHBondContact O-CG 3.45Å; F47-L51 PolarHBondContact O-N 2.95Å; F47-F60 AromaticContact CE2-CD1 3.91Å; F47-F60 HydrophobicContact CE2-CD1 3.91Å; F47-F60 AromaticContact CE2-CE1 3.47Å; F47-F60 HydrophobicContact CE2-CE1 3.47Å; F47-F60 VanDerWaalsContact CE2-CE1 3.47Å; F47-F60 HydrophobicContact CE2-CE2 4.33Å; F47-F60 AromaticContact CE2-CZ 3.7Å; F47-F60 HydrophobicContact CE2-CZ 3.7Å; F47-F60 HydrophobicContact CZ-CD1 4.27Å; F47-F60 AromaticContact CZ-CE1 3.55Å; F47-F60 HydrophobicContact CZ-CE1 3.55Å; F47-F60 AromaticContact CZ-CZ 3.95Å; F47-F60 HydrophobicContact CZ-CZ 3.95Å; F47-Y141 AromaticContact CD1-CD2 3.87Å; F47-Y141 HydrophobicContact CD1-CD2 3.87Å; F47-Y141 HydrophobicContact CD1-CE1 4.06Å; F47-Y141 AromaticContact CD1-CE2 3.34Å; F47-Y141 HydrophobicContact CD1-CE2 3.34Å; F47-Y141 HydrophobicContact CD1-CG 4.43Å; F47-Y141 AromaticContact CD1-CZ 3.43Å; F47-Y141 VanDerWaalsContact CD1-CZ 3.43Å; F47-Y141 AromaticContact CE1-CD2 3.77Å; F47-Y141 HydrophobicContact CE1-CD2 3.77Å; F47-Y141 AromaticContact CE1-CE2 3.72Å; F47-Y141 HydrophobicContact CE1-CE2 3.72Å; F47-Y141 HydrophobicContact CE1-CG 4.31Å; F47-Y141 HydrophobicContact CG-CE2 4.29Å; F47-M144 HydrophobicContact CE1-CB 3.85Å; F47-M144 HydrophobicContact CE1-CE 4.34Å; F47-M144 HydrophobicContact CZ-CB 3.65Å; F47-M144 HydrophobicContact CZ-CE 4.16Å; F47-M144 HydrophobicContact CZ-SD 4.45Å; F47-E145 HydrophobicContact CB-CG 4.06Å; F47-E145 HydrophobicContact CD1-CB 3.63Å; F47-E145 HydrophobicContact CD1-CG 4.06Å; F47-E145 HydrophobicContact CE1-CB 4.14Å; F47-E145 HydrophobicContact CG-CB 4.3Å; F47-E145 HydrophobicContact CG-CG 4.36Å; F47-Y149 HydrophobicContact CB-CD1 3.9Å; F47-Y149 HydrophobicContact CB-CE1 3.91Å; F47-Y149 HydrophobicContact CB-CG 4.21Å; F47-Y149 HydrophobicContact CD2-CD1 4.19Å; F47-Y149 AromaticContact CD2-CD2 3.58Å; F47-Y149 HydrophobicContact CD2-CD2 3.58Å; F47-Y149 HydrophobicContact CD2-CE2 4.12Å; F47-Y149 AromaticContact CD2-CG 3.61Å; F47-Y149 HydrophobicContact CD2-CG 3.61Å; F47-Y149 HydrophobicContact CE2-CD2 4.24Å; F47-Y149 HydrophobicContact CE2-CG 4.27Å; F47-Y149 HydrophobicContact CG-CD1 4.24Å; F47-Y149 HydrophobicContact CG-CD2 4.39Å; F47-Y149 HydrophobicContact CG-CG 4.1Å
48	D	97.4	Very high	93.6	Very high	93 Å²	93	57.3 Å²	57.3	50%	0.497	30%	0.302	S	S	.	.	H	α-helix	trans	-59.9	-40.8	172.6	-68.3	-50.3	0	0	0	112.2	S46 L50 L51 A52 Y141	S46-D48 PolarHBondContact O-N 2.81Å; S46-D48 PolarHBondContact OG-N 3.01Å; S46-D48 VanDerWaalsContact OG-N 3.15Å; D48-L50 VanDerWaalsContact C-N 3.33Å; D48-L50 PolarHBondContact O-N 2.91Å; D48-L51 PolarHBondContact O-N 3.09Å; D48-A52 WeakPolarHBondContact O-CB 3.34Å; D48-A52 PolarHBondContact O-N 2.86Å; D48-Y141 PolarHBondContact OD1-OH 3.12Å
49	H	96.8	Very high	94.2	Very high	83 Å²	83	52.3 Å²	52.3	38%	0.384	28%	0.277	S	S	.	.	H	α-helix	trans	-64	-40.4	176.9	-68.8	163.4	0	0	0	111.6	R42 E45 S46 F47 H53	R42-H49 WeakPolarHBondContact O-CB 3.43Å; R42-H49 PolarHBondContact O-ND1 3.43Å; E45-H49 IonicContact OE2-CE1 3.62Å; E45-H49 IonicContact OE2-ND1 2.83Å; S46-H49 WeakPolarHBondContact O-CB 3.47Å; S46-H49 PolarHBondContact O-N 3.3Å; S46-H49 VanDerWaalsContact O-N 3.12Å; F47-H49 VanDerWaalsContact C-N 3.32Å; F47-H49 PolarHBondContact O-N 3.46Å; H49-H53 WeakPolarHBondContact O-CB 3.44Å; H49-H53 PolarHBondContact O-N 3.38Å
50	L	97.3	Very high	94.9	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.1	-48.6	175.5	178.4	70.1	0	0	0	111.2	W43 S46 F47 D48 H53 G56 L57 F60 Y149 F152	W43-L50 HydrophobicContact CB-CB 4.25Å; W43-L50 HydrophobicContact CB-CD1 3.76Å; W43-L50 HydrophobicContact CD2-CD1 3.88Å; W43-L50 HydrophobicContact CE3-CD1 3.89Å; W43-L50 HydrophobicContact CG-CD1 3.81Å; S46-L50 PolarHBondContact O-N 2.95Å; F47-L50 HydrophobicContact CD2-CB 4.45Å; F47-L50 HydrophobicContact CD2-CD2 3.93Å; F47-L50 HydrophobicContact CE2-CD2 4.02Å; F47-L50 WeakPolarHBondContact O-CB 3.27Å; F47-L50 PolarHBondContact O-N 3.11Å; D48-L50 VanDerWaalsContact C-N 3.33Å; D48-L50 PolarHBondContact O-N 2.91Å; L50-H53 PolarHBondContact O-N 3.14Å; L50-G56 VanDerWaalsContact CD1-CA 3.47Å; L50-G56 WeakPolarHBondContact CD1-O 3.29Å; L50-G56 CarbonylContact O-C 3.44Å; L50-L57 PolarHBondContact O-N 3.19Å; L50-L57 VanDerWaalsContact O-N 3.14Å; L50-F60 HydrophobicContact CD2-CB 3.89Å; L50-F60 HydrophobicContact CD2-CD1 4.46Å; L50-F60 HydrophobicContact CD2-CD2 3.81Å; L50-F60 HydrophobicContact CD2-CE2 4.5Å; L50-F60 HydrophobicContact CD2-CG 3.79Å; L50-F60 HydrophobicContact CG-CB 4.32Å; L50-Y149 HydrophobicContact CB-CE2 4.33Å; L50-Y149 HydrophobicContact CD2-CD2 3.58Å; L50-Y149 HydrophobicContact CD2-CE2 3.73Å; L50-F152 HydrophobicContact CD1-CD1 4.48Å; L50-F152 HydrophobicContact CD1-CE1 3.66Å; L50-F152 HydrophobicContact CD1-CZ 4.18Å; L50-F152 HydrophobicContact CD2-CD1 3.94Å; L50-F152 HydrophobicContact CD2-CE1 3.94Å
51	L	97.1	Very high	95.4	Very high	9 Å²	9	53.8 Å²	53.8	5%	0.047	28%	0.28	C	S	.	.	H	α-helix	trans	-72	-33.7	-176.3	-63.7	-168.8	0	0	0	113.2	F47 D48 H53 L57 F60 I73 W76 Y141	F47-L51 HydrophobicContact CD1-CD1 4.18Å; F47-L51 HydrophobicContact CD2-CD2 4.33Å; F47-L51 HydrophobicContact CD2-CG 4.13Å; F47-L51 HydrophobicContact CE1-CD1 3.76Å; F47-L51 HydrophobicContact CE1-CG 4.3Å; F47-L51 HydrophobicContact CE2-CD1 4.19Å; F47-L51 HydrophobicContact CE2-CD2 3.64Å; F47-L51 HydrophobicContact CE2-CG 3.85Å; F47-L51 HydrophobicContact CG-CG 4.46Å; F47-L51 HydrophobicContact CZ-CD1 3.76Å; F47-L51 HydrophobicContact CZ-CD2 3.8Å; F47-L51 HydrophobicContact CZ-CG 3.94Å; F47-L51 WeakPolarHBondContact O-CG 3.45Å; F47-L51 PolarHBondContact O-N 2.95Å; D48-L51 PolarHBondContact O-N 3.09Å; L51-H53 VanDerWaalsContact C-N 3.27Å; L51-H53 PolarHBondContact O-N 3.47Å; L51-L57 HydrophobicContact CD2-CD1 3.93Å; L51-F60 HydrophobicContact CD2-CD1 4.14Å; L51-I73 HydrophobicContact CD2-CD1 3.7Å; L51-W76 HydrophobicContact CB-CH2 3.92Å; L51-W76 HydrophobicContact CB-CZ2 4.41Å; L51-W76 HydrophobicContact CB-CZ3 4.31Å; L51-W76 HydrophobicContact CD1-CD2 4.11Å; L51-W76 HydrophobicContact CD1-CE3 4.27Å; L51-W76 HydrophobicContact CD1-CH2 3.85Å; L51-W76 HydrophobicContact CD1-CZ2 3.65Å; L51-W76 HydrophobicContact CD1-CZ3 4.15Å; L51-W76 HydrophobicContact CG-CH2 4.49Å; L51-Y141 HydrophobicContact CD1-CD2 3.96Å; L51-Y141 HydrophobicContact CD1-CE2 3.83Å
52	A	95.1	Very high	95.8	Very high	92 Å²	92	52.7 Å²	52.7	76%	0.76	27%	0.273	S	S	*	.	H	α-helix	trans	-70.5	-25	176.8	0	0	0	0	0	112.5	D48	D48-A52 WeakPolarHBondContact O-CB 3.34Å; D48-A52 PolarHBondContact O-N 2.86Å
53	H	94.3	Very high	96	Very high	42 Å²	42	47.5 Å²	47.5	19%	0.194	25%	0.254	C	S	.	.	S	Bend	trans	-89	121.9	-178	-166.5	-95	0	0	0	111.8	E39 W43 H49 L50 L51 Y55 G56 L57	E39-H53 IonicContact OE1-NE2 2.56Å; W43-H53 AromaticContact CE2-ND1 3.48Å; W43-H53 AromaticContact CZ2-CE1 3.63Å; W43-H53 AromaticContact CZ2-ND1 3.27Å; W43-H53 VanDerWaalsContact CZ2-ND1 3.27Å; W43-H53 WeakPolarHBondContact CZ2-ND1 3.37Å; W43-H53 AromaticContact NE1-CE1 3.87Å; W43-H53 AromaticContact NE1-CG 3.32Å; W43-H53 VanDerWaalsContact NE1-CG 3.32Å; W43-H53 AromaticContact NE1-ND1 3.23Å; W43-H53 PolarHBondContact NE1-ND1 3.25Å; H49-H53 WeakPolarHBondContact O-CB 3.44Å; H49-H53 PolarHBondContact O-N 3.38Å; L50-H53 PolarHBondContact O-N 3.14Å; L51-H53 VanDerWaalsContact C-N 3.27Å; L51-H53 PolarHBondContact O-N 3.47Å; H53-Y55 VanDerWaalsContact C-N 3.28Å; H53-Y55 AromaticContact CE1-CD2 3.64Å; H53-Y55 PolarHBondContact ND1-N 3.07Å; H53-Y55 PolarHBondContact O-N 3.36Å; H53-Y55 VanDerWaalsContact O-N 3.12Å; H53-G56 PolarHBondContact ND1-N 3.4Å; H53-G56 WeakPolarHBondContact O-CA 3.44Å; H53-G56 PolarHBondContact O-N 2.98Å; H53-L57 PolarHBondContact O-N 2.75Å
54	K	92.1	Very high	96.1	Very high	162 Å²	162	47.4 Å²	47.4	70%	0.704	25%	0.253	S	S	*	.	H	α-helix	trans	-48.8	-45.9	-176.6	-178.8	-177	176.7	-175.1	0	113.6	A58	K54-A58 WeakPolarHBondContact O-CB 3.32Å; K54-A58 PolarHBondContact O-N 3.26Å
55	Y	92.1	Very high	96.3	Very high	80 Å²	80	49.8 Å²	49.8	31%	0.314	26%	0.257	S	S	.	.	H	α-helix	trans	-78.2	-28.8	-179.9	-62.8	-69.2	0	0	0	112.9	L33 L35 H53 A58 A59	L33-Y55 HydrophobicContact CB-CE2 4.26Å; L33-Y55 HydrophobicContact CD1-CE2 4.45Å; L33-Y55 VanDerWaalsContact CD1-OH 3.29Å; L33-Y55 WeakPolarHBondContact CD1-OH 3.25Å; L35-Y55 HydrophobicContact CD1-CG 4.49Å; L35-Y55 HydrophobicContact CD2-CD2 3.61Å; L35-Y55 HydrophobicContact CD2-CE2 4.41Å; L35-Y55 HydrophobicContact CD2-CG 3.96Å; L35-Y55 HydrophobicContact CG-CD2 4.31Å; H53-Y55 VanDerWaalsContact C-N 3.28Å; H53-Y55 AromaticContact CE1-CD2 3.64Å; H53-Y55 PolarHBondContact ND1-N 3.07Å; H53-Y55 PolarHBondContact O-N 3.36Å; H53-Y55 VanDerWaalsContact O-N 3.12Å; Y55-A58 PolarHBondContact O-N 3.17Å; Y55-A59 WeakPolarHBondContact O-CB 3.39Å; Y55-A59 PolarHBondContact O-N 3.26Å
56	G	95.1	Very high	96.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.7	-49.9	176	0	0	0	0	0	110.3	L50 H53 A58 A59 F60	L50-G56 VanDerWaalsContact CD1-CA 3.47Å; L50-G56 WeakPolarHBondContact CD1-O 3.29Å; L50-G56 CarbonylContact O-C 3.44Å; H53-G56 PolarHBondContact ND1-N 3.4Å; H53-G56 WeakPolarHBondContact O-CA 3.44Å; H53-G56 PolarHBondContact O-N 2.98Å; G56-A58 VanDerWaalsContact C-N 3.33Å; G56-A58 PolarHBondContact O-N 3.01Å; G56-A59 PolarHBondContact O-N 3.12Å; G56-F60 WeakPolarHBondContact O-CB 3.49Å; G56-F60 PolarHBondContact O-N 3.06Å
57	L	96.8	Very high	96.3	Very high	37 Å²	37	48.4 Å²	48.4	19%	0.194	26%	0.255	C	S	.	.	H	α-helix	trans	-55.7	-44.8	173.6	-178.5	62.2	0	0	0	112.4	L50 L51 H53 F60 R61 I73 M77	L50-L57 PolarHBondContact O-N 3.19Å; L50-L57 VanDerWaalsContact O-N 3.14Å; L51-L57 HydrophobicContact CD2-CD1 3.93Å; H53-L57 PolarHBondContact O-N 2.75Å; L57-F60 PolarHBondContact O-N 3.2Å; L57-R61 VanDerWaalsContact O-CB 3.3Å; L57-R61 WeakPolarHBondContact O-CB 3.47Å; L57-R61 PolarHBondContact O-N 3.32Å; L57-I73 HydrophobicContact CD1-CD1 3.68Å; L57-I73 HydrophobicContact CD1-CG1 3.84Å; L57-M77 HydrophobicContact CD1-CG 4.34Å; L57-M77 HydrophobicContact CD1-SD 4.08Å; L57-M77 HydrophobicContact CD2-CG 4.43Å; L57-M77 HydrophobicContact CD2-SD 3.85Å; L57-M77 HydrophobicContact CG-SD 4.16Å
58	A	95.4	Very high	96.2	Very high	44 Å²	44	57.1 Å²	57.1	36%	0.364	29%	0.293	S	S	.	.	H	α-helix	trans	-65.1	-42.7	178.2	0	0	0	0	0	112.7	K54 Y55 G56 T62	K54-A58 WeakPolarHBondContact O-CB 3.32Å; K54-A58 PolarHBondContact O-N 3.26Å; Y55-A58 PolarHBondContact O-N 3.17Å; G56-A58 VanDerWaalsContact C-N 3.33Å; G56-A58 PolarHBondContact O-N 3.01Å; A58-T62 PolarHBondContact O-N 3.29Å; A58-T62 VanDerWaalsContact O-N 3.09Å; A58-T62 PolarHBondContact O-OG1 2.85Å
59	A	95.9	Very high	96.2	Very high	13 Å²	13	53.5 Å²	53.5	11%	0.107	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-46	175.9	0	0	0	0	0	111.1	W43 Y55 G56 T62 F63 F152 I161	W43-A59 HydrophobicContact CZ3-CB 4.34Å; Y55-A59 WeakPolarHBondContact O-CB 3.39Å; Y55-A59 PolarHBondContact O-N 3.26Å; G56-A59 PolarHBondContact O-N 3.12Å; A59-T62 WeakPolarHBondContact O-CB 3.33Å; A59-T62 PolarHBondContact O-N 2.91Å; A59-F63 PolarHBondContact O-N 3.18Å; A59-F152 HydrophobicContact CB-CE2 4.04Å; A59-F152 HydrophobicContact CB-CZ 3.93Å; A59-I161 HydrophobicContact CB-CD1 3.96Å
60	F	98.2	Very high	96.3	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.5	-44	179.3	-169.5	-119	0	0	0	112.3	F47 L50 L51 G56 L57 T62 F63 L64 I73 M144 F152	F47-F60 AromaticContact CE2-CD1 3.91Å; F47-F60 HydrophobicContact CE2-CD1 3.91Å; F47-F60 AromaticContact CE2-CE1 3.47Å; F47-F60 HydrophobicContact CE2-CE1 3.47Å; F47-F60 VanDerWaalsContact CE2-CE1 3.47Å; F47-F60 HydrophobicContact CE2-CE2 4.33Å; F47-F60 AromaticContact CE2-CZ 3.7Å; F47-F60 HydrophobicContact CE2-CZ 3.7Å; F47-F60 HydrophobicContact CZ-CD1 4.27Å; F47-F60 AromaticContact CZ-CE1 3.55Å; F47-F60 HydrophobicContact CZ-CE1 3.55Å; F47-F60 AromaticContact CZ-CZ 3.95Å; F47-F60 HydrophobicContact CZ-CZ 3.95Å; L50-F60 HydrophobicContact CD2-CB 3.89Å; L50-F60 HydrophobicContact CD2-CD1 4.46Å; L50-F60 HydrophobicContact CD2-CD2 3.81Å; L50-F60 HydrophobicContact CD2-CE2 4.5Å; L50-F60 HydrophobicContact CD2-CG 3.79Å; L50-F60 HydrophobicContact CG-CB 4.32Å; L51-F60 HydrophobicContact CD2-CD1 4.14Å; G56-F60 WeakPolarHBondContact O-CB 3.49Å; G56-F60 PolarHBondContact O-N 3.06Å; L57-F60 PolarHBondContact O-N 3.2Å; F60-T62 VanDerWaalsContact C-N 3.28Å; F60-T62 PolarHBondContact O-N 2.78Å; F60-F63 HydrophobicContact CD2-CD1 4.37Å; F60-F63 HydrophobicContact CE2-CD1 4.27Å; F60-F63 WeakPolarHBondContact O-CB 3.49Å; F60-F63 PolarHBondContact O-N 3.48Å; F60-L64 HydrophobicContact CD1-CD1 3.93Å; F60-L64 HydrophobicContact CD1-CG 4.42Å; F60-L64 HydrophobicContact CE1-CD1 3.55Å; F60-L64 HydrophobicContact CE1-CD2 4.4Å; F60-L64 HydrophobicContact CE1-CG 4.11Å; F60-L64 HydrophobicContact CE2-CD2 4.3Å; F60-L64 HydrophobicContact CE2-CG 4.4Å; F60-L64 HydrophobicContact CZ-CD1 3.98Å; F60-L64 HydrophobicContact CZ-CD2 3.97Å; F60-L64 HydrophobicContact CZ-CG 4.11Å; F60-L64 WeakPolarHBondContact O-CG 3.48Å; F60-L64 PolarHBondContact O-N 3.46Å; F60-I73 HydrophobicContact CD1-CD1 4.27Å; F60-I73 HydrophobicContact CD1-CG1 4.41Å; F60-M144 HydrophobicContact CE1-CB 4.28Å; F60-M144 HydrophobicContact CE1-CG 4.5Å; F60-M144 HydrophobicContact CE1-SD 3.9Å; F60-M144 HydrophobicContact CZ-CB 4.21Å; F60-F152 HydrophobicContact CD2-CB 3.8Å; F60-F152 HydrophobicContact CD2-CD1 4.05Å; F60-F152 HydrophobicContact CD2-CD2 4.11Å; F60-F152 AromaticContact CD2-CG 3.71Å; F60-F152 HydrophobicContact CD2-CG 3.71Å; F60-F152 HydrophobicContact CE2-CB 3.85Å; F60-F152 HydrophobicContact CE2-CG 4.27Å
61	R	98.1	Very high	96.4	Very high	90 Å²	90	52.8 Å²	52.8	34%	0.34	27%	0.272	S	S	.	.	H	α-helix	trans	-56.4	-42.8	173	-178	-170.4	-175.5	167.1	18.3	112.1	L57 L64 K65 I73 E74	L57-R61 VanDerWaalsContact O-CB 3.3Å; L57-R61 WeakPolarHBondContact O-CB 3.47Å; L57-R61 PolarHBondContact O-N 3.32Å; R61-L64 PolarHBondContact O-N 3.33Å; R61-K65 WeakPolarHBondContact O-CG 3.43Å; R61-K65 PolarHBondContact O-N 3.46Å; R61-I73 HydrophobicContact CB-CG2 4.2Å; R61-I73 HydrophobicContact CG-CG2 4.08Å; R61-E74 WeakPolarHBondContact CD-OE1 3.39Å; R61-E74 IonicContact CZ-OE1 3.51Å; R61-E74 IonicContact CZ-OE2 3.15Å; R61-E74 IonicContact NE-OE1 2.8Å; R61-E74 PolarHBondContact NE-OE1 3.04Å; R61-E74 IonicContact NH1-OE1 2.79Å; R61-E74 IonicContact NH2-OE1 2.82Å; R61-E74 PolarHBondContact NH2-OE1 3.13Å; R61-E74 IonicContact NH2-OE2 3.54Å; R61-E74 PolarHBondContact NH2-OE2 2.64Å
62	T	96.6	Very high	96.4	Very high	32 Å²	32	52.7 Å²	52.7	20%	0.196	27%	0.272	C	S	.	.	H	α-helix	trans	-66.9	-41.2	178.9	-55.1	0	0	0	0	111.4	F18 A58 A59 F60 K65 S66 M157	F18-T62 HydrophobicContact CD1-CG2 4.41Å; F18-T62 HydrophobicContact CE1-CG2 4.05Å; A58-T62 PolarHBondContact O-N 3.29Å; A58-T62 VanDerWaalsContact O-N 3.09Å; A58-T62 PolarHBondContact O-OG1 2.85Å; A59-T62 WeakPolarHBondContact O-CB 3.33Å; A59-T62 PolarHBondContact O-N 2.91Å; F60-T62 VanDerWaalsContact C-N 3.28Å; F60-T62 PolarHBondContact O-N 2.78Å; T62-K65 WeakPolarHBondContact O-CB 3.36Å; T62-K65 PolarHBondContact O-N 2.86Å; T62-S66 PolarHBondContact O-N 3.25Å; T62-S66 VanDerWaalsContact O-N 3.15Å; T62-M157 HydrophobicContact CG2-CE 3.78Å
63	F	98	Very high	96.6	Very high	10 Å²	10	48.3 Å²	48.3	4%	0.044	24%	0.236	C	C	.	.	H	α-helix	trans	-58.8	-49.9	173.5	172.2	-98.3	0	0	0	111.6	A59 F60 K65 S66 E67 S148 R151 F152 M157	A59-F63 PolarHBondContact O-N 3.18Å; F60-F63 HydrophobicContact CD2-CD1 4.37Å; F60-F63 HydrophobicContact CE2-CD1 4.27Å; F60-F63 WeakPolarHBondContact O-CB 3.49Å; F60-F63 PolarHBondContact O-N 3.48Å; F63-K65 VanDerWaalsContact C-N 3.27Å; F63-K65 PolarHBondContact O-N 2.88Å; F63-S66 WeakPolarHBondContact O-CB 3.16Å; F63-S66 PolarHBondContact O-N 3.09Å; F63-S66 PolarHBondContact O-OG 2.88Å; F63-E67 HydrophobicContact CE1-CG 4.48Å; F63-E67 WeakPolarHBondContact CE1-OE2 3.22Å; F63-E67 HydrophobicContact CE2-CG 4.43Å; F63-E67 HydrophobicContact CZ-CG 4.22Å; F63-E67 WeakPolarHBondContact CZ-OE1 3.27Å; F63-E67 WeakPolarHBondContact CZ-OE2 3.26Å; F63-E67 PolarHBondContact O-N 3.47Å; F63-S148 WeakPolarHBondContact CE1-O 3.43Å; F63-R151 HydrophobicContact CE1-CB 4.37Å; F63-R151 HydrophobicContact CZ-CB 3.79Å; F63-F152 HydrophobicContact CB-CD2 3.6Å; F63-F152 HydrophobicContact CB-CE2 4.2Å; F63-F152 HydrophobicContact CD1-CB 3.68Å; F63-F152 HydrophobicContact CD1-CD2 4.1Å; F63-F152 HydrophobicContact CD1-CG 4.35Å; F63-F152 HydrophobicContact CD2-CB 4.44Å; F63-F152 HydrophobicContact CD2-CD2 4.13Å; F63-F152 HydrophobicContact CE1-CB 3.77Å; F63-F152 HydrophobicContact CG-CB 4.03Å; F63-F152 AromaticContact CG-CD2 3.67Å; F63-F152 HydrophobicContact CG-CD2 3.67Å; F63-F152 HydrophobicContact CG-CG 4.34Å; F63-F152 HydrophobicContact CZ-CB 4.19Å; F63-M157 HydrophobicContact CB-SD 3.92Å
64	L	98.2	Very high	96.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.5	-34.3	178.1	-65.4	177.4	0	0	0	112.8	F60 R61 S66 E67 F68 S69 D70 I73 M144	F60-L64 HydrophobicContact CD1-CD1 3.93Å; F60-L64 HydrophobicContact CD1-CG 4.42Å; F60-L64 HydrophobicContact CE1-CD1 3.55Å; F60-L64 HydrophobicContact CE1-CD2 4.4Å; F60-L64 HydrophobicContact CE1-CG 4.11Å; F60-L64 HydrophobicContact CE2-CD2 4.3Å; F60-L64 HydrophobicContact CE2-CG 4.4Å; F60-L64 HydrophobicContact CZ-CD1 3.98Å; F60-L64 HydrophobicContact CZ-CD2 3.97Å; F60-L64 HydrophobicContact CZ-CG 4.11Å; F60-L64 WeakPolarHBondContact O-CG 3.48Å; F60-L64 PolarHBondContact O-N 3.46Å; R61-L64 PolarHBondContact O-N 3.33Å; L64-S66 VanDerWaalsContact C-N 3.32Å; L64-S66 PolarHBondContact O-N 3.37Å; L64-E67 CarbonylContact O-C 3.57Å; L64-E67 PolarHBondContact O-N 3.01Å; L64-E67 VanDerWaalsContact O-N 3.09Å; L64-F68 PolarHBondContact O-N 3.16Å; L64-S69 WeakPolarHBondContact CD2-OG 3.27Å; L64-S69 PolarHBondContact O-N 3.01Å; L64-S69 PolarHBondContact O-OG 3.35Å; L64-D70 HydrophobicContact CB-CB 4.01Å; L64-I73 HydrophobicContact CD1-CB 3.6Å; L64-I73 HydrophobicContact CD1-CG2 3.57Å; L64-M144 HydrophobicContact CD1-SD 3.99Å
65	K	97.4	Very high	97.1	Very high	102 Å²	102	40 Å²	40	44%	0.443	20%	0.2	S	C	.	.	H	α-helix	trans	-61.6	-39.6	172.7	-77.8	-179.7	177.8	-173.1	0	112.6	R61 T62 F63 E67 F68 D70	R61-K65 WeakPolarHBondContact O-CG 3.43Å; R61-K65 PolarHBondContact O-N 3.46Å; T62-K65 WeakPolarHBondContact O-CB 3.36Å; T62-K65 PolarHBondContact O-N 2.86Å; F63-K65 VanDerWaalsContact C-N 3.27Å; F63-K65 PolarHBondContact O-N 2.88Å; K65-E67 PolarHBondContact O-N 2.92Å; K65-F68 PolarHBondContact O-N 3.31Å; K65-D70 HydrophobicContact CB-CB 4.36Å; K65-D70 VanDerWaalsContact CE-OD2 3.28Å; K65-D70 WeakPolarHBondContact CE-OD2 3.28Å; K65-D70 HydrophobicContact CG-CB 3.52Å; K65-D70 WeakPolarHBondContact CG-OD2 3.27Å
66	S	96.3	Very high	97.4	Very high	69 Å²	69	37.8 Å²	37.8	48%	0.483	19%	0.191	S	C	.	.	H	α-helix	trans	-66.7	-20.6	175.9	72.1	0	0	0	0	113.1	T62 F63 L64	T62-S66 PolarHBondContact O-N 3.25Å; T62-S66 VanDerWaalsContact O-N 3.15Å; F63-S66 WeakPolarHBondContact O-CB 3.16Å; F63-S66 PolarHBondContact O-N 3.09Å; F63-S66 PolarHBondContact O-OG 2.88Å; L64-S66 VanDerWaalsContact C-N 3.32Å; L64-S66 PolarHBondContact O-N 3.37Å
67	E	96.5	Very high	97.6	Very high	58 Å²	58	39.6 Å²	39.6	27%	0.271	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105	8.5	178	-60.5	-167.8	149.2	0	0	113.3	F63 L64 K65 S69 R151	F63-E67 HydrophobicContact CE1-CG 4.48Å; F63-E67 WeakPolarHBondContact CE1-OE2 3.22Å; F63-E67 HydrophobicContact CE2-CG 4.43Å; F63-E67 HydrophobicContact CZ-CG 4.22Å; F63-E67 WeakPolarHBondContact CZ-OE1 3.27Å; F63-E67 WeakPolarHBondContact CZ-OE2 3.26Å; F63-E67 PolarHBondContact O-N 3.47Å; L64-E67 CarbonylContact O-C 3.57Å; L64-E67 PolarHBondContact O-N 3.01Å; L64-E67 VanDerWaalsContact O-N 3.09Å; K65-E67 PolarHBondContact O-N 2.92Å; E67-S69 PolarHBondContact O-N 3.33Å; E67-R151 IonicContact OE1-CZ 3.99Å; E67-R151 IonicContact OE1-NH1 3.63Å; E67-R151 PolarHBondContact OE1-NH1 3.31Å; E67-R151 IonicContact OE2-CZ 3.01Å; E67-R151 IonicContact OE2-NH1 3.98Å; E67-R151 PolarHBondContact OE2-NH1 3.26Å; E67-R151 IonicContact OE2-NH2 2.88Å; E67-R151 PolarHBondContact OE2-NH2 2.79Å
68	F	96.2	Very high	97.7	Very high	184 Å²	184	38.5 Å²	38.5	81%	0.807	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	37.5	-178.6	-52.5	-87.4	0	0	0	113.7	L64 K65	L64-F68 PolarHBondContact O-N 3.16Å; K65-F68 PolarHBondContact O-N 3.31Å
69	S	98	Very high	97.8	Very high	16 Å²	16	36.4 Å²	36.4	11%	0.112	18%	0.178	C	C	.	.			trans	-129.1	20.6	-177.6	61	0	0	0	0	112.9	L64 E67 E71 N72	L64-S69 WeakPolarHBondContact CD2-OG 3.27Å; L64-S69 PolarHBondContact O-N 3.01Å; L64-S69 PolarHBondContact O-OG 3.35Å; E67-S69 PolarHBondContact O-N 3.33Å; S69-E71 VanDerWaalsContact C-N 3.26Å; S69-E71 WeakPolarHBondContact CA-OE2 3.36Å; S69-E71 PolarHBondContact O-N 3.23Å; S69-N72 PolarHBondContact O-N 3.22Å; S69-N72 PolarHBondContact O-ND2 3.02Å
70	D	98.2	Very high	97.9	Very high	32 Å²	32	38.2 Å²	38.2	17%	0.171	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-13.2	-174.9	81.4	-44.9	0	0	0	113.6	L64 K65 N72 I73 E74 R109	L64-D70 HydrophobicContact CB-CB 4.01Å; K65-D70 HydrophobicContact CB-CB 4.36Å; K65-D70 VanDerWaalsContact CE-OD2 3.28Å; K65-D70 WeakPolarHBondContact CE-OD2 3.28Å; K65-D70 HydrophobicContact CG-CB 3.52Å; K65-D70 WeakPolarHBondContact CG-OD2 3.27Å; D70-N72 PolarHBondContact O-N 2.69Å; D70-I73 WeakPolarHBondContact O-CG2 3.44Å; D70-I73 PolarHBondContact O-N 3.42Å; D70-E74 WeakPolarHBondContact O-CG 3.38Å; D70-E74 PolarHBondContact O-N 2.94Å; D70-E74 VanDerWaalsContact O-N 3.13Å; D70-R109 VanDerWaalsContact C-NH2 3.31Å; D70-R109 PolarHBondContact O-NH2 2.8Å; D70-R109 IonicContact OD1-NH2 2.65Å; D70-R109 PolarHBondContact OD1-NH2 3.48Å; D70-R109 VanDerWaalsContact OD1-NH2 3.09Å; D70-R109 IonicContact OD2-NH2 3.02Å; D70-R109 PolarHBondContact OD2-NH2 2.89Å
71	E	98.5	Very high	97.9	Very high	36 Å²	36	43 Å²	43	17%	0.168	21%	0.207	C	C	.	.	H	α-helix	trans	-55.6	-33.6	171.3	73.6	-66.9	159.7	0	0	112.4	S69 E74 F75 R109 V111	S69-E71 VanDerWaalsContact C-N 3.26Å; S69-E71 WeakPolarHBondContact CA-OE2 3.36Å; S69-E71 PolarHBondContact O-N 3.23Å; E71-E74 PolarHBondContact O-N 2.85Å; E71-F75 WeakPolarHBondContact O-CB 3.15Å; E71-F75 PolarHBondContact O-N 2.82Å; E71-R109 VanDerWaalsContact CA-NH2 3.34Å; E71-R109 HydrophobicContact CB-CB 4Å; E71-V111 HydrophobicContact CG-CG1 4.19Å
72	N	98.5	Very high	97.9	Very high	8 Å²	8	38.7 Å²	38.7	4%	0.043	19%	0.191	C	C	.	.	H	α-helix	trans	-65	-47.3	-178.4	-62.3	-62.3	0	0	0	112.2	S69 D70 W76 I140 M144	S69-N72 PolarHBondContact O-N 3.22Å; S69-N72 PolarHBondContact O-ND2 3.02Å; D70-N72 PolarHBondContact O-N 2.69Å; N72-W76 WeakPolarHBondContact O-CB 3.43Å; N72-W76 PolarHBondContact O-N 3Å; N72-I140 HydrophobicContact CB-CG2 3.71Å; N72-I140 WeakPolarHBondContact O-CG2 3.31Å; N72-M144 HydrophobicContact CB-CG 3.68Å; N72-M144 HydrophobicContact CB-SD 3.57Å; N72-M144 VanDerWaalsContact CB-SD 3.57Å
73	I	98.5	Very high	97.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-74.7	-33.2	-180	-168.7	59.1	0	0	0	111.6	L51 L57 F60 R61 L64 D70 W76 M77 M144	L51-I73 HydrophobicContact CD2-CD1 3.7Å; L57-I73 HydrophobicContact CD1-CD1 3.68Å; L57-I73 HydrophobicContact CD1-CG1 3.84Å; F60-I73 HydrophobicContact CD1-CD1 4.27Å; F60-I73 HydrophobicContact CD1-CG1 4.41Å; R61-I73 HydrophobicContact CB-CG2 4.2Å; R61-I73 HydrophobicContact CG-CG2 4.08Å; L64-I73 HydrophobicContact CD1-CB 3.6Å; L64-I73 HydrophobicContact CD1-CG2 3.57Å; D70-I73 WeakPolarHBondContact O-CG2 3.44Å; D70-I73 PolarHBondContact O-N 3.42Å; I73-W76 HydrophobicContact CD1-CB 4.49Å; I73-W76 HydrophobicContact CD1-CD2 4.48Å; I73-W76 HydrophobicContact CD1-CE3 3.96Å; I73-W76 PolarHBondContact O-N 3.41Å; I73-M77 HydrophobicContact CG1-CE 4.43Å; I73-M77 HydrophobicContact CG1-CG 4.49Å; I73-M77 WeakPolarHBondContact O-CB 3.16Å; I73-M77 VanDerWaalsContact O-CG 3.31Å; I73-M77 WeakPolarHBondContact O-CG 3.32Å; I73-M77 PolarHBondContact O-N 3.01Å; I73-M144 HydrophobicContact CB-SD 3.9Å; I73-M144 HydrophobicContact CD1-CE 4.08Å; I73-M144 HydrophobicContact CD1-SD 4.19Å; I73-M144 PolarHBondContact N-SD 2.88Å
74	E	98.6	Very high	97.9	Very high	29 Å²	29	46.2 Å²	46.2	14%	0.136	22%	0.221	C	C	.	.	H	α-helix	trans	-67.1	-41.9	176.9	-66.2	-64.9	138.5	0	0	111.8	R61 D70 E71 M77 A78 F102 R109	R61-E74 WeakPolarHBondContact CD-OE1 3.39Å; R61-E74 IonicContact CZ-OE1 3.51Å; R61-E74 IonicContact CZ-OE2 3.15Å; R61-E74 IonicContact NE-OE1 2.8Å; R61-E74 PolarHBondContact NE-OE1 3.04Å; R61-E74 IonicContact NH1-OE1 2.79Å; R61-E74 IonicContact NH2-OE1 2.82Å; R61-E74 PolarHBondContact NH2-OE1 3.13Å; R61-E74 IonicContact NH2-OE2 3.54Å; R61-E74 PolarHBondContact NH2-OE2 2.64Å; D70-E74 WeakPolarHBondContact O-CG 3.38Å; D70-E74 PolarHBondContact O-N 2.94Å; D70-E74 VanDerWaalsContact O-N 3.13Å; E71-E74 PolarHBondContact O-N 2.85Å; E74-M77 HydrophobicContact CG-CE 4.31Å; E74-M77 PolarHBondContact O-N 3.46Å; E74-M77 WeakPolarHBondContact OE1-CE 3.33Å; E74-A78 WeakPolarHBondContact O-CB 3.3Å; E74-A78 PolarHBondContact O-N 2.73Å; E74-F102 HydrophobicContact CB-CE1 3.94Å; E74-F102 HydrophobicContact CB-CZ 3.98Å; E74-R109 VanDerWaalsContact CG-NH2 3.27Å
75	F	98.8	Very high	97.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.5	-50	171.1	174.4	-107.5	0	0	0	111	E71 M77 A78 C79 I98 F102 I103 V111 V136 I140	E71-F75 WeakPolarHBondContact O-CB 3.15Å; E71-F75 PolarHBondContact O-N 2.82Å; F75-M77 VanDerWaalsContact C-N 3.35Å; F75-M77 PolarHBondContact O-N 3.15Å; F75-A78 WeakPolarHBondContact O-CB 3.45Å; F75-A78 PolarHBondContact O-N 3.28Å; F75-A78 VanDerWaalsContact O-N 3.09Å; F75-C79 VanDerWaalsContact CZ-SG 3.52Å; F75-C79 PolarHBondContact O-N 3.27Å; F75-C79 PolarHBondContact O-SG 2.97Å; F75-C79 VanDerWaalsContact O-SG 3.36Å; F75-I98 HydrophobicContact CD2-CG2 4.05Å; F75-I98 HydrophobicContact CE2-CG2 3.66Å; F75-F102 HydrophobicContact CB-CB 4.43Å; F75-F102 HydrophobicContact CB-CD1 3.73Å; F75-F102 HydrophobicContact CB-CE1 4.07Å; F75-F102 HydrophobicContact CB-CG 4Å; F75-F102 HydrophobicContact CD2-CB 3.54Å; F75-F102 HydrophobicContact CD2-CD1 4.32Å; F75-F102 HydrophobicContact CD2-CD2 4.01Å; F75-F102 AromaticContact CD2-CG 3.72Å; F75-F102 HydrophobicContact CD2-CG 3.72Å; F75-F102 HydrophobicContact CE2-CB 4.21Å; F75-F102 HydrophobicContact CG-CB 4.31Å; F75-F102 HydrophobicContact CG-CD1 4.48Å; F75-F102 HydrophobicContact CG-CG 4.31Å; F75-I103 HydrophobicContact CD2-CD1 4.49Å; F75-I103 HydrophobicContact CE2-CD1 3.68Å; F75-I103 HydrophobicContact CE2-CG1 4.22Å; F75-I103 HydrophobicContact CZ-CD1 3.89Å; F75-V111 HydrophobicContact CB-CG1 3.7Å; F75-V111 HydrophobicContact CD1-CG1 4.27Å; F75-V111 HydrophobicContact CG-CG1 3.91Å; F75-V136 HydrophobicContact CE1-CG1 4.35Å; F75-V136 HydrophobicContact CE1-CG2 4.02Å; F75-V136 HydrophobicContact CZ-CB 4.36Å; F75-V136 HydrophobicContact CZ-CG1 3.73Å; F75-V136 HydrophobicContact CZ-CG2 3.86Å; F75-I140 HydrophobicContact CD1-CB 3.99Å; F75-I140 HydrophobicContact CD1-CG1 3.72Å; F75-I140 HydrophobicContact CD1-CG2 4.08Å; F75-I140 HydrophobicContact CE1-CB 4.26Å; F75-I140 HydrophobicContact CE1-CG1 3.79Å
76	W	98.6	Very high	97.7	Very high	33 Å²	33	53 Å²	53	13%	0.125	25%	0.252	C	S	.	.	H	α-helix	trans	-58.3	-45	179.7	-178.3	92.8	0	0	0	112.1	L51 N72 I73 A78 C79 E80 Q137 Y141 M144	L51-W76 HydrophobicContact CB-CH2 3.92Å; L51-W76 HydrophobicContact CB-CZ2 4.41Å; L51-W76 HydrophobicContact CB-CZ3 4.31Å; L51-W76 HydrophobicContact CD1-CD2 4.11Å; L51-W76 HydrophobicContact CD1-CE3 4.27Å; L51-W76 HydrophobicContact CD1-CH2 3.85Å; L51-W76 HydrophobicContact CD1-CZ2 3.65Å; L51-W76 HydrophobicContact CD1-CZ3 4.15Å; L51-W76 HydrophobicContact CG-CH2 4.49Å; N72-W76 WeakPolarHBondContact O-CB 3.43Å; N72-W76 PolarHBondContact O-N 3Å; I73-W76 HydrophobicContact CD1-CB 4.49Å; I73-W76 HydrophobicContact CD1-CD2 4.48Å; I73-W76 HydrophobicContact CD1-CE3 3.96Å; I73-W76 PolarHBondContact O-N 3.41Å; W76-A78 PolarHBondContact O-N 3.26Å; W76-C79 WeakPolarHBondContact O-CB 3.32Å; W76-C79 PolarHBondContact O-N 2.93Å; W76-E80 HydrophobicContact CD2-CG 4.19Å; W76-E80 HydrophobicContact CE3-CG 3.98Å; W76-E80 HydrophobicContact CH2-CG 3.61Å; W76-E80 HydrophobicContact CZ2-CG 3.83Å; W76-E80 HydrophobicContact CZ3-CG 3.69Å; W76-E80 PolarHBondContact O-N 3.09Å; W76-Q137 HydrophobicContact CG-CG 4.34Å; W76-Q137 PolarHBondContact O-NE2 2.62Å; W76-Y141 AromaticContact NE1-CD2 3.73Å; W76-M144 HydrophobicContact CB-CE 3.95Å; W76-M144 HydrophobicContact CG-CE 4.23Å
77	M	98.4	Very high	97.7	Very high	39 Å²	39	52.1 Å²	52.1	19%	0.192	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-38.7	175.1	-71.3	-172.8	-62.5	0	0	112.2	L57 I73 E74 F75 C79 E80 E81	L57-M77 HydrophobicContact CD1-CG 4.34Å; L57-M77 HydrophobicContact CD1-SD 4.08Å; L57-M77 HydrophobicContact CD2-CG 4.43Å; L57-M77 HydrophobicContact CD2-SD 3.85Å; L57-M77 HydrophobicContact CG-SD 4.16Å; I73-M77 HydrophobicContact CG1-CE 4.43Å; I73-M77 HydrophobicContact CG1-CG 4.49Å; I73-M77 WeakPolarHBondContact O-CB 3.16Å; I73-M77 VanDerWaalsContact O-CG 3.31Å; I73-M77 WeakPolarHBondContact O-CG 3.32Å; I73-M77 PolarHBondContact O-N 3.01Å; E74-M77 HydrophobicContact CG-CE 4.31Å; E74-M77 PolarHBondContact O-N 3.46Å; E74-M77 WeakPolarHBondContact OE1-CE 3.33Å; F75-M77 VanDerWaalsContact C-N 3.35Å; F75-M77 PolarHBondContact O-N 3.15Å; M77-C79 VanDerWaalsContact C-N 3.26Å; M77-C79 PolarHBondContact O-N 3Å; M77-E80 WeakPolarHBondContact O-CB 3.29Å; M77-E80 PolarHBondContact O-N 3.45Å; M77-E81 PolarHBondContact O-N 3.28Å
78	A	98.4	Very high	97.6	Very high	13 Å²	13	53.5 Å²	53.5	11%	0.107	26%	0.262	C	S	.	.	H	α-helix	trans	-62.3	-36	175.8	0	0	0	0	0	111.7	E74 F75 W76 Y82 I98 F102	E74-A78 WeakPolarHBondContact O-CB 3.3Å; E74-A78 PolarHBondContact O-N 2.73Å; F75-A78 WeakPolarHBondContact O-CB 3.45Å; F75-A78 PolarHBondContact O-N 3.28Å; F75-A78 VanDerWaalsContact O-N 3.09Å; W76-A78 PolarHBondContact O-N 3.26Å; A78-Y82 VanDerWaalsContact O-CB 3.3Å; A78-Y82 WeakPolarHBondContact O-CB 3.18Å; A78-Y82 PolarHBondContact O-N 3.4Å; A78-I98 HydrophobicContact CB-CD1 4.11Å; A78-I98 HydrophobicContact CB-CG1 4.09Å; A78-F102 HydrophobicContact CB-CE2 4.34Å
79	C	98.4	Very high	97.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-67.4	-41.7	172.1	-66.7	0	0	0	0	112.6	F75 W76 M77 E81 Y82 K83 Q137	F75-C79 VanDerWaalsContact CZ-SG 3.52Å; F75-C79 PolarHBondContact O-N 3.27Å; F75-C79 PolarHBondContact O-SG 2.97Å; F75-C79 VanDerWaalsContact O-SG 3.36Å; W76-C79 WeakPolarHBondContact O-CB 3.32Å; W76-C79 PolarHBondContact O-N 2.93Å; M77-C79 VanDerWaalsContact C-N 3.26Å; M77-C79 PolarHBondContact O-N 3Å; C79-E81 VanDerWaalsContact C-N 3.3Å; C79-E81 PolarHBondContact O-N 3.3Å; C79-Y82 WeakPolarHBondContact O-CB 3.37Å; C79-Y82 PolarHBondContact O-N 3.43Å; C79-K83 WeakPolarHBondContact O-CG 3.4Å; C79-K83 PolarHBondContact O-N 3.04Å; C79-Q137 HydrophobicContact CB-CB 4.11Å; C79-Q137 HydrophobicContact CB-CG 3.73Å
80	E	98.1	Very high	97.6	Very high	51 Å²	51	56.1 Å²	56.1	24%	0.238	28%	0.28	C	S	.	.	H	α-helix	trans	-57.5	-43.7	173.7	-72.1	-53.7	115.1	0	0	112.1	W76 M77 K83 K84 Q137	W76-E80 HydrophobicContact CD2-CG 4.19Å; W76-E80 HydrophobicContact CE3-CG 3.98Å; W76-E80 HydrophobicContact CH2-CG 3.61Å; W76-E80 HydrophobicContact CZ2-CG 3.83Å; W76-E80 HydrophobicContact CZ3-CG 3.69Å; W76-E80 PolarHBondContact O-N 3.09Å; M77-E80 WeakPolarHBondContact O-CB 3.29Å; M77-E80 PolarHBondContact O-N 3.45Å; E80-K83 WeakPolarHBondContact OE1-CE 3.33Å; E80-K83 IonicContact OE1-NZ 3.86Å; E80-K83 PolarHBondContact OE1-NZ 3.44Å; E80-K83 IonicContact OE2-NZ 2.73Å; E80-K84 WeakPolarHBondContact O-CE 3.46Å; E80-K84 WeakPolarHBondContact O-CG 3.33Å; E80-Q137 PolarHBondContact OE1-NE2 2.86Å
81	E	97.6	Very high	97.5	Very high	100 Å²	100	55.1 Å²	55.1	47%	0.467	28%	0.275	S	S	.	.	H	α-helix	trans	-70.1	-37.6	176.8	-67.7	-54.9	116.1	0	0	112.2	M77 C79 K83 K84	M77-E81 PolarHBondContact O-N 3.28Å; C79-E81 VanDerWaalsContact C-N 3.3Å; C79-E81 PolarHBondContact O-N 3.3Å; E81-K83 VanDerWaalsContact C-N 3.34Å; E81-K83 PolarHBondContact O-N 2.86Å; E81-K84 PolarHBondContact O-N 3.48Å; E81-K84 IonicContact OE1-NZ 3.87Å; E81-K84 PolarHBondContact OE1-NZ 3.36Å
82	Y	98.2	Very high	97.5	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.2	-43.8	175.9	174.4	-93.7	0	0	0	112.1	A78 C79 K84 I85 L91 K94 A95 I98 P128 T129 L133	A78-Y82 VanDerWaalsContact O-CB 3.3Å; A78-Y82 WeakPolarHBondContact O-CB 3.18Å; A78-Y82 PolarHBondContact O-N 3.4Å; C79-Y82 WeakPolarHBondContact O-CB 3.37Å; C79-Y82 PolarHBondContact O-N 3.43Å; Y82-K84 PolarHBondContact O-N 3.22Å; Y82-I85 WeakPolarHBondContact O-CB 3.47Å; Y82-I85 PolarHBondContact O-N 3.05Å; Y82-I85 VanDerWaalsContact O-N 3.11Å; Y82-L91 HydrophobicContact CD1-CD1 4.43Å; Y82-L91 HydrophobicContact CD2-CD1 3.93Å; Y82-L91 HydrophobicContact CE1-CD1 3.97Å; Y82-L91 HydrophobicContact CE2-CD1 3.4Å; Y82-L91 HydrophobicContact CE2-CG 3.81Å; Y82-L91 HydrophobicContact CG-CD1 4.41Å; Y82-L91 VanDerWaalsContact CZ-CD1 3.42Å; Y82-K94 HydrophobicContact CD2-CB 4.08Å; Y82-K94 HydrophobicContact CD2-CG 3.83Å; Y82-A95 HydrophobicContact CE2-CB 3.83Å; Y82-I98 HydrophobicContact CD2-CD1 4.15Å; Y82-I98 HydrophobicContact CG-CD1 4.21Å; Y82-P128 VanDerWaalsContact OH-CB 3.29Å; Y82-P128 WeakPolarHBondContact OH-CB 3.37Å; Y82-T129 WeakPolarHBondContact CE1-O 3.37Å; Y82-T129 VanDerWaalsContact CZ-O 3.31Å; Y82-T129 PolarHBondContact OH-O 3.3Å; Y82-L133 HydrophobicContact CD1-CD1 3.8Å; Y82-L133 HydrophobicContact CD1-CG 4.36Å; Y82-L133 HydrophobicContact CD2-CD1 4.28Å; Y82-L133 HydrophobicContact CE1-CD1 4.12Å; Y82-L133 HydrophobicContact CE1-CG 4.29Å; Y82-L133 HydrophobicContact CG-CD1 3.88Å
83	K	97.5	Very high	97.4	Very high	73 Å²	73	59 Å²	59	32%	0.317	30%	0.304	S	S	.	.	H	α-helix	trans	-60.6	-25.2	179.2	-75.8	-177.5	-67.8	-170.8	0	114	C79 E80 E81 I85 P130 Q137	C79-K83 WeakPolarHBondContact O-CG 3.4Å; C79-K83 PolarHBondContact O-N 3.04Å; E80-K83 WeakPolarHBondContact OE1-CE 3.33Å; E80-K83 IonicContact OE1-NZ 3.86Å; E80-K83 PolarHBondContact OE1-NZ 3.44Å; E80-K83 IonicContact OE2-NZ 2.73Å; E81-K83 VanDerWaalsContact C-N 3.34Å; E81-K83 PolarHBondContact O-N 2.86Å; K83-I85 VanDerWaalsContact C-N 3.34Å; K83-P130 WeakPolarHBondContact CG-O 3.48Å; K83-Q137 VanDerWaalsContact CE-OE1 3.28Å
84	K	97.1	Very high	97.4	Very high	128 Å²	128	61.9 Å²	61.9	56%	0.557	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-9.9	-179.4	-61.9	168	-166.7	169.6	0	113.1	E80 E81 Y82 K86	E80-K84 WeakPolarHBondContact O-CE 3.46Å; E80-K84 WeakPolarHBondContact O-CG 3.33Å; E81-K84 PolarHBondContact O-N 3.48Å; E81-K84 IonicContact OE1-NZ 3.87Å; E81-K84 PolarHBondContact OE1-NZ 3.36Å; Y82-K84 PolarHBondContact O-N 3.22Å; K84-K86 PolarHBondContact O-N 3.43Å
85	I	97.3	Very high	97.4	Very high	35 Å²	35	60.6 Å²	60.6	18%	0.179	31%	0.311	C	S	.	.			trans	-76.3	123.4	-175.6	-61.1	174.4	0	0	0	110.6	Y82 K83 S87 K90 L91 K94	Y82-I85 WeakPolarHBondContact O-CB 3.47Å; Y82-I85 PolarHBondContact O-N 3.05Å; Y82-I85 VanDerWaalsContact O-N 3.11Å; K83-I85 VanDerWaalsContact C-N 3.34Å; I85-S87 WeakPolarHBondContact CG2-O 3.24Å; I85-K90 HydrophobicContact CG2-CB 3.67Å; I85-L91 HydrophobicContact CB-CD1 3.96Å; I85-L91 HydrophobicContact CG2-CB 4.04Å; I85-L91 HydrophobicContact CG2-CD1 4.2Å; I85-K94 HydrophobicContact CD1-CB 3.59Å; I85-K94 HydrophobicContact CD1-CG 3.7Å
86	K	94.6	Very high	97.3	Very high	209 Å²	209	64.6 Å²	64.6	91%	0.909	33%	0.332	S	S	*	.			trans	-97.5	-21.1	176.3	-56.5	-174.2	-178.4	-177	0	114.1	K84	K84-K86 PolarHBondContact O-N 3.43Å
87	S	96.7	Very high	97.3	Very high	51 Å²	51	69 Å²	69	36%	0.357	35%	0.353	S	S	.	.			trans	-86.1	121.9	-178.2	165.2	0	0	0	0	110.4	I85 T89 K90 L91	I85-S87 WeakPolarHBondContact CG2-O 3.24Å; S87-T89 VanDerWaalsContact C-N 3.34Å; S87-T89 PolarHBondContact O-N 3.38Å; S87-K90 PolarHBondContact O-N 3.13Å; S87-K90 VanDerWaalsContact O-N 3.14Å; S87-K90 PolarHBondContact OG-N 3.34Å; S87-L91 WeakPolarHBondContact O-CB 3.17Å; S87-L91 PolarHBondContact O-N 3.09Å
88	S	94.5	Very high	97.3	Very high	87 Å²	87	67.3 Å²	67.3	61%	0.608	34%	0.344	S	S	*	.	H	α-helix	trans	-54.5	-46.4	178.7	172.9	0	0	0	0	112.4	K90 L91 V92	S88-K90 PolarHBondContact O-N 3.18Å; S88-L91 VanDerWaalsContact O-CB 3.32Å; S88-L91 WeakPolarHBondContact O-CB 3.47Å; S88-L91 PolarHBondContact O-N 2.73Å; S88-L91 VanDerWaalsContact O-N 3.09Å; S88-V92 WeakPolarHBondContact O-CG2 3.48Å; S88-V92 PolarHBondContact O-N 2.56Å
89	T	95.9	Very high	97.3	Very high	114 Å²	114	68.2 Å²	68.2	70%	0.699	35%	0.346	S	S	*	.	H	α-helix	trans	-62.2	-40.9	177.9	-44.1	0	0	0	0	112.8	S87 L91 S93	S87-T89 VanDerWaalsContact C-N 3.34Å; S87-T89 PolarHBondContact O-N 3.38Å; T89-L91 VanDerWaalsContact C-N 3.3Å; T89-S93 PolarHBondContact O-N 3.13Å; T89-S93 VanDerWaalsContact O-N 3.11Å; T89-S93 PolarHBondContact O-OG 2.89Å
90	K	96.9	Very high	97.3	Very high	141 Å²	141	74.6 Å²	74.6	61%	0.613	37%	0.373	S	S	*	.	H	α-helix	trans	-68.1	-33.6	175.2	-69.1	-172.4	-179.7	-178.2	0	111.8	I85 S87 S88 S93 K94	I85-K90 HydrophobicContact CG2-CB 3.67Å; S87-K90 PolarHBondContact O-N 3.13Å; S87-K90 VanDerWaalsContact O-N 3.14Å; S87-K90 PolarHBondContact OG-N 3.34Å; S88-K90 PolarHBondContact O-N 3.18Å; K90-S93 WeakPolarHBondContact CA-OG 3.3Å; K90-S93 PolarHBondContact O-OG 3.34Å; K90-K94 VanDerWaalsContact O-CB 3.25Å; K90-K94 WeakPolarHBondContact O-CB 2.99Å; K90-K94 PolarHBondContact O-N 3.09Å
91	L	96.8	Very high	97.3	Very high	11 Å²	11	75 Å²	75	6%	0.058	38%	0.375	C	S	.	.	H	α-helix	trans	-66.1	-49.8	178.6	-166.9	73	0	0	0	110.2	Y82 I85 S87 S88 T89 S93 K94 A95 P128 P130	Y82-L91 HydrophobicContact CD1-CD1 4.43Å; Y82-L91 HydrophobicContact CD2-CD1 3.93Å; Y82-L91 HydrophobicContact CE1-CD1 3.97Å; Y82-L91 HydrophobicContact CE2-CD1 3.4Å; Y82-L91 HydrophobicContact CE2-CG 3.81Å; Y82-L91 HydrophobicContact CG-CD1 4.41Å; Y82-L91 VanDerWaalsContact CZ-CD1 3.42Å; I85-L91 HydrophobicContact CB-CD1 3.96Å; I85-L91 HydrophobicContact CG2-CB 4.04Å; I85-L91 HydrophobicContact CG2-CD1 4.2Å; S87-L91 WeakPolarHBondContact O-CB 3.17Å; S87-L91 PolarHBondContact O-N 3.09Å; S88-L91 VanDerWaalsContact O-CB 3.32Å; S88-L91 WeakPolarHBondContact O-CB 3.47Å; S88-L91 PolarHBondContact O-N 2.73Å; S88-L91 VanDerWaalsContact O-N 3.09Å; T89-L91 VanDerWaalsContact C-N 3.3Å; L91-S93 PolarHBondContact O-N 3.38Å; L91-K94 PolarHBondContact O-N 3.36Å; L91-A95 VanDerWaalsContact O-CB 3.29Å; L91-A95 WeakPolarHBondContact O-CB 3.33Å; L91-A95 PolarHBondContact O-N 2.94Å; L91-P128 HydrophobicContact CD2-CB 4.35Å; L91-P128 WeakPolarHBondContact CD2-O 3.22Å; L91-P128 HydrophobicContact CG-CB 4.28Å; L91-P130 HydrophobicContact CD2-CG 4.5Å
92	V	97.4	Very high	97.3	Very high	56 Å²	56	70.4 Å²	70.4	34%	0.339	35%	0.354	S	S	.	.	H	α-helix	trans	-60	-46.1	177	174.7	0	0	0	0	111.8	S88 A95 N96 P128	S88-V92 WeakPolarHBondContact O-CG2 3.48Å; S88-V92 PolarHBondContact O-N 2.56Å; V92-A95 PolarHBondContact O-N 3.23Å; V92-N96 PolarHBondContact O-N 3.4Å; V92-N96 PolarHBondContact O-ND2 3.22Å; V92-N96 VanDerWaalsContact O-ND2 3.15Å; V92-P128 HydrophobicContact CG2-CG 4.11Å
93	S	97.4	Very high	97.3	Very high	70 Å²	70	70.4 Å²	70.4	49%	0.49	35%	0.354	S	S	.	.	H	α-helix	trans	-64.8	-40.6	178.3	51.2	0	0	0	0	112.6	T89 K90 L91 K97	T89-S93 PolarHBondContact O-N 3.13Å; T89-S93 VanDerWaalsContact O-N 3.11Å; T89-S93 PolarHBondContact O-OG 2.89Å; K90-S93 WeakPolarHBondContact CA-OG 3.3Å; K90-S93 PolarHBondContact O-OG 3.34Å; L91-S93 PolarHBondContact O-N 3.38Å; S93-K97 PolarHBondContact O-N 3.01Å; S93-K97 VanDerWaalsContact O-N 3.1Å
94	K	98.1	Very high	97.3	Very high	60 Å²	60	71.1 Å²	71.1	26%	0.261	36%	0.358	S	S	.	.	H	α-helix	trans	-68.1	-40.9	175.6	-173.6	72.4	176.9	-174.6	0	112.1	Y82 I85 K90 L91 K97 I98	Y82-K94 HydrophobicContact CD2-CB 4.08Å; Y82-K94 HydrophobicContact CD2-CG 3.83Å; I85-K94 HydrophobicContact CD1-CB 3.59Å; I85-K94 HydrophobicContact CD1-CG 3.7Å; K90-K94 VanDerWaalsContact O-CB 3.25Å; K90-K94 WeakPolarHBondContact O-CB 2.99Å; K90-K94 PolarHBondContact O-N 3.09Å; L91-K94 PolarHBondContact O-N 3.36Å; K94-K97 PolarHBondContact O-N 3.49Å; K94-I98 HydrophobicContact CD-CD1 4.45Å; K94-I98 HydrophobicContact CG-CD1 3.98Å; K94-I98 HydrophobicContact CG-CG1 4.47Å; K94-I98 WeakPolarHBondContact O-CG1 3.34Å; K94-I98 PolarHBondContact O-N 3.01Å
95	A	97.9	Very high	97.2	Very high	1 Å²	1	69.4 Å²	69.4	1%	0.008	36%	0.358	C	S	.	.	H	α-helix	trans	-55.1	-51.7	174.1	0	0	0	0	0	111.3	Y82 L91 V92 K97 I98 F99 L125 P128	Y82-A95 HydrophobicContact CE2-CB 3.83Å; L91-A95 VanDerWaalsContact O-CB 3.29Å; L91-A95 WeakPolarHBondContact O-CB 3.33Å; L91-A95 PolarHBondContact O-N 2.94Å; V92-A95 PolarHBondContact O-N 3.23Å; A95-K97 VanDerWaalsContact C-N 3.31Å; A95-K97 PolarHBondContact O-N 3Å; A95-I98 PolarHBondContact O-N 3.35Å; A95-F99 WeakPolarHBondContact O-CB 3.31Å; A95-F99 PolarHBondContact O-N 3.34Å; A95-L125 HydrophobicContact CB-CD2 3.85Å; A95-P128 HydrophobicContact CB-CB 3.96Å; A95-P128 HydrophobicContact CB-CG 3.87Å
96	N	97.5	Very high	97.1	Very high	85 Å²	85	76.1 Å²	76.1	46%	0.455	39%	0.389	S	S	.	.	H	α-helix	trans	-60.4	-39.4	177.8	-77.9	-42.1	0	0	0	112.6	V92 K100	V92-N96 PolarHBondContact O-N 3.4Å; V92-N96 PolarHBondContact O-ND2 3.22Å; V92-N96 VanDerWaalsContact O-ND2 3.15Å; N96-K100 WeakPolarHBondContact O-CG 3.48Å; N96-K100 PolarHBondContact O-N 3.22Å; N96-K100 VanDerWaalsContact O-N 3.15Å
97	K	98.2	Very high	97.2	Very high	126 Å²	126	66.8 Å²	66.8	55%	0.548	35%	0.35	S	S	.	.	H	α-helix	trans	-63.7	-49.1	176	-173.8	178.2	178.5	178	0	111.4	S93 K94 A95 F99 K100 E101	S93-K97 PolarHBondContact O-N 3.01Å; S93-K97 VanDerWaalsContact O-N 3.1Å; K94-K97 PolarHBondContact O-N 3.49Å; A95-K97 VanDerWaalsContact C-N 3.31Å; A95-K97 PolarHBondContact O-N 3Å; K97-F99 VanDerWaalsContact C-N 3.3Å; K97-F99 PolarHBondContact O-N 3.47Å; K97-K100 PolarHBondContact O-N 2.54Å; K97-E101 WeakPolarHBondContact CE-OE2 3.36Å; K97-E101 VanDerWaalsContact O-CB 3.27Å; K97-E101 WeakPolarHBondContact O-CB 3.38Å; K97-E101 PolarHBondContact O-N 3.22Å
98	I	98.4	Very high	97.2	Very high	2 Å²	2	69.7 Å²	69.7	1%	0.01	37%	0.368	C	S	.	.	H	α-helix	trans	-60.8	-42.8	179.1	-69	170.8	0	0	0	110.5	F75 A78 Y82 K94 A95 K100 E101 F102 L133	F75-I98 HydrophobicContact CD2-CG2 4.05Å; F75-I98 HydrophobicContact CE2-CG2 3.66Å; A78-I98 HydrophobicContact CB-CD1 4.11Å; A78-I98 HydrophobicContact CB-CG1 4.09Å; Y82-I98 HydrophobicContact CD2-CD1 4.15Å; Y82-I98 HydrophobicContact CG-CD1 4.21Å; K94-I98 HydrophobicContact CD-CD1 4.45Å; K94-I98 HydrophobicContact CG-CD1 3.98Å; K94-I98 HydrophobicContact CG-CG1 4.47Å; K94-I98 WeakPolarHBondContact O-CG1 3.34Å; K94-I98 PolarHBondContact O-N 3.01Å; A95-I98 PolarHBondContact O-N 3.35Å; I98-K100 PolarHBondContact O-N 2.82Å; I98-E101 PolarHBondContact O-N 3.22Å; I98-F102 HydrophobicContact CG2-CD2 4.31Å; I98-F102 PolarHBondContact O-N 2.99Å; I98-L133 HydrophobicContact CB-CD1 4.44Å; I98-L133 HydrophobicContact CD1-CD1 3.63Å; I98-L133 HydrophobicContact CG2-CD1 3.94Å; I98-L133 HydrophobicContact CG2-CD2 4.43Å
99	F	98	Very high	97.4	Very high	33 Å²	33	68.1 Å²	68.1	15%	0.145	35%	0.348	C	S	.	.	I	π-helix	trans	-58.6	-51	179.4	-176.5	-96.5	0	0	0	112	A95 K97 E101 I103 E104 K122 L125	A95-F99 WeakPolarHBondContact O-CB 3.31Å; A95-F99 PolarHBondContact O-N 3.34Å; K97-F99 VanDerWaalsContact C-N 3.3Å; K97-F99 PolarHBondContact O-N 3.47Å; F99-E101 VanDerWaalsContact C-N 3.33Å; F99-E101 PolarHBondContact O-N 3.41Å; F99-I103 HydrophobicContact CD2-CB 3.79Å; F99-I103 HydrophobicContact CD2-CG2 3.7Å; F99-I103 HydrophobicContact CE2-CB 4.19Å; F99-I103 HydrophobicContact CE2-CG2 3.68Å; F99-I103 HydrophobicContact CG-CB 4.42Å; F99-I103 WeakPolarHBondContact O-CA 3.49Å; F99-I103 PolarHBondContact O-N 3.46Å; F99-E104 HydrophobicContact CD1-CB 4.13Å; F99-E104 HydrophobicContact CE1-CB 3.77Å; F99-E104 HydrophobicContact CE1-CG 4.09Å; F99-E104 HydrophobicContact CZ-CB 4.28Å; F99-E104 PolarHBondContact O-N 3.11Å; F99-K122 HydrophobicContact CE2-CB 3.92Å; F99-K122 HydrophobicContact CE2-CG 4.09Å; F99-K122 HydrophobicContact CZ-CB 4.39Å; F99-K122 HydrophobicContact CZ-CD 4.37Å; F99-K122 HydrophobicContact CZ-CG 4.12Å; F99-L125 HydrophobicContact CB-CD1 4.03Å; F99-L125 HydrophobicContact CD2-CD1 3.87Å; F99-L125 HydrophobicContact CG-CD1 4.37Å
100	K	98.2	Very high	97.5	Very high	134 Å²	134	65.9 Å²	65.9	58%	0.583	33%	0.33	S	S	*	.	I	π-helix	trans	-70.7	-25.2	-178.9	-69.7	-177.2	174.4	-172.1	0	114.5	N96 K97 I98 S107	N96-K100 WeakPolarHBondContact O-CG 3.48Å; N96-K100 PolarHBondContact O-N 3.22Å; N96-K100 VanDerWaalsContact O-N 3.15Å; K97-K100 PolarHBondContact O-N 2.54Å; I98-K100 PolarHBondContact O-N 2.82Å; K100-S107 PolarHBondContact O-OG 3.04Å
101	E	98.4	Very high	97.5	Very high	58 Å²	58	59.2 Å²	59.2	27%	0.271	30%	0.301	S	S	.	.	I	π-helix	trans	-87.6	-33.8	-177.3	-170.7	174.5	167	0	0	112	K97 I98 F99 S107 R109	K97-E101 WeakPolarHBondContact CE-OE2 3.36Å; K97-E101 VanDerWaalsContact O-CB 3.27Å; K97-E101 WeakPolarHBondContact O-CB 3.38Å; K97-E101 PolarHBondContact O-N 3.22Å; I98-E101 PolarHBondContact O-N 3.22Å; F99-E101 VanDerWaalsContact C-N 3.33Å; F99-E101 PolarHBondContact O-N 3.41Å; E101-S107 WeakPolarHBondContact O-CB 3.39Å; E101-R109 CarbonylContact O-C 3.38Å; E101-R109 WeakPolarHBondContact O-CA 3.41Å; E101-R109 WeakPolarHBondContact O-CB 3.03Å; E101-R109 PolarHBondContact O-N 2.79Å; E101-R109 VanDerWaalsContact O-N 3.17Å
102	F	98.4	Very high	97.5	Very high	4 Å²	4	64.9 Å²	64.9	2%	0.018	33%	0.331	C	S	.	.	I	π-helix	trans	-128.8	-23.5	-169.6	-59.4	-81.1	0	0	0	116	E74 F75 A78 I98 R109 E110 V111	E74-F102 HydrophobicContact CB-CE1 3.94Å; E74-F102 HydrophobicContact CB-CZ 3.98Å; F75-F102 HydrophobicContact CB-CB 4.43Å; F75-F102 HydrophobicContact CB-CD1 3.73Å; F75-F102 HydrophobicContact CB-CE1 4.07Å; F75-F102 HydrophobicContact CB-CG 4Å; F75-F102 HydrophobicContact CD2-CB 3.54Å; F75-F102 HydrophobicContact CD2-CD1 4.32Å; F75-F102 HydrophobicContact CD2-CD2 4.01Å; F75-F102 AromaticContact CD2-CG 3.72Å; F75-F102 HydrophobicContact CD2-CG 3.72Å; F75-F102 HydrophobicContact CE2-CB 4.21Å; F75-F102 HydrophobicContact CG-CB 4.31Å; F75-F102 HydrophobicContact CG-CD1 4.48Å; F75-F102 HydrophobicContact CG-CG 4.31Å; A78-F102 HydrophobicContact CB-CE2 4.34Å; I98-F102 HydrophobicContact CG2-CD2 4.31Å; I98-F102 PolarHBondContact O-N 2.99Å; F102-R109 WeakPolarHBondContact CA-O 3.16Å; F102-R109 HydrophobicContact CD1-CB 3.94Å; F102-R109 VanDerWaalsContact CD1-O 3.27Å; F102-R109 WeakPolarHBondContact CD1-O 3.33Å; F102-R109 HydrophobicContact CE1-CB 3.92Å; F102-E110 WeakPolarHBondContact O-CA 3.42Å; F102-V111 HydrophobicContact CB-CG1 4.33Å; F102-V111 HydrophobicContact CD1-CG1 4.25Å; F102-V111 WeakPolarHBondContact O-CG2 3.46Å; F102-V111 PolarHBondContact O-N 3.21Å
103	I	97.9	Very high	97.4	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.005	32%	0.318	C	S	.	.	I	π-helix	trans	-111.2	-39.3	-167.4	-55.6	-63	0	0	0	113.1	F75 F99 V111 I113 R118 T121 V136	F75-I103 HydrophobicContact CD2-CD1 4.49Å; F75-I103 HydrophobicContact CE2-CD1 3.68Å; F75-I103 HydrophobicContact CE2-CG1 4.22Å; F75-I103 HydrophobicContact CZ-CD1 3.89Å; F99-I103 HydrophobicContact CD2-CB 3.79Å; F99-I103 HydrophobicContact CD2-CG2 3.7Å; F99-I103 HydrophobicContact CE2-CB 4.19Å; F99-I103 HydrophobicContact CE2-CG2 3.68Å; F99-I103 HydrophobicContact CG-CB 4.42Å; F99-I103 WeakPolarHBondContact O-CA 3.49Å; F99-I103 PolarHBondContact O-N 3.46Å; I103-V111 HydrophobicContact CD1-CG2 3.96Å; I103-I113 HydrophobicContact CD1-CD1 4.05Å; I103-I113 HydrophobicContact CG2-CD1 4.34Å; I103-R118 HydrophobicContact CG2-CG 3.95Å; I103-R118 WeakPolarHBondContact O-CD 3.4Å; I103-R118 PolarHBondContact O-NH1 2.92Å; I103-T121 HydrophobicContact CD1-CG2 4.49Å; I103-T121 HydrophobicContact CG1-CG2 4.37Å; I103-T121 HydrophobicContact CG2-CG2 4.1Å; I103-V136 HydrophobicContact CD1-CG2 4Å
104	E	96.9	Very high	97.3	Very high	88 Å²	88	63.4 Å²	63.4	41%	0.411	32%	0.316	S	S	.	.	S	Bend	trans	-58.9	143.5	-179.8	-173.3	166.3	-121.5	0	0	110.4	F99 Q106 S107	F99-E104 HydrophobicContact CD1-CB 4.13Å; F99-E104 HydrophobicContact CE1-CB 3.77Å; F99-E104 HydrophobicContact CE1-CG 4.09Å; F99-E104 HydrophobicContact CZ-CB 4.28Å; F99-E104 PolarHBondContact O-N 3.11Å; E104-Q106 PolarHBondContact O-N 3.07Å; E104-S107 VanDerWaalsContact C-OG 3.31Å; E104-S107 WeakPolarHBondContact CA-OG 3.46Å; E104-S107 WeakPolarHBondContact CB-OG 3.45Å; E104-S107 PolarHBondContact N-OG 3.17Å; E104-S107 VanDerWaalsContact N-OG 3.1Å; E104-S107 VanDerWaalsContact O-CB 3.24Å; E104-S107 WeakPolarHBondContact O-CB 3.4Å; E104-S107 PolarHBondContact O-N 3.26Å; E104-S107 PolarHBondContact O-OG 3.16Å
105	V	96	Very high	97.1	Very high	92 Å²	92	68.4 Å²	68.4	56%	0.558	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	132.1	175	177.3	0	0	0	0	108.6	S107	V105-S107 PolarHBondContact O-N 2.65Å
106	Q	95.5	Very high	97.1	Very high	176 Å²	176	77.9 Å²	77.9	82%	0.822	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	21.7	-175.3	-57.5	166.4	-38.2	0	0	114	E104 E110	E104-Q106 PolarHBondContact O-N 3.07Å; Q106-E110 PolarHBondContact N-OE2 2.72Å
107	S	96.8	Very high	97	Very high	12 Å²	12	74 Å²	74	8%	0.084	35%	0.349	C	S	.	.			trans	-56	145.5	168	-67.6	0	0	0	0	110.4	K100 E101 E104 V105 R109 E110	K100-S107 PolarHBondContact O-OG 3.04Å; E101-S107 WeakPolarHBondContact O-CB 3.39Å; E104-S107 VanDerWaalsContact C-OG 3.31Å; E104-S107 WeakPolarHBondContact CA-OG 3.46Å; E104-S107 WeakPolarHBondContact CB-OG 3.45Å; E104-S107 PolarHBondContact N-OG 3.17Å; E104-S107 VanDerWaalsContact N-OG 3.1Å; E104-S107 VanDerWaalsContact O-CB 3.24Å; E104-S107 WeakPolarHBondContact O-CB 3.4Å; E104-S107 PolarHBondContact O-N 3.26Å; E104-S107 PolarHBondContact O-OG 3.16Å; V105-S107 PolarHBondContact O-N 2.65Å; S107-R109 PolarHBondContact O-N 2.82Å; S107-E110 PolarHBondContact O-N 3.04Å
108	P	96.7	Very high	96.9	Very high	113 Å²	113	69.4 Å²	69.4	73%	0.734	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.7	-179.6	25.9	-35.5	0	0	0	113
109	R	97.8	Very high	96.9	Very high	54 Å²	54	72.7 Å²	72.7	20%	0.204	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.1	42.8	179.3	-53.1	-167.9	69.9	-150	1.1	110.9	D70 E71 E74 E101 F102 S107 V111	D70-R109 VanDerWaalsContact C-NH2 3.31Å; D70-R109 PolarHBondContact O-NH2 2.8Å; D70-R109 IonicContact OD1-NH2 2.65Å; D70-R109 PolarHBondContact OD1-NH2 3.48Å; D70-R109 VanDerWaalsContact OD1-NH2 3.09Å; D70-R109 IonicContact OD2-NH2 3.02Å; D70-R109 PolarHBondContact OD2-NH2 2.89Å; E71-R109 VanDerWaalsContact CA-NH2 3.34Å; E71-R109 HydrophobicContact CB-CB 4Å; E74-R109 VanDerWaalsContact CG-NH2 3.27Å; E101-R109 CarbonylContact O-C 3.38Å; E101-R109 WeakPolarHBondContact O-CA 3.41Å; E101-R109 WeakPolarHBondContact O-CB 3.03Å; E101-R109 PolarHBondContact O-N 2.79Å; E101-R109 VanDerWaalsContact O-N 3.17Å; F102-R109 WeakPolarHBondContact CA-O 3.16Å; F102-R109 HydrophobicContact CD1-CB 3.94Å; F102-R109 VanDerWaalsContact CD1-O 3.27Å; F102-R109 WeakPolarHBondContact CD1-O 3.33Å; F102-R109 HydrophobicContact CE1-CB 3.92Å; S107-R109 PolarHBondContact O-N 2.82Å; R109-V111 PolarHBondContact O-N 3.05Å
110	E	97.8	Very high	96.8	Very high	67 Å²	67	76.4 Å²	76.4	31%	0.313	36%	0.36	S	S	.	.			trans	-53.8	123.5	-178.3	-170.9	176.7	165.3	0	0	112.1	F102 Q106 S107 R118	F102-E110 WeakPolarHBondContact O-CA 3.42Å; Q106-E110 PolarHBondContact N-OE2 2.72Å; S107-E110 PolarHBondContact O-N 3.04Å; E110-R118 IonicContact OE1-CZ 2.72Å; E110-R118 IonicContact OE1-NH1 3.51Å; E110-R118 PolarHBondContact OE1-NH1 3.42Å; E110-R118 IonicContact OE1-NH2 3.58Å; E110-R118 PolarHBondContact OE1-NH2 3.49Å
111	V	97.8	Very high	96.7	Very high	1 Å²	1	70.2 Å²	70.2	1%	0.006	33%	0.333	C	S	.	.			trans	-82.1	147	175.3	-65.2	0	0	0	0	111.4	E71 F75 F102 I103 R109 I113 I140	E71-V111 HydrophobicContact CG-CG1 4.19Å; F75-V111 HydrophobicContact CB-CG1 3.7Å; F75-V111 HydrophobicContact CD1-CG1 4.27Å; F75-V111 HydrophobicContact CG-CG1 3.91Å; F102-V111 HydrophobicContact CB-CG1 4.33Å; F102-V111 HydrophobicContact CD1-CG1 4.25Å; F102-V111 WeakPolarHBondContact O-CG2 3.46Å; F102-V111 PolarHBondContact O-N 3.21Å; I103-V111 HydrophobicContact CD1-CG2 3.96Å; R109-V111 PolarHBondContact O-N 3.05Å; V111-I113 HydrophobicContact CG2-CD1 4.5Å; V111-I113 HydrophobicContact CG2-CG2 4.05Å; V111-I113 PolarHBondContact O-N 3.32Å; V111-I140 HydrophobicContact CB-CD1 3.76Å; V111-I140 HydrophobicContact CB-CG1 4.24Å; V111-I140 HydrophobicContact CG1-CD1 4.43Å; V111-I140 HydrophobicContact CG2-CD1 4.01Å; V111-I140 HydrophobicContact CG2-CG1 4.22Å
112	N	95.4	Very high	96.6	Very high	129 Å²	129	72.9 Å²	72.9	69%	0.69	34%	0.344	S	S	*	.			trans	-75.2	93	-177	-174.1	10.1	0	0	0	112.2
113	I	96	Very high	96.4	Very high	13 Å²	13	79.7 Å²	79.7	7%	0.067	38%	0.376	C	S	.	.			trans	-131.3	146.9	177.9	62.6	175.9	0	0	0	112.4	I103 V111 T117 R118 V136 I140	I103-I113 HydrophobicContact CD1-CD1 4.05Å; I103-I113 HydrophobicContact CG2-CD1 4.34Å; V111-I113 HydrophobicContact CG2-CD1 4.5Å; V111-I113 HydrophobicContact CG2-CG2 4.05Å; V111-I113 PolarHBondContact O-N 3.32Å; I113-T117 HydrophobicContact CB-CG2 4.31Å; I113-T117 HydrophobicContact CD1-CG2 4.35Å; I113-R118 HydrophobicContact CD1-CB 4.02Å; I113-R118 HydrophobicContact CD1-CG 4.39Å; I113-R118 HydrophobicContact CG1-CB 4.41Å; I113-V136 HydrophobicContact CD1-CG2 4Å; I113-V136 HydrophobicContact CG2-CG2 4.04Å; I113-I140 HydrophobicContact CG2-CD1 3.78Å; I113-I140 HydrophobicContact CG2-CG1 4.46Å
114	D	95.3	Very high	96.3	Very high	82 Å²	82	82 Å²	82	44%	0.439	39%	0.391	S	S	.	.			trans	-66.3	156.8	176.6	68	54.1	0	0	0	112.5	R116 T117 R118 K139	D114-R116 VanDerWaalsContact C-N 3.28Å; D114-R116 PolarHBondContact O-N 3.08Å; D114-R116 PolarHBondContact OD1-N 3.37Å; D114-T117 WeakPolarHBondContact O-CB 3.46Å; D114-T117 PolarHBondContact O-N 3.23Å; D114-T117 WeakPolarHBondContact OD1-CB 3.5Å; D114-T117 PolarHBondContact OD1-N 3.15Å; D114-T117 PolarHBondContact OD1-OG1 3.42Å; D114-T117 PolarHBondContact OD2-OG1 2.85Å; D114-T117 VanDerWaalsContact OD2-OG1 3.13Å; D114-R118 PolarHBondContact O-N 3.32Å; D114-R118 VanDerWaalsContact O-N 3.12Å; D114-K139 IonicContact OD2-NZ 2.72Å; D114-K139 PolarHBondContact OD2-NZ 3.39Å
115	Y	95.1	Very high	96.2	Very high	166 Å²	166	78.5 Å²	78.5	65%	0.651	38%	0.376	S	S	*	.	H	α-helix	trans	-53.9	-42.9	-179	173.2	-96.9	0	0	0	112.8	T117 R118 E119	Y115-T117 VanDerWaalsContact C-N 3.33Å; Y115-T117 PolarHBondContact O-N 2.91Å; Y115-R118 WeakPolarHBondContact O-CB 3.41Å; Y115-R118 PolarHBondContact O-N 2.94Å; Y115-E119 HydrophobicContact CD1-CG 4.34Å; Y115-E119 HydrophobicContact CD2-CG 4.35Å; Y115-E119 HydrophobicContact CE1-CG 3.81Å; Y115-E119 HydrophobicContact CE2-CG 3.82Å; Y115-E119 PolarHBondContact O-N 3.31Å
116	R	96.1	Very high	96.1	Very high	200 Å²	200	79 Å²	79	76%	0.755	38%	0.383	S	S	*	.	H	α-helix	trans	-64.1	-39.6	-177.4	-68	-177.5	177.1	-175.9	-0.6	111.6	D114 K120	D114-R116 VanDerWaalsContact C-N 3.28Å; D114-R116 PolarHBondContact O-N 3.08Å; D114-R116 PolarHBondContact OD1-N 3.37Å; R116-K120 WeakPolarHBondContact O-CB 3.4Å; R116-K120 WeakPolarHBondContact O-CG 3.33Å; R116-K120 PolarHBondContact O-N 3.46Å
117	T	95.7	Very high	96	Very high	2 Å²	2	76.7 Å²	76.7	1%	0.012	38%	0.377	C	S	.	.	H	α-helix	trans	-65.7	-42.4	177.5	-54.2	0	0	0	0	111.1	I113 D114 Y115 K120 T121 V136 K139	I113-T117 HydrophobicContact CB-CG2 4.31Å; I113-T117 HydrophobicContact CD1-CG2 4.35Å; D114-T117 WeakPolarHBondContact O-CB 3.46Å; D114-T117 PolarHBondContact O-N 3.23Å; D114-T117 WeakPolarHBondContact OD1-CB 3.5Å; D114-T117 PolarHBondContact OD1-N 3.15Å; D114-T117 PolarHBondContact OD1-OG1 3.42Å; D114-T117 PolarHBondContact OD2-OG1 2.85Å; D114-T117 VanDerWaalsContact OD2-OG1 3.13Å; Y115-T117 VanDerWaalsContact C-N 3.33Å; Y115-T117 PolarHBondContact O-N 2.91Å; T117-K120 PolarHBondContact O-N 3.44Å; T117-T121 WeakPolarHBondContact O-CB 3.5Å; T117-T121 PolarHBondContact O-N 2.94Å; T117-T121 PolarHBondContact O-OG1 2.73Å; T117-V136 HydrophobicContact CG2-CB 4.24Å; T117-V136 HydrophobicContact CG2-CG2 4.27Å; T117-K139 HydrophobicContact CG2-CD 3.8Å; T117-K139 PolarHBondContact OG1-NZ 3.2Å
118	R	97.2	Very high	95.9	Very high	30 Å²	30	77 Å²	77	11%	0.113	38%	0.378	C	S	.	.	H	α-helix	trans	-62.4	-48.3	178.4	-169.3	-174.3	-50.7	-133.9	3.9	111.4	I103 E110 I113 D114 Y115 K120 T121 K122	I103-R118 HydrophobicContact CG2-CG 3.95Å; I103-R118 WeakPolarHBondContact O-CD 3.4Å; I103-R118 PolarHBondContact O-NH1 2.92Å; E110-R118 IonicContact OE1-CZ 2.72Å; E110-R118 IonicContact OE1-NH1 3.51Å; E110-R118 PolarHBondContact OE1-NH1 3.42Å; E110-R118 IonicContact OE1-NH2 3.58Å; E110-R118 PolarHBondContact OE1-NH2 3.49Å; I113-R118 HydrophobicContact CD1-CB 4.02Å; I113-R118 HydrophobicContact CD1-CG 4.39Å; I113-R118 HydrophobicContact CG1-CB 4.41Å; D114-R118 PolarHBondContact O-N 3.32Å; D114-R118 VanDerWaalsContact O-N 3.12Å; Y115-R118 WeakPolarHBondContact O-CB 3.41Å; Y115-R118 PolarHBondContact O-N 2.94Å; R118-K120 PolarHBondContact O-N 3.36Å; R118-T121 WeakPolarHBondContact O-CB 3.38Å; R118-T121 PolarHBondContact O-N 2.94Å; R118-K122 WeakPolarHBondContact O-CB 3.11Å; R118-K122 PolarHBondContact O-N 3.2Å
119	E	97	Very high	95.9	Very high	72 Å²	72	74.6 Å²	74.6	34%	0.336	36%	0.362	S	S	.	.	H	α-helix	trans	-63.4	-42.1	178.6	-71.4	-56	104.5	0	0	112.1	Y115 T121 K122 Q123	Y115-E119 HydrophobicContact CD1-CG 4.34Å; Y115-E119 HydrophobicContact CD2-CG 4.35Å; Y115-E119 HydrophobicContact CE1-CG 3.81Å; Y115-E119 HydrophobicContact CE2-CG 3.82Å; Y115-E119 PolarHBondContact O-N 3.31Å; E119-T121 VanDerWaalsContact C-N 3.34Å; E119-T121 PolarHBondContact O-N 3.46Å; E119-K122 WeakPolarHBondContact O-CB 3.46Å; E119-K122 PolarHBondContact O-N 2.62Å; E119-Q123 PolarHBondContact O-N 3.23Å
120	K	95.9	Very high	95.8	Very high	111 Å²	111	75 Å²	75	48%	0.483	37%	0.371	S	S	.	.	H	α-helix	trans	-59.9	-43.8	172.5	-77.3	-179.8	174.6	-168.9	0	112.4	R116 T117 R118 Q123 S124 E135	R116-K120 WeakPolarHBondContact O-CB 3.4Å; R116-K120 WeakPolarHBondContact O-CG 3.33Å; R116-K120 PolarHBondContact O-N 3.46Å; T117-K120 PolarHBondContact O-N 3.44Å; R118-K120 PolarHBondContact O-N 3.36Å; K120-Q123 PolarHBondContact O-N 2.95Å; K120-S124 WeakPolarHBondContact O-CB 3.48Å; K120-S124 PolarHBondContact O-N 2.91Å; K120-E135 IonicContact NZ-OE1 3.09Å; K120-E135 PolarHBondContact NZ-OE1 2.86Å; K120-E135 IonicContact NZ-OE2 2.7Å
121	T	96.3	Very high	95.8	Very high	4 Å²	4	74.2 Å²	74.2	3%	0.025	38%	0.376	C	S	.	.	H	α-helix	trans	-63	-45.3	178.4	-59.4	0	0	0	0	110.2	I103 T117 R118 E119 Q123 S124 L125 L133 V136	I103-T121 HydrophobicContact CD1-CG2 4.49Å; I103-T121 HydrophobicContact CG1-CG2 4.37Å; I103-T121 HydrophobicContact CG2-CG2 4.1Å; T117-T121 WeakPolarHBondContact O-CB 3.5Å; T117-T121 PolarHBondContact O-N 2.94Å; T117-T121 PolarHBondContact O-OG1 2.73Å; R118-T121 WeakPolarHBondContact O-CB 3.38Å; R118-T121 PolarHBondContact O-N 2.94Å; E119-T121 VanDerWaalsContact C-N 3.34Å; E119-T121 PolarHBondContact O-N 3.46Å; T121-Q123 VanDerWaalsContact C-N 3.33Å; T121-Q123 PolarHBondContact O-N 3.36Å; T121-S124 PolarHBondContact O-N 3.22Å; T121-S124 VanDerWaalsContact O-N 3.16Å; T121-L125 HydrophobicContact CG2-CD1 3.92Å; T121-L125 HydrophobicContact CG2-CG 4.4Å; T121-L125 VanDerWaalsContact O-CG 3.26Å; T121-L125 WeakPolarHBondContact O-CG 3.31Å; T121-L125 PolarHBondContact O-N 3.27Å; T121-L133 HydrophobicContact CG2-CD2 4Å; T121-V136 HydrophobicContact CG2-CG1 4.01Å
122	K	96.2	Very high	95.7	Very high	113 Å²	113	74.7 Å²	74.7	49%	0.491	38%	0.379	S	S	.	.	H	α-helix	trans	-56.7	-45.7	175.3	-176.5	-178.7	176.5	-176.7	0	111.7	F99 R118 E119 L125 S126	F99-K122 HydrophobicContact CE2-CB 3.92Å; F99-K122 HydrophobicContact CE2-CG 4.09Å; F99-K122 HydrophobicContact CZ-CB 4.39Å; F99-K122 HydrophobicContact CZ-CD 4.37Å; F99-K122 HydrophobicContact CZ-CG 4.12Å; R118-K122 WeakPolarHBondContact O-CB 3.11Å; R118-K122 PolarHBondContact O-N 3.2Å; E119-K122 WeakPolarHBondContact O-CB 3.46Å; E119-K122 PolarHBondContact O-N 2.62Å; K122-L125 PolarHBondContact O-N 3.38Å; K122-S126 PolarHBondContact O-N 3.28Å
123	Q	95.8	Very high	95.9	Very high	148 Å²	148	68.6 Å²	68.6	69%	0.692	35%	0.347	S	S	*	.	H	α-helix	trans	-64.9	-41.9	175.9	-169.8	175.3	17.9	0	0	111.7	E119 K120 T121 L125 S126	E119-Q123 PolarHBondContact O-N 3.23Å; K120-Q123 PolarHBondContact O-N 2.95Å; T121-Q123 VanDerWaalsContact C-N 3.33Å; T121-Q123 PolarHBondContact O-N 3.36Å; Q123-L125 PolarHBondContact O-N 3.48Å; Q123-S126 PolarHBondContact O-N 3.05Å; Q123-S126 VanDerWaalsContact O-N 3.15Å; Q123-S126 PolarHBondContact O-OG 3.41Å
124	S	94.8	Very high	95.9	Very high	48 Å²	48	71.5 Å²	71.5	34%	0.336	36%	0.363	S	S	.	.	H	α-helix	trans	-67	-19	178.5	-168	0	0	0	0	113.9	K120 T121 S132	K120-S124 WeakPolarHBondContact O-CB 3.48Å; K120-S124 PolarHBondContact O-N 2.91Å; T121-S124 PolarHBondContact O-N 3.22Å; T121-S124 VanDerWaalsContact O-N 3.16Å; S124-S132 WeakPolarHBondContact O-CB 3.49Å; S124-S132 PolarHBondContact O-OG 3.22Å; S124-S132 VanDerWaalsContact OG-CA 3.27Å; S124-S132 WeakPolarHBondContact OG-CA 3.2Å; S124-S132 VanDerWaalsContact OG-CB 3.27Å; S124-S132 WeakPolarHBondContact OG-CB 3.25Å; S124-S132 PolarHBondContact OG-O 2.93Å; S124-S132 PolarHBondContact OG-OG 3.16Å
125	L	94.7	Very high	96	Very high	16 Å²	16	72.3 Å²	72.3	8%	0.084	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	0.6	176.9	-63	174.5	0	0	0	113.1	A95 F99 T121 K122 Q123 D127 P128 L133	A95-L125 HydrophobicContact CB-CD2 3.85Å; F99-L125 HydrophobicContact CB-CD1 4.03Å; F99-L125 HydrophobicContact CD2-CD1 3.87Å; F99-L125 HydrophobicContact CG-CD1 4.37Å; T121-L125 HydrophobicContact CG2-CD1 3.92Å; T121-L125 HydrophobicContact CG2-CG 4.4Å; T121-L125 VanDerWaalsContact O-CG 3.26Å; T121-L125 WeakPolarHBondContact O-CG 3.31Å; T121-L125 PolarHBondContact O-N 3.27Å; K122-L125 PolarHBondContact O-N 3.38Å; Q123-L125 PolarHBondContact O-N 3.48Å; L125-D127 VanDerWaalsContact C-N 3.32Å; L125-P128 WeakPolarHBondContact O-CG 3.2Å; L125-L133 HydrophobicContact CD1-CD2 4.09Å; L125-L133 HydrophobicContact CD2-CD2 3.96Å; L125-L133 HydrophobicContact CD2-CG 4.18Å; L125-L133 HydrophobicContact CG-CD2 4.41Å
126	S	93.4	Very high	96.1	Very high	102 Å²	102	64.4 Å²	64.4	71%	0.713	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-33.1	170.6	69.7	0	0	0	0	112.1	K122 Q123	K122-S126 PolarHBondContact O-N 3.28Å; Q123-S126 PolarHBondContact O-N 3.05Å; Q123-S126 VanDerWaalsContact O-N 3.15Å; Q123-S126 PolarHBondContact O-OG 3.41Å
127	D	93.8	Very high	96.2	Very high	128 Å²	128	55.3 Å²	55.3	68%	0.684	30%	0.299	S	S	*	.	S	Bend	trans	-129	84.9	168.7	-173.6	22.8	0	0	0	109.1	L125 T129	L125-D127 VanDerWaalsContact C-N 3.32Å; D127-T129 PolarHBondContact O-N 3.08Å
128	P	95.4	Very high	96.3	Very high	18 Å²	18	56.9 Å²	56.9	12%	0.117	32%	0.315	C	S	.	.			trans	-65.8	130.2	-170.8	-21.9	33.1	0	0	0	113	Y82 L91 V92 A95 L125	Y82-P128 VanDerWaalsContact OH-CB 3.29Å; Y82-P128 WeakPolarHBondContact OH-CB 3.37Å; L91-P128 HydrophobicContact CD2-CB 4.35Å; L91-P128 WeakPolarHBondContact CD2-O 3.22Å; L91-P128 HydrophobicContact CG-CB 4.28Å; V92-P128 HydrophobicContact CG2-CG 4.11Å; A95-P128 HydrophobicContact CB-CB 3.96Å; A95-P128 HydrophobicContact CB-CG 3.87Å; L125-P128 WeakPolarHBondContact O-CG 3.2Å
129	T	96.8	Very high	96.4	Very high	63 Å²	63	59.3 Å²	59.3	39%	0.387	33%	0.327	S	S	.	.			trans	-118	162.2	167.8	71.4	0	0	0	0	109.2	Y82 D127 A131 S132	Y82-T129 WeakPolarHBondContact CE1-O 3.37Å; Y82-T129 VanDerWaalsContact CZ-O 3.31Å; Y82-T129 PolarHBondContact OH-O 3.3Å; D127-T129 PolarHBondContact O-N 3.08Å; T129-A131 PolarHBondContact O-N 3.14Å; T129-A131 PolarHBondContact OG1-N 3.19Å; T129-S132 PolarHBondContact N-OG 2.99Å; T129-S132 WeakPolarHBondContact O-CB 3.33Å; T129-S132 PolarHBondContact O-N 3.2Å; T129-S132 PolarHBondContact O-OG 2.96Å; T129-S132 PolarHBondContact OG1-N 2.63Å; T129-S132 PolarHBondContact OG1-OG 3.27Å
130	P	96.4	Very high	96.4	Very high	61 Å²	61	55.9 Å²	55.9	40%	0.396	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-24	174	-27.5	36.6	0	0	0	113.7	K83 L91	K83-P130 WeakPolarHBondContact CG-O 3.48Å; L91-P130 HydrophobicContact CD2-CG 4.5Å
131	A	96.6	Very high	96.6	Very high	52 Å²	52	52.1 Å²	52.1	43%	0.43	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-6.6	179.4	0	0	0	0	0	114.6	T129 L133 N134	T129-A131 PolarHBondContact O-N 3.14Å; T129-A131 PolarHBondContact OG1-N 3.19Å; A131-L133 PolarHBondContact O-N 3.19Å; A131-N134 WeakPolarHBondContact O-CB 3.46Å; A131-N134 PolarHBondContact O-N 3.05Å
132	S	97.1	Very high	96.6	Very high	10 Å²	10	54 Å²	54	7%	0.07	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-21	-171.5	-68.4	0	0	0	0	115.1	S124 T129	S124-S132 WeakPolarHBondContact O-CB 3.49Å; S124-S132 PolarHBondContact O-OG 3.22Å; S124-S132 VanDerWaalsContact OG-CA 3.27Å; S124-S132 WeakPolarHBondContact OG-CA 3.2Å; S124-S132 VanDerWaalsContact OG-CB 3.27Å; S124-S132 WeakPolarHBondContact OG-CB 3.25Å; S124-S132 PolarHBondContact OG-O 2.93Å; S124-S132 PolarHBondContact OG-OG 3.16Å; T129-S132 PolarHBondContact N-OG 2.99Å; T129-S132 WeakPolarHBondContact O-CB 3.33Å; T129-S132 PolarHBondContact O-N 3.2Å; T129-S132 PolarHBondContact O-OG 2.96Å; T129-S132 PolarHBondContact OG1-N 2.63Å; T129-S132 PolarHBondContact OG1-OG 3.27Å
133	L	97.6	Very high	96.7	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	0.2	180	-66.2	172.7	0	0	0	113.4	Y82 I98 T121 L125 A131 E135 V136 Q137	Y82-L133 HydrophobicContact CD1-CD1 3.8Å; Y82-L133 HydrophobicContact CD1-CG 4.36Å; Y82-L133 HydrophobicContact CD2-CD1 4.28Å; Y82-L133 HydrophobicContact CE1-CD1 4.12Å; Y82-L133 HydrophobicContact CE1-CG 4.29Å; Y82-L133 HydrophobicContact CG-CD1 3.88Å; I98-L133 HydrophobicContact CB-CD1 4.44Å; I98-L133 HydrophobicContact CD1-CD1 3.63Å; I98-L133 HydrophobicContact CG2-CD1 3.94Å; I98-L133 HydrophobicContact CG2-CD2 4.43Å; T121-L133 HydrophobicContact CG2-CD2 4Å; L125-L133 HydrophobicContact CD1-CD2 4.09Å; L125-L133 HydrophobicContact CD2-CD2 3.96Å; L125-L133 HydrophobicContact CD2-CG 4.18Å; L125-L133 HydrophobicContact CG-CD2 4.41Å; A131-L133 PolarHBondContact O-N 3.19Å; L133-E135 PolarHBondContact O-N 3.45Å; L133-V136 HydrophobicContact CB-CG1 4.32Å; L133-V136 HydrophobicContact CD2-CG1 4Å; L133-V136 VanDerWaalsContact O-CG1 3.24Å; L133-V136 WeakPolarHBondContact O-CG1 3.34Å; L133-V136 PolarHBondContact O-N 3.15Å; L133-Q137 WeakPolarHBondContact O-CB 3.45Å; L133-Q137 PolarHBondContact O-N 2.82Å
134	N	97.4	Very high	96.9	Very high	74 Å²	74	44.6 Å²	44.6	40%	0.396	27%	0.266	S	S	.	.	H	α-helix	trans	-61.8	-42.8	-171.4	-73.4	-1.6	0	0	0	113.1	A131 G138	A131-N134 WeakPolarHBondContact O-CB 3.46Å; A131-N134 PolarHBondContact O-N 3.05Å; N134-G138 PolarHBondContact O-N 3.24Å
135	E	96.4	Very high	97	Very high	99 Å²	99	45.3 Å²	45.3	46%	0.463	27%	0.265	S	S	.	.	H	α-helix	trans	-62.1	-50.9	-179.2	-177.7	178.8	171.4	0	0	110.9	K120 L133 G138 K139	K120-E135 IonicContact NZ-OE1 3.09Å; K120-E135 PolarHBondContact NZ-OE1 2.86Å; K120-E135 IonicContact NZ-OE2 2.7Å; L133-E135 PolarHBondContact O-N 3.45Å; E135-G138 PolarHBondContact O-N 2.86Å; E135-K139 PolarHBondContact O-N 3.36Å; E135-K139 VanDerWaalsContact O-N 3.15Å
136	V	97.7	Very high	97.2	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-70.1	-37.6	-178.7	59.2	0	0	0	0	111.9	F75 I103 I113 T117 T121 L133 G138 K139 I140	F75-V136 HydrophobicContact CE1-CG1 4.35Å; F75-V136 HydrophobicContact CE1-CG2 4.02Å; F75-V136 HydrophobicContact CZ-CB 4.36Å; F75-V136 HydrophobicContact CZ-CG1 3.73Å; F75-V136 HydrophobicContact CZ-CG2 3.86Å; I103-V136 HydrophobicContact CD1-CG2 4Å; I113-V136 HydrophobicContact CD1-CG2 4Å; I113-V136 HydrophobicContact CG2-CG2 4.04Å; T117-V136 HydrophobicContact CG2-CB 4.24Å; T117-V136 HydrophobicContact CG2-CG2 4.27Å; T121-V136 HydrophobicContact CG2-CG1 4.01Å; L133-V136 HydrophobicContact CB-CG1 4.32Å; L133-V136 HydrophobicContact CD2-CG1 4Å; L133-V136 VanDerWaalsContact O-CG1 3.24Å; L133-V136 WeakPolarHBondContact O-CG1 3.34Å; L133-V136 PolarHBondContact O-N 3.15Å; V136-G138 VanDerWaalsContact C-N 3.32Å; V136-G138 PolarHBondContact O-N 2.82Å; V136-K139 PolarHBondContact O-N 3.49Å; V136-I140 WeakPolarHBondContact O-CG1 3.34Å; V136-I140 PolarHBondContact O-N 3.42Å; V136-I140 VanDerWaalsContact O-N 3.08Å
137	Q	98.5	Very high	97.4	Very high	9 Å²	9	51 Å²	51	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-59.9	-43.7	173.5	-172.2	-173.4	16.3	0	0	111.2	W76 C79 E80 K83 L133 K139 I140 Y141	W76-Q137 HydrophobicContact CG-CG 4.34Å; W76-Q137 PolarHBondContact O-NE2 2.62Å; C79-Q137 HydrophobicContact CB-CB 4.11Å; C79-Q137 HydrophobicContact CB-CG 3.73Å; E80-Q137 PolarHBondContact OE1-NE2 2.86Å; K83-Q137 VanDerWaalsContact CE-OE1 3.28Å; L133-Q137 WeakPolarHBondContact O-CB 3.45Å; L133-Q137 PolarHBondContact O-N 2.82Å; Q137-K139 VanDerWaalsContact C-N 3.33Å; Q137-K139 PolarHBondContact O-N 3.18Å; Q137-I140 PolarHBondContact O-N 2.91Å; Q137-Y141 WeakPolarHBondContact O-CB 3.48Å; Q137-Y141 PolarHBondContact O-N 2.89Å
138	G	98	Very high	97.6	Very high	34 Å²	34	45 Å²	45	35%	0.351	25%	0.248	S	C	.	.	H	α-helix	trans	-61.5	-39.6	176.7	0	0	0	0	0	112.7	N134 E135 V136 Y141 S142	N134-G138 PolarHBondContact O-N 3.24Å; E135-G138 PolarHBondContact O-N 2.86Å; V136-G138 VanDerWaalsContact C-N 3.32Å; V136-G138 PolarHBondContact O-N 2.82Å; G138-Y141 PolarHBondContact O-N 3.14Å; G138-S142 PolarHBondContact O-N 3.41Å; G138-S142 PolarHBondContact O-OG 3.29Å
139	K	97.9	Very high	97.8	Very high	81 Å²	81	45 Å²	45	35%	0.352	25%	0.246	S	C	.	.	H	α-helix	trans	-62.6	-45.2	175	-72.8	-169.4	172.4	-158.1	0	112.5	D114 T117 E135 V136 Q137 S142 L143	D114-K139 IonicContact OD2-NZ 2.72Å; D114-K139 PolarHBondContact OD2-NZ 3.39Å; T117-K139 HydrophobicContact CG2-CD 3.8Å; T117-K139 PolarHBondContact OG1-NZ 3.2Å; E135-K139 PolarHBondContact O-N 3.36Å; E135-K139 VanDerWaalsContact O-N 3.15Å; V136-K139 PolarHBondContact O-N 3.49Å; Q137-K139 VanDerWaalsContact C-N 3.33Å; Q137-K139 PolarHBondContact O-N 3.18Å; K139-S142 PolarHBondContact O-N 2.95Å; K139-L143 WeakPolarHBondContact O-CB 3.42Å; K139-L143 PolarHBondContact O-N 3.46Å
140	I	98.4	Very high	97.9	Very high	1 Å²	1	44 Å²	44	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-69.2	-37	178.5	-61.3	-53.4	0	0	0	111.7	N72 F75 V111 I113 V136 Q137 L143 M144	N72-I140 HydrophobicContact CB-CG2 3.71Å; N72-I140 WeakPolarHBondContact O-CG2 3.31Å; F75-I140 HydrophobicContact CD1-CB 3.99Å; F75-I140 HydrophobicContact CD1-CG1 3.72Å; F75-I140 HydrophobicContact CD1-CG2 4.08Å; F75-I140 HydrophobicContact CE1-CB 4.26Å; F75-I140 HydrophobicContact CE1-CG1 3.79Å; V111-I140 HydrophobicContact CB-CD1 3.76Å; V111-I140 HydrophobicContact CB-CG1 4.24Å; V111-I140 HydrophobicContact CG1-CD1 4.43Å; V111-I140 HydrophobicContact CG2-CD1 4.01Å; V111-I140 HydrophobicContact CG2-CG1 4.22Å; I113-I140 HydrophobicContact CG2-CD1 3.78Å; I113-I140 HydrophobicContact CG2-CG1 4.46Å; V136-I140 WeakPolarHBondContact O-CG1 3.34Å; V136-I140 PolarHBondContact O-N 3.42Å; V136-I140 VanDerWaalsContact O-N 3.08Å; Q137-I140 PolarHBondContact O-N 2.91Å; I140-L143 HydrophobicContact CD1-CD2 4.34Å; I140-L143 WeakPolarHBondContact O-CB 3.39Å; I140-L143 PolarHBondContact O-N 3.36Å; I140-M144 HydrophobicContact CG2-CE 4.21Å; I140-M144 WeakPolarHBondContact O-CG 3.36Å; I140-M144 PolarHBondContact O-N 2.83Å
141	Y	98.6	Very high	97.9	Very high	31 Å²	31	45.1 Å²	45.1	12%	0.122	24%	0.236	C	C	.	.	H	α-helix	trans	-56.6	-53.1	170.4	175.8	-84.7	0	0	0	110.9	F47 D48 L51 W76 Q137 G138 L143 M144 E145	F47-Y141 AromaticContact CD1-CD2 3.87Å; F47-Y141 HydrophobicContact CD1-CD2 3.87Å; F47-Y141 HydrophobicContact CD1-CE1 4.06Å; F47-Y141 AromaticContact CD1-CE2 3.34Å; F47-Y141 HydrophobicContact CD1-CE2 3.34Å; F47-Y141 HydrophobicContact CD1-CG 4.43Å; F47-Y141 AromaticContact CD1-CZ 3.43Å; F47-Y141 VanDerWaalsContact CD1-CZ 3.43Å; F47-Y141 AromaticContact CE1-CD2 3.77Å; F47-Y141 HydrophobicContact CE1-CD2 3.77Å; F47-Y141 AromaticContact CE1-CE2 3.72Å; F47-Y141 HydrophobicContact CE1-CE2 3.72Å; F47-Y141 HydrophobicContact CE1-CG 4.31Å; F47-Y141 HydrophobicContact CG-CE2 4.29Å; D48-Y141 PolarHBondContact OD1-OH 3.12Å; L51-Y141 HydrophobicContact CD1-CD2 3.96Å; L51-Y141 HydrophobicContact CD1-CE2 3.83Å; W76-Y141 AromaticContact NE1-CD2 3.73Å; Q137-Y141 WeakPolarHBondContact O-CB 3.48Å; Q137-Y141 PolarHBondContact O-N 2.89Å; G138-Y141 PolarHBondContact O-N 3.14Å; Y141-L143 VanDerWaalsContact C-N 3.28Å; Y141-L143 PolarHBondContact O-N 2.87Å; Y141-M144 PolarHBondContact O-N 3.42Å; Y141-E145 HydrophobicContact CE1-CB 4.28Å; Y141-E145 HydrophobicContact CE1-CG 4.44Å; Y141-E145 WeakPolarHBondContact CE1-OE2 3.45Å; Y141-E145 WeakPolarHBondContact O-CB 3.35Å; Y141-E145 PolarHBondContact O-N 3.34Å; Y141-E145 PolarHBondContact OH-OE1 2.95Å
142	S	98.3	Very high	98	Very high	44 Å²	44	42.6 Å²	42.6	31%	0.308	22%	0.216	S	C	.	.	H	α-helix	trans	-63.3	-31.9	179.3	-69.3	0	0	0	0	113.4	G138 K139 K146	G138-S142 PolarHBondContact O-N 3.41Å; G138-S142 PolarHBondContact O-OG 3.29Å; K139-S142 PolarHBondContact O-N 2.95Å; S142-K146 VanDerWaalsContact O-CB 3.31Å; S142-K146 WeakPolarHBondContact O-CB 3.27Å; S142-K146 VanDerWaalsContact O-CG 3.25Å; S142-K146 WeakPolarHBondContact O-CG 3.19Å; S142-K146 PolarHBondContact O-N 3.32Å; S142-K146 VanDerWaalsContact O-N 3.08Å
143	L	97.9	Very high	98.1	Very high	63 Å²	63	43.6 Å²	43.6	33%	0.33	22%	0.22	S	C	.	.	H	α-helix	trans	-61.4	-53.4	173.3	176.4	67.6	0	0	0	110.4	K139 I140 Y141 E145 K146 D147	K139-L143 WeakPolarHBondContact O-CB 3.42Å; K139-L143 PolarHBondContact O-N 3.46Å; I140-L143 HydrophobicContact CD1-CD2 4.34Å; I140-L143 WeakPolarHBondContact O-CB 3.39Å; I140-L143 PolarHBondContact O-N 3.36Å; Y141-L143 VanDerWaalsContact C-N 3.28Å; Y141-L143 PolarHBondContact O-N 2.87Å; L143-E145 PolarHBondContact O-N 3.48Å; L143-K146 PolarHBondContact O-N 3.43Å; L143-D147 WeakPolarHBondContact O-CB 3.29Å; L143-D147 PolarHBondContact O-N 2.91Å
144	M	98.5	Very high	98	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.252	C	S	.	.	I	π-helix	trans	-63	-43	178.9	-68.6	-173.3	-66.3	0	0	111.9	F47 F60 L64 N72 I73 W76 I140 Y141 K146 S148 Y149	F47-M144 HydrophobicContact CE1-CB 3.85Å; F47-M144 HydrophobicContact CE1-CE 4.34Å; F47-M144 HydrophobicContact CZ-CB 3.65Å; F47-M144 HydrophobicContact CZ-CE 4.16Å; F47-M144 HydrophobicContact CZ-SD 4.45Å; F60-M144 HydrophobicContact CE1-CB 4.28Å; F60-M144 HydrophobicContact CE1-CG 4.5Å; F60-M144 HydrophobicContact CE1-SD 3.9Å; F60-M144 HydrophobicContact CZ-CB 4.21Å; L64-M144 HydrophobicContact CD1-SD 3.99Å; N72-M144 HydrophobicContact CB-CG 3.68Å; N72-M144 HydrophobicContact CB-SD 3.57Å; N72-M144 VanDerWaalsContact CB-SD 3.57Å; I73-M144 HydrophobicContact CB-SD 3.9Å; I73-M144 HydrophobicContact CD1-CE 4.08Å; I73-M144 HydrophobicContact CD1-SD 4.19Å; I73-M144 PolarHBondContact N-SD 2.88Å; W76-M144 HydrophobicContact CB-CE 3.95Å; W76-M144 HydrophobicContact CG-CE 4.23Å; I140-M144 HydrophobicContact CG2-CE 4.21Å; I140-M144 WeakPolarHBondContact O-CG 3.36Å; I140-M144 PolarHBondContact O-N 2.83Å; Y141-M144 PolarHBondContact O-N 3.42Å; M144-K146 VanDerWaalsContact C-N 3.33Å; M144-K146 PolarHBondContact O-N 3.14Å; M144-S148 PolarHBondContact O-N 3.37Å; M144-Y149 WeakPolarHBondContact O-CB 3.35Å; M144-Y149 PolarHBondContact O-N 2.94Å
145	E	98.6	Very high	98	Very high	64 Å²	64	49.5 Å²	49.5	30%	0.299	24%	0.239	S	C	.	.	I	π-helix	trans	-61	-39.4	-179.9	-174.4	177.8	-134.7	0	0	112.5	F47 Y141 L143 P150	F47-E145 HydrophobicContact CB-CG 4.06Å; F47-E145 HydrophobicContact CD1-CB 3.63Å; F47-E145 HydrophobicContact CD1-CG 4.06Å; F47-E145 HydrophobicContact CE1-CB 4.14Å; F47-E145 HydrophobicContact CG-CB 4.3Å; F47-E145 HydrophobicContact CG-CG 4.36Å; Y141-E145 HydrophobicContact CE1-CB 4.28Å; Y141-E145 HydrophobicContact CE1-CG 4.44Å; Y141-E145 WeakPolarHBondContact CE1-OE2 3.45Å; Y141-E145 WeakPolarHBondContact O-CB 3.35Å; Y141-E145 PolarHBondContact O-N 3.34Å; Y141-E145 PolarHBondContact OH-OE1 2.95Å; L143-E145 PolarHBondContact O-N 3.48Å; E145-P150 WeakPolarHBondContact O-CD 3.45Å
146	K	98.1	Very high	97.9	Very high	160 Å²	160	52.5 Å²	52.5	70%	0.696	25%	0.251	S	S	*	.	I	π-helix	trans	-87.9	-26.6	-175.6	-68.3	176.1	-177.3	178.3	0	113.7	S142 L143 M144	S142-K146 VanDerWaalsContact O-CB 3.31Å; S142-K146 WeakPolarHBondContact O-CB 3.27Å; S142-K146 VanDerWaalsContact O-CG 3.25Å; S142-K146 WeakPolarHBondContact O-CG 3.19Å; S142-K146 PolarHBondContact O-N 3.32Å; S142-K146 VanDerWaalsContact O-N 3.08Å; L143-K146 PolarHBondContact O-N 3.43Å; M144-K146 VanDerWaalsContact C-N 3.33Å; M144-K146 PolarHBondContact O-N 3.14Å
147	D	97.8	Very high	97.7	Very high	76 Å²	76	54 Å²	54	41%	0.406	26%	0.258	S	S	.	.	I	π-helix	trans	-108.7	-69.6	-177.8	175.5	67.3	0	0	0	112.6	L143 P150 R151	L143-D147 WeakPolarHBondContact O-CB 3.29Å; L143-D147 PolarHBondContact O-N 2.91Å; D147-P150 WeakPolarHBondContact O-CD 3.21Å; D147-R151 IonicContact OD1-NE 2.62Å; D147-R151 IonicContact OD2-CZ 3.71Å; D147-R151 IonicContact OD2-NE 3.28Å; D147-R151 IonicContact OD2-NH2 3.04Å; D147-R151 PolarHBondContact OD2-NH2 3.24Å
148	S	98.2	Very high	97.5	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.021	26%	0.258	C	S	.	.	I	π-helix	trans	-78.5	-31.9	-165	-46.8	0	0	0	0	112.6	F63 M144 R151 F152	F63-S148 WeakPolarHBondContact CE1-O 3.43Å; M144-S148 PolarHBondContact O-N 3.37Å; S148-R151 PolarHBondContact O-N 2.99Å; S148-F152 WeakPolarHBondContact O-CB 3.49Å; S148-F152 PolarHBondContact O-N 3.12Å
149	Y	98.6	Very high	97.3	Very high	19 Å²	19	56.5 Å²	56.5	8%	0.075	26%	0.26	C	S	.	.	H	α-helix	trans	-63.7	-48.8	178.9	169.6	-119.4	0	0	0	113.1	W43 S44 F47 L50 M144 R151 F152 L153	W43-Y149 WeakPolarHBondContact O-CE2 3.45Å; W43-Y149 PolarHBondContact O-OH 3.37Å; S44-Y149 VanDerWaalsContact C-OH 3.25Å; S44-Y149 WeakPolarHBondContact CA-OH 3.49Å; S44-Y149 PolarHBondContact O-OH 3.37Å; F47-Y149 HydrophobicContact CB-CD1 3.9Å; F47-Y149 HydrophobicContact CB-CE1 3.91Å; F47-Y149 HydrophobicContact CB-CG 4.21Å; F47-Y149 HydrophobicContact CD2-CD1 4.19Å; F47-Y149 AromaticContact CD2-CD2 3.58Å; F47-Y149 HydrophobicContact CD2-CD2 3.58Å; F47-Y149 HydrophobicContact CD2-CE2 4.12Å; F47-Y149 AromaticContact CD2-CG 3.61Å; F47-Y149 HydrophobicContact CD2-CG 3.61Å; F47-Y149 HydrophobicContact CE2-CD2 4.24Å; F47-Y149 HydrophobicContact CE2-CG 4.27Å; F47-Y149 HydrophobicContact CG-CD1 4.24Å; F47-Y149 HydrophobicContact CG-CD2 4.39Å; F47-Y149 HydrophobicContact CG-CG 4.1Å; L50-Y149 HydrophobicContact CB-CE2 4.33Å; L50-Y149 HydrophobicContact CD2-CD2 3.58Å; L50-Y149 HydrophobicContact CD2-CE2 3.73Å; M144-Y149 WeakPolarHBondContact O-CB 3.35Å; M144-Y149 PolarHBondContact O-N 2.94Å; Y149-R151 PolarHBondContact O-N 3.09Å; Y149-F152 WeakPolarHBondContact O-CB 3.42Å; Y149-F152 PolarHBondContact O-N 3.37Å; Y149-F152 VanDerWaalsContact O-N 3.15Å; Y149-L153 HydrophobicContact CD2-CD1 4.43Å; Y149-L153 HydrophobicContact CD2-CG 4.24Å; Y149-L153 HydrophobicContact CE1-CD1 4.12Å; Y149-L153 HydrophobicContact CE2-CD1 3.81Å; Y149-L153 HydrophobicContact CE2-CD2 3.92Å; Y149-L153 HydrophobicContact CE2-CG 3.86Å; Y149-L153 WeakPolarHBondContact O-CG 3.42Å; Y149-L153 PolarHBondContact O-N 3.32Å
150	P	98.4	Very high	97	Very high	41 Å²	41	55.6 Å²	55.6	27%	0.266	26%	0.259	S	S	.	.	H	α-helix	trans	-59.9	-33.4	172.8	-26.5	33.7	0	0	0	113.5	E145 D147 R154	E145-P150 WeakPolarHBondContact O-CD 3.45Å; D147-P150 WeakPolarHBondContact O-CD 3.21Å; P150-R154 PolarHBondContact O-N 3.46Å; P150-R154 PolarHBondContact O-NE 3.08Å
151	R	98.4	Very high	96.6	Very high	84 Å²	84	57.2 Å²	57.2	32%	0.317	27%	0.268	S	S	.	.	H	α-helix	trans	-71.3	-40.1	175.1	-67.2	-169.9	-65.7	129.9	1.6	111.6	F63 E67 D147 S148 Y149 L153 R154 S155	F63-R151 HydrophobicContact CE1-CB 4.37Å; F63-R151 HydrophobicContact CZ-CB 3.79Å; E67-R151 IonicContact OE1-CZ 3.99Å; E67-R151 IonicContact OE1-NH1 3.63Å; E67-R151 PolarHBondContact OE1-NH1 3.31Å; E67-R151 IonicContact OE2-CZ 3.01Å; E67-R151 IonicContact OE2-NH1 3.98Å; E67-R151 PolarHBondContact OE2-NH1 3.26Å; E67-R151 IonicContact OE2-NH2 2.88Å; E67-R151 PolarHBondContact OE2-NH2 2.79Å; D147-R151 IonicContact OD1-NE 2.62Å; D147-R151 IonicContact OD2-CZ 3.71Å; D147-R151 IonicContact OD2-NE 3.28Å; D147-R151 IonicContact OD2-NH2 3.04Å; D147-R151 PolarHBondContact OD2-NH2 3.24Å; S148-R151 PolarHBondContact O-N 2.99Å; Y149-R151 PolarHBondContact O-N 3.09Å; R151-L153 PolarHBondContact O-N 3.06Å; R151-R154 CarbonylContact O-C 3.41Å; R151-R154 PolarHBondContact O-N 2.93Å; R151-S155 PolarHBondContact O-N 3.35Å
152	F	98.4	Very high	96.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-56.3	-48.4	172.8	169.2	-105.8	0	0	0	111.6	L50 A59 F60 F63 S148 Y149 R154 S155 M157 Y158	L50-F152 HydrophobicContact CD1-CD1 4.48Å; L50-F152 HydrophobicContact CD1-CE1 3.66Å; L50-F152 HydrophobicContact CD1-CZ 4.18Å; L50-F152 HydrophobicContact CD2-CD1 3.94Å; L50-F152 HydrophobicContact CD2-CE1 3.94Å; A59-F152 HydrophobicContact CB-CE2 4.04Å; A59-F152 HydrophobicContact CB-CZ 3.93Å; F60-F152 HydrophobicContact CD2-CB 3.8Å; F60-F152 HydrophobicContact CD2-CD1 4.05Å; F60-F152 HydrophobicContact CD2-CD2 4.11Å; F60-F152 AromaticContact CD2-CG 3.71Å; F60-F152 HydrophobicContact CD2-CG 3.71Å; F60-F152 HydrophobicContact CE2-CB 3.85Å; F60-F152 HydrophobicContact CE2-CG 4.27Å; F63-F152 HydrophobicContact CB-CD2 3.6Å; F63-F152 HydrophobicContact CB-CE2 4.2Å; F63-F152 HydrophobicContact CD1-CB 3.68Å; F63-F152 HydrophobicContact CD1-CD2 4.1Å; F63-F152 HydrophobicContact CD1-CG 4.35Å; F63-F152 HydrophobicContact CD2-CB 4.44Å; F63-F152 HydrophobicContact CD2-CD2 4.13Å; F63-F152 HydrophobicContact CE1-CB 3.77Å; F63-F152 HydrophobicContact CG-CB 4.03Å; F63-F152 AromaticContact CG-CD2 3.67Å; F63-F152 HydrophobicContact CG-CD2 3.67Å; F63-F152 HydrophobicContact CG-CG 4.34Å; F63-F152 HydrophobicContact CZ-CB 4.19Å; S148-F152 WeakPolarHBondContact O-CB 3.49Å; S148-F152 PolarHBondContact O-N 3.12Å; Y149-F152 WeakPolarHBondContact O-CB 3.42Å; Y149-F152 PolarHBondContact O-N 3.37Å; Y149-F152 VanDerWaalsContact O-N 3.15Å; F152-R154 PolarHBondContact O-N 3.15Å; F152-S155 VanDerWaalsContact O-CB 3.22Å; F152-S155 WeakPolarHBondContact O-CB 3.44Å; F152-S155 PolarHBondContact O-N 3.5Å; F152-S155 PolarHBondContact O-OG 3.06Å; F152-M157 HydrophobicContact CE2-SD 4.36Å; F152-Y158 HydrophobicContact CD1-CD2 4.48Å; F152-Y158 AromaticContact CE1-CD2 3.64Å; F152-Y158 HydrophobicContact CE1-CD2 3.64Å; F152-Y158 HydrophobicContact CE1-CE2 4.33Å; F152-Y158 HydrophobicContact CE1-CG 4.23Å; F152-Y158 AromaticContact CZ-CD2 3.8Å; F152-Y158 HydrophobicContact CZ-CD2 3.8Å; F152-Y158 HydrophobicContact CZ-CG 4.39Å; F152-Y158 WeakPolarHBondContact O-CB 3.42Å
153	L	97.6	Very high	95.7	Very high	30 Å²	30	59.1 Å²	59.1	16%	0.157	28%	0.277	C	S	.	.	H	α-helix	trans	-64.2	-27.7	179.8	-63.6	-179.6	0	0	0	113.5	Y149 R151 Y158 Q159	Y149-L153 HydrophobicContact CD2-CD1 4.43Å; Y149-L153 HydrophobicContact CD2-CG 4.24Å; Y149-L153 HydrophobicContact CE1-CD1 4.12Å; Y149-L153 HydrophobicContact CE2-CD1 3.81Å; Y149-L153 HydrophobicContact CE2-CD2 3.92Å; Y149-L153 HydrophobicContact CE2-CG 3.86Å; Y149-L153 WeakPolarHBondContact O-CG 3.42Å; Y149-L153 PolarHBondContact O-N 3.32Å; R151-L153 PolarHBondContact O-N 3.06Å; L153-Y158 HydrophobicContact CB-CD1 4.47Å; L153-Y158 HydrophobicContact CD2-CD1 4.18Å; L153-Y158 HydrophobicContact CD2-CD2 4.26Å; L153-Y158 HydrophobicContact CD2-CE1 3.9Å; L153-Y158 HydrophobicContact CD2-CE2 4.01Å; L153-Y158 HydrophobicContact CD2-CG 4.33Å; L153-Y158 WeakPolarHBondContact O-CD1 3.16Å; L153-Q159 PolarHBondContact O-NE2 3.13Å
154	R	97.3	Very high	95.1	Very high	181 Å²	181	62 Å²	62	68%	0.683	28%	0.284	S	S	*	.	H	α-helix	trans	-87.9	-9.4	174	-68.3	-175.5	-64.9	-124.4	-1.5	113.4	P150 R151 F152	P150-R154 PolarHBondContact O-N 3.46Å; P150-R154 PolarHBondContact O-NE 3.08Å; R151-R154 CarbonylContact O-C 3.41Å; R151-R154 PolarHBondContact O-N 2.93Å; F152-R154 PolarHBondContact O-N 3.15Å
155	S	97.1	Very high	94.5	Very high	18 Å²	18	62.3 Å²	62.3	13%	0.126	29%	0.286	C	S	.	.	S	Bend	trans	-70	149.2	-175.7	76.6	0	0	0	0	111.4	R151 F152 M157 Y158 Q159	R151-S155 PolarHBondContact O-N 3.35Å; F152-S155 VanDerWaalsContact O-CB 3.22Å; F152-S155 WeakPolarHBondContact O-CB 3.44Å; F152-S155 PolarHBondContact O-N 3.5Å; F152-S155 PolarHBondContact O-OG 3.06Å; S155-M157 PolarHBondContact O-N 2.98Å; S155-Y158 PolarHBondContact O-N 3.12Å; S155-Y158 PolarHBondContact OG-N 3.37Å; S155-Q159 WeakPolarHBondContact O-CG 3.24Å; S155-Q159 PolarHBondContact O-N 3.23Å; S155-Q159 VanDerWaalsContact O-N 3.14Å
156	K	94.8	Very high	93.7	Very high	162 Å²	162	63.1 Å²	63.1	70%	0.704	29%	0.29	S	S	*	.	H	α-helix	trans	-55.5	-34.7	171.8	-175.1	176.8	177.7	-176.7	0	111.7	Y158 Q159 D160	K156-Y158 PolarHBondContact O-N 3.19Å; K156-Q159 PolarHBondContact O-N 3.22Å; K156-D160 WeakPolarHBondContact O-CB 3.42Å; K156-D160 PolarHBondContact O-N 3.14Å
157	M	92.8	Very high	92.8	Very high	33 Å²	33	57.8 Å²	57.8	16%	0.163	28%	0.275	C	S	.	.	H	α-helix	trans	-56.7	-51.4	177.3	-178	-174.3	-74.5	0	0	111.9	F18 T62 F63 F152 S155 I161	F18-M157 HydrophobicContact CD1-CE 4Å; F18-M157 HydrophobicContact CE1-CE 3.3Å; F18-M157 HydrophobicContact CZ-CE 3.77Å; T62-M157 HydrophobicContact CG2-CE 3.78Å; F63-M157 HydrophobicContact CB-SD 3.92Å; F152-M157 HydrophobicContact CE2-SD 4.36Å; S155-M157 PolarHBondContact O-N 2.98Å; M157-I161 HydrophobicContact CG-CD1 4.46Å; M157-I161 VanDerWaalsContact O-CG1 3.31Å; M157-I161 WeakPolarHBondContact O-CG1 3.38Å; M157-I161 PolarHBondContact O-N 3.45Å
158	Y	93.9	Very high	91.5	Very high	12 Å²	12	57.7 Å²	57.7	5%	0.047	27%	0.272	C	S	.	.	H	α-helix	trans	-67.6	-42.6	179	178.5	-104.3	0	0	0	111.9	V40 W43 S44 F152 L153 S155 K156 D160 I161 V162	V40-Y158 HydrophobicContact CG1-CE2 3.9Å; V40-Y158 PolarHBondContact O-OH 2.7Å; V40-Y158 VanDerWaalsContact O-OH 3.06Å; W43-Y158 HydrophobicContact CB-CE2 4.27Å; W43-Y158 HydrophobicContact CE3-CD2 4.26Å; W43-Y158 AromaticContact CE3-CE2 3.96Å; W43-Y158 HydrophobicContact CE3-CE2 3.96Å; S44-Y158 WeakPolarHBondContact CB-OH 3.46Å; F152-Y158 HydrophobicContact CD1-CD2 4.48Å; F152-Y158 AromaticContact CE1-CD2 3.64Å; F152-Y158 HydrophobicContact CE1-CD2 3.64Å; F152-Y158 HydrophobicContact CE1-CE2 4.33Å; F152-Y158 HydrophobicContact CE1-CG 4.23Å; F152-Y158 AromaticContact CZ-CD2 3.8Å; F152-Y158 HydrophobicContact CZ-CD2 3.8Å; F152-Y158 HydrophobicContact CZ-CG 4.39Å; F152-Y158 WeakPolarHBondContact O-CB 3.42Å; L153-Y158 HydrophobicContact CB-CD1 4.47Å; L153-Y158 HydrophobicContact CD2-CD1 4.18Å; L153-Y158 HydrophobicContact CD2-CD2 4.26Å; L153-Y158 HydrophobicContact CD2-CE1 3.9Å; L153-Y158 HydrophobicContact CD2-CE2 4.01Å; L153-Y158 HydrophobicContact CD2-CG 4.33Å; L153-Y158 WeakPolarHBondContact O-CD1 3.16Å; S155-Y158 PolarHBondContact O-N 3.12Å; S155-Y158 PolarHBondContact OG-N 3.37Å; K156-Y158 PolarHBondContact O-N 3.19Å; Y158-D160 VanDerWaalsContact C-N 3.31Å; Y158-D160 PolarHBondContact O-N 3.18Å; Y158-I161 WeakPolarHBondContact O-CB 3.32Å; Y158-I161 PolarHBondContact O-N 3.08Å; Y158-I161 VanDerWaalsContact O-N 3.09Å; Y158-V162 HydrophobicContact CD1-CG2 4.08Å; Y158-V162 HydrophobicContact CE1-CG2 3.62Å; Y158-V162 HydrophobicContact CE2-CG2 4.06Å; Y158-V162 WeakPolarHBondContact O-CG2 3.49Å; Y158-V162 PolarHBondContact O-N 2.97Å
159	Q	93.7	Very high	89.9	Confident	83 Å²	83	58.8 Å²	58.8	39%	0.388	29%	0.285	S	S	.	.	H	α-helix	trans	-60.6	-39.9	178.3	-62.2	-59.3	-39.2	0	0	112.1	L153 S155 K156 I161 V162 N163	L153-Q159 PolarHBondContact O-NE2 3.13Å; S155-Q159 WeakPolarHBondContact O-CG 3.24Å; S155-Q159 PolarHBondContact O-N 3.23Å; S155-Q159 VanDerWaalsContact O-N 3.14Å; K156-Q159 PolarHBondContact O-N 3.22Å; Q159-I161 VanDerWaalsContact C-N 3.33Å; Q159-I161 PolarHBondContact O-N 2.86Å; Q159-V162 PolarHBondContact O-N 3.16Å; Q159-N163 WeakPolarHBondContact O-CB 3.15Å; Q159-N163 PolarHBondContact O-N 2.69Å; Q159-N163 PolarHBondContact O-ND2 3.39Å; Q159-N163 VanDerWaalsContact O-ND2 3.14Å
160	D	91	Very high	88	Confident	62 Å²	62	64.6 Å²	64.6	33%	0.332	31%	0.312	S	S	.	.	H	α-helix	trans	-65.1	-35.9	175.6	-73.4	-14.4	0	0	0	111.9	K156 Y158 R164	K156-D160 WeakPolarHBondContact O-CB 3.42Å; K156-D160 PolarHBondContact O-N 3.14Å; Y158-D160 VanDerWaalsContact C-N 3.31Å; Y158-D160 PolarHBondContact O-N 3.18Å; D160-R164 WeakPolarHBondContact O-CB 3.31Å; D160-R164 WeakPolarHBondContact O-CD 3.36Å; D160-R164 WeakPolarHBondContact O-CG 3.17Å; D160-R164 PolarHBondContact O-N 2.92Å; D160-R164 VanDerWaalsContact O-N 3.08Å
161	I	90.8	Very high	86.2	Confident	35 Å²	35	72.9 Å²	72.9	18%	0.179	34%	0.338	C	S	.	.	H	α-helix	trans	-65.8	-47.5	175.1	-65.7	165.2	0	0	0	110.5	L35 V40 W43 A59 M157 Y158 Q159 N163 R164 A165	L35-I161 HydrophobicContact CD1-CG2 4.49Å; V40-I161 HydrophobicContact CG1-CG2 3.84Å; V40-I161 HydrophobicContact CG2-CG2 4.01Å; W43-I161 HydrophobicContact CH2-CG2 4.27Å; W43-I161 HydrophobicContact CZ3-CD1 4.31Å; W43-I161 HydrophobicContact CZ3-CG2 4.03Å; A59-I161 HydrophobicContact CB-CD1 3.96Å; M157-I161 HydrophobicContact CG-CD1 4.46Å; M157-I161 VanDerWaalsContact O-CG1 3.31Å; M157-I161 WeakPolarHBondContact O-CG1 3.38Å; M157-I161 PolarHBondContact O-N 3.45Å; Y158-I161 WeakPolarHBondContact O-CB 3.32Å; Y158-I161 PolarHBondContact O-N 3.08Å; Y158-I161 VanDerWaalsContact O-N 3.09Å; Q159-I161 VanDerWaalsContact C-N 3.33Å; Q159-I161 PolarHBondContact O-N 2.86Å; I161-N163 PolarHBondContact O-N 3.46Å; I161-R164 PolarHBondContact O-N 3.15Å; I161-A165 PolarHBondContact O-N 3.24Å
162	V	89.9	Confident	84.1	Confident	20 Å²	20	76.2 Å²	76.2	12%	0.121	35%	0.351	C	S	.	.	H	α-helix	trans	-58	-50.1	177.4	171.3	0	0	0	0	110.6	V40 Y158 Q159 R164 A165 H166	V40-V162 HydrophobicContact CG1-CB 4.47Å; V40-V162 HydrophobicContact CG1-CG2 3.57Å; Y158-V162 HydrophobicContact CD1-CG2 4.08Å; Y158-V162 HydrophobicContact CE1-CG2 3.62Å; Y158-V162 HydrophobicContact CE2-CG2 4.06Å; Y158-V162 WeakPolarHBondContact O-CG2 3.49Å; Y158-V162 PolarHBondContact O-N 2.97Å; Q159-V162 PolarHBondContact O-N 3.16Å; V162-R164 VanDerWaalsContact C-N 3.33Å; V162-R164 PolarHBondContact O-N 3.5Å; V162-A165 WeakPolarHBondContact O-CB 3.47Å; V162-A165 PolarHBondContact O-N 3.11Å; V162-A165 VanDerWaalsContact O-N 3.12Å; V162-H166 VanDerWaalsContact CG1-CD2 3.48Å; V162-H166 WeakPolarHBondContact CG1-CD2 3.48Å; V162-H166 WeakPolarHBondContact CG1-NE2 3.2Å; V162-H166 PolarHBondContact O-CD2 3.49Å; V162-H166 PolarHBondContact O-N 3.05Å
163	N	88.3	Confident	81.9	Confident	95 Å²	95	81.5 Å²	81.5	51%	0.508	39%	0.387	S	S	.	.	H	α-helix	trans	-59.5	-41.6	179.6	-72.2	-28.5	0	0	0	112.5	Q159 I161 H166 A167	Q159-N163 WeakPolarHBondContact O-CB 3.15Å; Q159-N163 PolarHBondContact O-N 2.69Å; Q159-N163 PolarHBondContact O-ND2 3.39Å; Q159-N163 VanDerWaalsContact O-ND2 3.14Å; I161-N163 PolarHBondContact O-N 3.46Å; N163-H166 PolarHBondContact O-N 2.98Å; N163-A167 PolarHBondContact O-N 3.12Å
164	R	85.9	Confident	79.2	Confident	125 Å²	125	89.2 Å²	89.2	47%	0.472	44%	0.435	S	S	.	.	H	α-helix	trans	-64.9	-40.9	175.9	-72.6	167.3	-171.3	-117.8	9.2	111.8	L22 D160 I161 V162 A167 Q168	L22-R164 VanDerWaalsContact CD1-CZ 3.47Å; D160-R164 WeakPolarHBondContact O-CB 3.31Å; D160-R164 WeakPolarHBondContact O-CD 3.36Å; D160-R164 WeakPolarHBondContact O-CG 3.17Å; D160-R164 PolarHBondContact O-N 2.92Å; D160-R164 VanDerWaalsContact O-N 3.08Å; I161-R164 PolarHBondContact O-N 3.15Å; V162-R164 VanDerWaalsContact C-N 3.33Å; V162-R164 PolarHBondContact O-N 3.5Å; R164-A167 PolarHBondContact O-N 3.09Å; R164-Q168 WeakPolarHBondContact O-CG 3.29Å; R164-Q168 PolarHBondContact O-N 3.05Å; R164-Q168 VanDerWaalsContact O-N 3.14Å
165	A	84.9	Confident	78.3	Confident	5 Å²	5	84.6 Å²	84.6	4%	0.041	42%	0.423	C	S	.	.	H	α-helix	trans	-62.9	-44.7	177.3	0	0	0	0	0	111.4	T37 V40 I161 V162 A167 Q168 G169	T37-A165 PolarHBondContact OG1-O 3.3Å; V40-A165 HydrophobicContact CG2-CB 4.04Å; I161-A165 PolarHBondContact O-N 3.24Å; V162-A165 WeakPolarHBondContact O-CB 3.47Å; V162-A165 PolarHBondContact O-N 3.11Å; V162-A165 VanDerWaalsContact O-N 3.12Å; A165-A167 PolarHBondContact O-N 3.1Å; A165-Q168 PolarHBondContact O-N 3.31Å; A165-G169 PolarHBondContact O-N 3.26Å
166	H	81.9	Confident	77.4	Confident	82 Å²	82	88.1 Å²	88.1	38%	0.38	44%	0.439	S	S	.	.	H	α-helix	trans	-60.2	-46.3	175.1	-75.1	-70	0	0	0	113.1	T37 V162 N163 Q168 G169 Q170	T37-H166 WeakPolarHBondContact CG2-CE1 3.36Å; T37-H166 WeakPolarHBondContact CG2-ND1 3.44Å; V162-H166 VanDerWaalsContact CG1-CD2 3.48Å; V162-H166 WeakPolarHBondContact CG1-CD2 3.48Å; V162-H166 WeakPolarHBondContact CG1-NE2 3.2Å; V162-H166 PolarHBondContact O-CD2 3.49Å; V162-H166 PolarHBondContact O-N 3.05Å; N163-H166 PolarHBondContact O-N 2.98Å; H166-Q168 PolarHBondContact O-N 3.14Å; H166-G169 PolarHBondContact O-N 3.25Å; H166-G169 VanDerWaalsContact O-N 3.09Å; H166-Q170 PolarHBondContact O-N 3.25Å; H166-Q170 VanDerWaalsContact O-N 3.1Å
167	A	78.9	Confident	76.4	Confident	48 Å²	48	84 Å²	84	40%	0.397	42%	0.424	S	S	.	.	H	α-helix	trans	-62.5	-31.9	179.1	0	0	0	0	0	112.6	N163 R164 A165	N163-A167 PolarHBondContact O-N 3.12Å; R164-A167 PolarHBondContact O-N 3.09Å; A165-A167 PolarHBondContact O-N 3.1Å
168	Q	71	Confident	75.4	Confident	73 Å²	73	87 Å²	87	34%	0.341	44%	0.439	S	S	.	.	H	α-helix	trans	-75.9	-29.3	175	-70.3	-179.1	15.2	0	0	113.1	R164 A165 H166	R164-Q168 WeakPolarHBondContact O-CG 3.29Å; R164-Q168 PolarHBondContact O-N 3.05Å; R164-Q168 VanDerWaalsContact O-N 3.14Å; A165-Q168 PolarHBondContact O-N 3.31Å; H166-Q168 PolarHBondContact O-N 3.14Å
169	G	63.4	Low	74.3	Confident	27 Å²	27	91.7 Å²	91.7	28%	0.278	46%	0.464	S	S	.	.	H	α-helix	trans	-68.1	-44.9	173.4	0	0	0	0	0	112.8	A165 H166 R171 R172	A165-G169 PolarHBondContact O-N 3.26Å; H166-G169 PolarHBondContact O-N 3.25Å; H166-G169 VanDerWaalsContact O-N 3.09Å; G169-R171 PolarHBondContact O-N 3.15Å; G169-R172 WeakPolarHBondContact O-CB 3.48Å; G169-R172 PolarHBondContact O-N 3.16Å; G169-R172 VanDerWaalsContact O-N 3.16Å
170	Q	59.7	Low	73	Confident	141 Å²	141	92.3 Å²	92.3	66%	0.659	47%	0.469	S	S	*	.	H	α-helix	trans	-67	-34.8	-178.4	-70.6	175.5	-9.3	0	0	113.4	H166 R172 S173	H166-Q170 PolarHBondContact O-N 3.25Å; H166-Q170 VanDerWaalsContact O-N 3.1Å; Q170-R172 PolarHBondContact O-N 3.44Å; Q170-R172 VanDerWaalsContact O-N 3.15Å; Q170-S173 PolarHBondContact O-N 3.24Å
171	R	59.7	Low	71.7	Confident	214 Å²	214	94.4 Å²	94.4	81%	0.808	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-11.4	174.6	-78.8	179.8	170.4	162.5	-2.1	114.4	G169	G169-R171 PolarHBondContact O-N 3.15Å
172	R	54.6	Low	70.2	Confident	155 Å²	155	99 Å²	99	59%	0.585	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-10.1	178.9	-71.5	172.8	140.4	173.2	-7.2	113.4	K34 G169 Q170	K34-R172 VanDerWaalsContact CD-CZ 3.47Å; G169-R172 WeakPolarHBondContact O-CB 3.48Å; G169-R172 PolarHBondContact O-N 3.16Å; G169-R172 VanDerWaalsContact O-N 3.16Å; Q170-R172 PolarHBondContact O-N 3.44Å; Q170-R172 VanDerWaalsContact O-N 3.15Å
173	S	53.3	Low	68.6	Low	110 Å²	110	105.6 Å²	105.6	77%	0.769	53%	0.533	S	S	*	.			trans	-103.4	9.7	-175.6	-58.1	0	0	0	0	113.6	Q170	Q170-S173 PolarHBondContact O-N 3.24Å
174	V	41.2	Very low	66.8	Low	192 Å²	192	106.5 Å²	106.5	100%	1.164	54%	0.536	S	S	*	.			trans	-117.1	0	177.2	-171.9	0	0	0	0	109.2

Retrieved 174 of 174 residues in 51.5 ms (Link to these results)

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