A0A060X8W5_ONCMY Loading...

Regulator of G protein signaling 2

AlphaFold DB , UniProt , Accession A0A060X8W5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110524588, Length 198 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	40.6	Very low	32.6	Very low	231 Å²	231	170.8 Å²	170.8	100%	1.138	86%	0.859	S	S	*	*				0	137.3	0	-115.6	-168.5	-119.7	0	0	108
2	R	33.8	Very low	32.7	Very low	223 Å²	223	165.3 Å²	165.3	84%	0.842	86%	0.859	S	S	*	*			trans	81.6	100.5	174.2	-53.9	179.3	-170.1	-165.5	1.2	114.3
3	E	33	Very low	32.6	Very low	186 Å²	186	161 Å²	161	87%	0.869	85%	0.85	S	S	*	*				78.6	120	67	-76	-170.1	167.6	0	0	114.3
4	C	28.6	Very low	33	Very low	119 Å²	119	158.4 Å²	158.4	80%	0.804	84%	0.844	S	S	*	*				172.6	105.8	127.1	-95	0	0	0	0	108.4
5	V	32.7	Very low	32.8	Very low	131 Å²	131	158.4 Å²	158.4	79%	0.794	84%	0.844	S	S	*	*				89	114	87.5	172.7	0	0	0	0	112.8
6	V	32.4	Very low	33	Very low	113 Å²	113	155.7 Å²	155.7	69%	0.685	84%	0.84	S	S	*	*			trans	-12.6	136.1	159.8	-172	0	0	0	0	117.4	E8	V6-E8 HydrophobicContact CG1-CG 3.82Å
7	S	29.8	Very low	33	Very low	125 Å²	125	157.3 Å²	157.3	87%	0.874	84%	0.843	S	S	*	*			trans	-126.1	111.7	148.1	-173.5	0	0	0	0	108.6
8	E	31.6	Very low	33	Very low	166 Å²	166	158.4 Å²	158.4	78%	0.776	84%	0.839	S	S	*	*			trans	-66.7	147.6	177.2	-83.8	156.1	141.3	0	0	111.8	V6	V6-E8 HydrophobicContact CG1-CG 3.82Å
9	R	32.8	Very low	32.9	Very low	247 Å²	247	156.1 Å²	156.1	93%	0.932	85%	0.845	S	S	*	*			trans	-84	113.2	170.6	-77.4	172.2	-108.6	179.6	-5.9	107.5
10	D	30.8	Very low	33.1	Very low	158 Å²	158	152.5 Å²	152.5	85%	0.845	83%	0.832	S	S	*	*			trans	-108.2	121.1	158.2	-86	-29.6	0	0	0	109
11	M	32.4	Very low	33.2	Very low	180 Å²	180	152.2 Å²	152.2	89%	0.887	83%	0.83	S	S	*	*				-177.3	97.7	123.4	-166.9	163.4	-74.6	0	0	108.6
12	A	33.2	Very low	32.7	Very low	104 Å²	104	150 Å²	150	86%	0.86	81%	0.814	S	S	*	*			trans	-86.3	119.5	150.9	0	0	0	0	0	107.5
13	C	32.4	Very low	32.5	Very low	110 Å²	110	145 Å²	145	74%	0.743	81%	0.813	S	S	*	*			trans	-145.5	114.1	140.8	-160.6	0	0	0	0	108.3	D15	C13-D15 PolarHBondContact O-N 3.31Å
14	T	37.8	Very low	32.8	Very low	125 Å²	125	141 Å²	141	77%	0.767	80%	0.797	S	S	*	*			trans	-52.6	124	164.5	41.6	0	0	0	0	110.8
15	D	29.9	Very low	33.3	Very low	158 Å²	158	140 Å²	140	85%	0.845	78%	0.784	S	S	*	*			trans	-150.1	119.8	140.7	-102.1	-29.5	0	0	0	111.3	C13 M17	C13-D15 PolarHBondContact O-N 3.31Å; D15-M17 PolarHBondContact O-N 3.04Å
16	C	35.7	Very low	33.7	Very low	115 Å²	115	138 Å²	138	78%	0.777	77%	0.772	S	S	*	*			trans	-74.9	95.8	178	179	0	0	0	0	108.7	K18	C16-K18 PolarHBondContact O-N 3.38Å
17	M	33	Very low	34.4	Very low	183 Å²	183	140.9 Å²	140.9	90%	0.901	78%	0.775	S	S	*	*			trans	-81	100.4	164.1	-70.5	-152.9	139	0	0	109.2	D15 A19	D15-M17 PolarHBondContact O-N 3.04Å; M17-A19 PolarHBondContact O-N 2.89Å
18	K	32.6	Very low	35.2	Very low	177 Å²	177	136 Å²	136	77%	0.77	75%	0.745	S	S	*	*			trans	-52.9	120.1	167.7	-76.8	173.3	176.6	172.2	0	109.4	C16 S20	C16-K18 PolarHBondContact O-N 3.38Å; K18-S20 PolarHBondContact O-N 3.12Å
19	A	32.1	Very low	36.1	Very low	114 Å²	114	133.1 Å²	133.1	94%	0.942	73%	0.733	S	S	*	*			trans	-73.8	79.3	164.8	0	0	0	0	0	109	M17	M17-A19 PolarHBondContact O-N 2.89Å
20	S	36.3	Very low	37.2	Very low	85 Å²	85	126.8 Å²	126.8	59%	0.594	71%	0.713	S	S	*	*			trans	-108	122.9	162	38.8	0	0	0	0	108.7	K18	K18-S20 PolarHBondContact O-N 3.12Å
21	D	35.1	Very low	38.4	Very low	147 Å²	147	123.6 Å²	123.6	79%	0.786	69%	0.691	S	S	*	*			trans	75.8	74.6	159.4	-54.8	-28.9	0	0	0	119.2
22	F	30	Very low	39.6	Very low	185 Å²	185	124.4 Å²	124.4	81%	0.811	68%	0.684	S	S	*	*			trans	-141.1	63.1	135.1	-139	-105.5	0	0	0	110.8	I24	F22-I24 HydrophobicContact CD1-CD1 3.84Å; F22-I24 HydrophobicContact CD1-CG1 3.42Å; F22-I24 VanDerWaalsContact CD1-CG1 3.42Å; F22-I24 HydrophobicContact CE1-CD1 3.58Å; F22-I24 HydrophobicContact CE1-CG1 3.36Å; F22-I24 HydrophobicContact CZ-CG1 4.47Å; F22-I24 PolarHBondContact O-N 3.02Å
23	S	31.1	Very low	41.1	Very low	117 Å²	117	123.6 Å²	123.6	82%	0.818	67%	0.666	S	S	*	*			trans	-72.6	85	161	-74.7	0	0	0	0	108.3	D25	S23-D25 VanDerWaalsContact C-N 3.34Å; S23-D25 PolarHBondContact O-N 3.08Å
24	I	37.8	Very low	42.5	Very low	103 Å²	103	119.6 Å²	119.6	53%	0.528	64%	0.635	S	S	.	*			trans	-60.5	108.6	157.7	-58.7	177.9	0	0	0	105	F22 T26 I29	F22-I24 HydrophobicContact CD1-CD1 3.84Å; F22-I24 HydrophobicContact CD1-CG1 3.42Å; F22-I24 VanDerWaalsContact CD1-CG1 3.42Å; F22-I24 HydrophobicContact CE1-CD1 3.58Å; F22-I24 HydrophobicContact CE1-CG1 3.36Å; F22-I24 HydrophobicContact CZ-CG1 4.47Å; F22-I24 PolarHBondContact O-N 3.02Å; I24-T26 PolarHBondContact O-N 2.91Å; I24-I29 HydrophobicContact CG2-CD1 3.94Å
25	D	39.3	Very low	43.8	Very low	98 Å²	98	117.7 Å²	117.7	52%	0.524	61%	0.614	S	S	.	*			trans	-65.4	77.7	-179.6	-178	16.9	0	0	0	110.3	S23 K27 G28 I29	S23-D25 VanDerWaalsContact C-N 3.34Å; S23-D25 PolarHBondContact O-N 3.08Å; D25-K27 PolarHBondContact O-N 2.86Å; D25-K27 WeakPolarHBondContact OD1-CB 3.18Å; D25-K27 PolarHBondContact OD1-N 3.44Å; D25-G28 PolarHBondContact O-N 2.87Å; D25-G28 VanDerWaalsContact O-N 3.09Å; D25-G28 PolarHBondContact OD1-N 2.98Å; D25-G28 VanDerWaalsContact OD2-CA 3.26Å; D25-G28 WeakPolarHBondContact OD2-CA 3.49Å; D25-G28 PolarHBondContact OD2-N 3.4Å; D25-I29 PolarHBondContact O-N 3.11Å
26	T	42.4	Very low	45.6	Very low	89 Å²	89	114.2 Å²	114.2	55%	0.546	60%	0.598	S	S	.	*	H	α-helix	trans	-61.3	-25.9	174.2	54.3	0	0	0	0	110.9	I24 K30	I24-T26 PolarHBondContact O-N 2.91Å; T26-K30 WeakPolarHBondContact O-CB 3.44Å; T26-K30 VanDerWaalsContact O-CG 3.31Å; T26-K30 WeakPolarHBondContact O-CG 3.08Å; T26-K30 PolarHBondContact O-N 3.49Å
27	K	46.8	Very low	47.1	Very low	172 Å²	172	111.6 Å²	111.6	75%	0.748	57%	0.572	S	S	*	*	H	α-helix	trans	-66.8	-46.3	172.3	-63.6	178.5	178.6	175.9	0	110.1	D25 K31	D25-K27 PolarHBondContact O-N 2.86Å; D25-K27 WeakPolarHBondContact OD1-CB 3.18Å; D25-K27 PolarHBondContact OD1-N 3.44Å; K27-K31 WeakPolarHBondContact O-CB 3.32Å; K27-K31 PolarHBondContact O-N 3.44Å
28	G	45.5	Very low	48.6	Very low	23 Å²	23	103.1 Å²	103.1	24%	0.237	53%	0.53	C	S	.	.	H	α-helix	trans	-62.7	-39.7	175.6	0	0	0	0	0	114	D25 K31 R32	D25-G28 PolarHBondContact O-N 2.87Å; D25-G28 VanDerWaalsContact O-N 3.09Å; D25-G28 PolarHBondContact OD1-N 2.98Å; D25-G28 VanDerWaalsContact OD2-CA 3.26Å; D25-G28 WeakPolarHBondContact OD2-CA 3.49Å; D25-G28 PolarHBondContact OD2-N 3.4Å; G28-K31 WeakPolarHBondContact O-CB 3.45Å; G28-K31 PolarHBondContact O-N 3.15Å; G28-R32 WeakPolarHBondContact O-CB 3.41Å; G28-R32 PolarHBondContact O-N 3.41Å
29	I	51.4	Low	50.2	Low	105 Å²	105	102 Å²	102	54%	0.538	52%	0.521	S	S	.	.	H	α-helix	trans	-67.9	-48.3	176.7	-64.9	168.5	0	0	0	110.9	I24 D25 K31 R32 N33	I24-I29 HydrophobicContact CG2-CD1 3.94Å; D25-I29 PolarHBondContact O-N 3.11Å; I29-K31 PolarHBondContact O-N 2.98Å; I29-R32 PolarHBondContact O-N 3.28Å; I29-N33 WeakPolarHBondContact O-CB 3.44Å; I29-N33 PolarHBondContact O-N 3.03Å
30	K	55	Low	51.6	Low	115 Å²	115	103.3 Å²	103.3	50%	0.5	50%	0.503	S	S	.	.	H	α-helix	trans	-59.5	-37.9	172.4	-73.3	-177.3	178	-169.2	0	110.7	T26 N33 W34	T26-K30 WeakPolarHBondContact O-CB 3.44Å; T26-K30 VanDerWaalsContact O-CG 3.31Å; T26-K30 WeakPolarHBondContact O-CG 3.08Å; T26-K30 PolarHBondContact O-N 3.49Å; K30-N33 PolarHBondContact O-N 3.04Å; K30-W34 PolarHBondContact O-N 3.28Å
31	K	56	Low	52.9	Low	90 Å²	90	100.8 Å²	100.8	39%	0.391	48%	0.483	S	S	.	.	H	α-helix	trans	-60.6	-48.8	178.1	-159.4	179	-173.3	170.1	0	113.2	K27 G28 I29 N33 W34 R35	K27-K31 WeakPolarHBondContact O-CB 3.32Å; K27-K31 PolarHBondContact O-N 3.44Å; G28-K31 WeakPolarHBondContact O-CB 3.45Å; G28-K31 PolarHBondContact O-N 3.15Å; I29-K31 PolarHBondContact O-N 2.98Å; K31-N33 VanDerWaalsContact C-N 3.33Å; K31-W34 VanDerWaalsContact CA-CD1 3.48Å; K31-W34 VanDerWaalsContact CA-NE1 3.28Å; K31-W34 HydrophobicContact CB-CZ2 4.41Å; K31-W34 HydrophobicContact CD-CZ2 4.26Å; K31-W34 HydrophobicContact CG-CH2 4.3Å; K31-W34 HydrophobicContact CG-CZ2 3.31Å; K31-W34 VanDerWaalsContact O-CD2 3.28Å; K31-W34 VanDerWaalsContact O-CE2 3.26Å; K31-R35 WeakPolarHBondContact O-CG 3.31Å; K31-R35 PolarHBondContact O-N 3.14Å
32	R	58.8	Low	54.2	Low	197 Å²	197	95.8 Å²	95.8	74%	0.743	46%	0.455	S	S	*	.	H	α-helix	trans	-69.1	-33.5	179.3	-172.9	171.6	158.9	171.1	-6.3	111.9	G28 I29 R35 T36	G28-R32 WeakPolarHBondContact O-CB 3.41Å; G28-R32 PolarHBondContact O-N 3.41Å; I29-R32 PolarHBondContact O-N 3.28Å; R32-R35 PolarHBondContact O-N 3.43Å; R32-T36 PolarHBondContact O-N 2.88Å
33	N	63.9	Low	55.4	Low	87 Å²	87	93.8 Å²	93.8	47%	0.465	45%	0.447	S	S	.	.	H	α-helix	trans	-68.7	-47.3	178.5	-162.9	-36.9	0	0	0	111.6	I29 K30 K31 R35 T36 R37	I29-N33 WeakPolarHBondContact O-CB 3.44Å; I29-N33 PolarHBondContact O-N 3.03Å; K30-N33 PolarHBondContact O-N 3.04Å; K31-N33 VanDerWaalsContact C-N 3.33Å; N33-R35 VanDerWaalsContact C-N 3.27Å; N33-R35 PolarHBondContact O-N 3.11Å; N33-T36 PolarHBondContact O-N 3.47Å; N33-R37 VanDerWaalsContact O-CG 3.32Å; N33-R37 WeakPolarHBondContact O-CG 3.45Å; N33-R37 PolarHBondContact O-N 3.3Å; N33-R37 VanDerWaalsContact O-N 3.13Å; N33-R37 VanDerWaalsContact OD1-CD 3.25Å; N33-R37 WeakPolarHBondContact OD1-CD 3.33Å
34	W	63.1	Low	56.1	Low	27 Å²	27	90.4 Å²	90.4	10%	0.102	42%	0.419	C	S	.	.	H	α-helix	trans	-64.8	-31	177	66.6	-118.5	0	0	0	112.6	K30 K31 T36 R37 I38 E186	K30-W34 PolarHBondContact O-N 3.28Å; K31-W34 VanDerWaalsContact CA-CD1 3.48Å; K31-W34 VanDerWaalsContact CA-NE1 3.28Å; K31-W34 HydrophobicContact CB-CZ2 4.41Å; K31-W34 HydrophobicContact CD-CZ2 4.26Å; K31-W34 HydrophobicContact CG-CH2 4.3Å; K31-W34 HydrophobicContact CG-CZ2 3.31Å; K31-W34 VanDerWaalsContact O-CD2 3.28Å; K31-W34 VanDerWaalsContact O-CE2 3.26Å; W34-T36 PolarHBondContact O-N 3.22Å; W34-R37 CarbonylContact O-C 3.15Å; W34-R37 PolarHBondContact O-N 3.49Å; W34-R37 VanDerWaalsContact O-N 3.14Å; W34-I38 HydrophobicContact CD2-CD1 4.38Å; W34-I38 HydrophobicContact CE3-CD1 3.33Å; W34-I38 HydrophobicContact CE3-CG1 4.13Å; W34-I38 HydrophobicContact CZ3-CD1 3.72Å; W34-I38 WeakPolarHBondContact O-CB 3.48Å; W34-I38 WeakPolarHBondContact O-CG1 3.44Å; W34-I38 PolarHBondContact O-N 2.58Å; W34-E186 WeakPolarHBondContact CH2-OE2 3.33Å; W34-E186 HydrophobicContact CZ3-CB 4.48Å; W34-E186 HydrophobicContact CZ3-CG 4.31Å; W34-E186 VanDerWaalsContact CZ3-OE1 3.28Å; W34-E186 WeakPolarHBondContact CZ3-OE1 3.49Å; W34-E186 WeakPolarHBondContact CZ3-OE2 3.43Å
35	R	64.1	Low	56.5	Low	85 Å²	85	88.7 Å²	88.7	32%	0.321	41%	0.413	S	S	.	.	H	α-helix	trans	-60.3	-48	176.4	-78.3	175.9	153.8	164.1	-10.5	112.8	K31 R32 N33 R37 R39	K31-R35 WeakPolarHBondContact O-CG 3.31Å; K31-R35 PolarHBondContact O-N 3.14Å; R32-R35 PolarHBondContact O-N 3.43Å; N33-R35 VanDerWaalsContact C-N 3.27Å; N33-R35 PolarHBondContact O-N 3.11Å; R35-R37 VanDerWaalsContact C-N 3.26Å; R35-R37 PolarHBondContact O-N 2.88Å; R35-R39 WeakPolarHBondContact O-CB 3.35Å; R35-R39 PolarHBondContact O-N 2.96Å
36	T	67.2	Low	56.5	Low	85 Å²	85	88.5 Å²	88.5	52%	0.521	42%	0.419	S	S	.	.	H	α-helix	trans	-63.6	-37	175.8	-58.6	0	0	0	0	110.7	R32 N33 W34 Y40	R32-T36 PolarHBondContact O-N 2.88Å; N33-T36 PolarHBondContact O-N 3.47Å; W34-T36 PolarHBondContact O-N 3.22Å; T36-Y40 VanDerWaalsContact O-CB 3.24Å; T36-Y40 WeakPolarHBondContact O-CB 3.34Å; T36-Y40 PolarHBondContact O-N 3.31Å
37	R	67.4	Low	56.2	Low	59 Å²	59	88.7 Å²	88.7	22%	0.223	43%	0.425	C	S	.	.	H	α-helix	trans	-75.2	-35.5	179.8	-64.2	178.4	93.6	170.8	18.9	114	N33 W34 R35 Y40 L41 I88	N33-R37 VanDerWaalsContact O-CG 3.32Å; N33-R37 WeakPolarHBondContact O-CG 3.45Å; N33-R37 PolarHBondContact O-N 3.3Å; N33-R37 VanDerWaalsContact O-N 3.13Å; N33-R37 VanDerWaalsContact OD1-CD 3.25Å; N33-R37 WeakPolarHBondContact OD1-CD 3.33Å; W34-R37 CarbonylContact O-C 3.15Å; W34-R37 PolarHBondContact O-N 3.49Å; W34-R37 VanDerWaalsContact O-N 3.14Å; R35-R37 VanDerWaalsContact C-N 3.26Å; R35-R37 PolarHBondContact O-N 2.88Å; R37-Y40 CarbonylContact O-C 3.6Å; R37-Y40 PolarHBondContact O-N 3.49Å; R37-L41 WeakPolarHBondContact O-CB 3.43Å; R37-L41 WeakPolarHBondContact O-CG 3.26Å; R37-L41 PolarHBondContact O-N 3.1Å; R37-I88 HydrophobicContact CB-CD1 4.07Å; R37-I88 HydrophobicContact CB-CG1 4.31Å; R37-I88 HydrophobicContact CB-CG2 3.85Å; R37-I88 PolarHBondContact NH1-O 3.23Å
38	I	65.4	Low	56	Low	5 Å²	5	89.3 Å²	89.3	3%	0.026	43%	0.428	C	S	.	.	H	α-helix	trans	-65	-47.9	170.4	-69	178.5	0	0	0	108.9	W34 Y40 L41 L42 L183 E186	W34-I38 HydrophobicContact CD2-CD1 4.38Å; W34-I38 HydrophobicContact CE3-CD1 3.33Å; W34-I38 HydrophobicContact CE3-CG1 4.13Å; W34-I38 HydrophobicContact CZ3-CD1 3.72Å; W34-I38 WeakPolarHBondContact O-CB 3.48Å; W34-I38 WeakPolarHBondContact O-CG1 3.44Å; W34-I38 PolarHBondContact O-N 2.58Å; I38-Y40 PolarHBondContact O-N 3.08Å; I38-L41 WeakPolarHBondContact O-CB 3.49Å; I38-L41 PolarHBondContact O-N 3.49Å; I38-L41 VanDerWaalsContact O-N 3.12Å; I38-L42 HydrophobicContact CG2-CD1 3.8Å; I38-L42 HydrophobicContact CG2-CG 4.29Å; I38-L42 WeakPolarHBondContact O-CB 3.45Å; I38-L42 VanDerWaalsContact O-CG 3.26Å; I38-L42 WeakPolarHBondContact O-CG 3.44Å; I38-L42 PolarHBondContact O-N 3Å; I38-L183 HydrophobicContact CD1-CD1 3.31Å; I38-L183 HydrophobicContact CG1-CD1 3.33Å; I38-E186 HydrophobicContact CD1-CB 4.39Å; I38-E186 HydrophobicContact CD1-CG 4.25Å
39	R	65.8	Low	55.7	Low	154 Å²	154	93.6 Å²	93.6	58%	0.581	45%	0.454	S	S	*	.	H	α-helix	trans	-59	-40	176	-167.5	-174	-60.1	147.5	-0	110.9	R35 L42 K43	R35-R39 WeakPolarHBondContact O-CB 3.35Å; R35-R39 PolarHBondContact O-N 2.96Å; R39-L42 CarbonylContact O-C 3.31Å; R39-L42 PolarHBondContact O-N 3.5Å; R39-K43 WeakPolarHBondContact O-CB 3.49Å; R39-K43 PolarHBondContact O-N 3.29Å
40	Y	60.8	Low	55.1	Low	142 Å²	142	94 Å²	94	56%	0.557	47%	0.466	S	S	*	.	H	α-helix	trans	-67.3	-42.9	173.9	-171.8	-121.4	0	0	0	111.7	T36 R37 I38 L42 K43 I44	T36-Y40 VanDerWaalsContact O-CB 3.24Å; T36-Y40 WeakPolarHBondContact O-CB 3.34Å; T36-Y40 PolarHBondContact O-N 3.31Å; R37-Y40 CarbonylContact O-C 3.6Å; R37-Y40 PolarHBondContact O-N 3.49Å; I38-Y40 PolarHBondContact O-N 3.08Å; Y40-L42 VanDerWaalsContact C-N 3.25Å; Y40-L42 PolarHBondContact O-N 3.3Å; Y40-K43 CarbonylContact O-C 3.47Å; Y40-K43 WeakPolarHBondContact O-CA 3.48Å; Y40-K43 PolarHBondContact O-N 3.32Å; Y40-I44 HydrophobicContact CD1-CD1 3.2Å; Y40-I44 HydrophobicContact CD1-CG1 3.56Å; Y40-I44 HydrophobicContact CD2-CD1 4.22Å; Y40-I44 HydrophobicContact CD2-CG1 3.58Å; Y40-I44 HydrophobicContact CE1-CD1 2.95Å; Y40-I44 HydrophobicContact CE1-CG1 3.3Å; Y40-I44 HydrophobicContact CE2-CD1 4.02Å; Y40-I44 HydrophobicContact CE2-CG1 3.29Å; Y40-I44 HydrophobicContact CG-CD1 3.83Å; Y40-I44 HydrophobicContact CG-CG1 3.67Å; Y40-I44 WeakPolarHBondContact O-CB 3.49Å; Y40-I44 WeakPolarHBondContact O-CG1 3.44Å; Y40-I44 PolarHBondContact O-N 2.8Å
41	L	64.6	Low	54.3	Low	32 Å²	32	94 Å²	94	17%	0.168	48%	0.481	C	S	.	.	H	α-helix	trans	-55.4	-42	171.3	-81.7	174.2	0	0	0	112.4	R37 I38 K43 A84 I88	R37-L41 WeakPolarHBondContact O-CB 3.43Å; R37-L41 WeakPolarHBondContact O-CG 3.26Å; R37-L41 PolarHBondContact O-N 3.1Å; I38-L41 WeakPolarHBondContact O-CB 3.49Å; I38-L41 PolarHBondContact O-N 3.49Å; I38-L41 VanDerWaalsContact O-N 3.12Å; L41-K43 VanDerWaalsContact C-N 3.26Å; L41-K43 PolarHBondContact O-N 3.12Å; L41-A84 HydrophobicContact CD2-CB 3.64Å; L41-I88 HydrophobicContact CD1-CD1 3.26Å; L41-I88 HydrophobicContact CD2-CD1 3.5Å; L41-I88 HydrophobicContact CG-CD1 3.15Å
42	L	61.2	Low	53.4	Low	41 Å²	41	99.3 Å²	99.3	22%	0.215	50%	0.504	C	S	.	.	H	α-helix	trans	-73.8	-16.8	177.1	-63.9	172.1	0	0	0	112.5	I38 R39 Y40 T45 L198	I38-L42 HydrophobicContact CG2-CD1 3.8Å; I38-L42 HydrophobicContact CG2-CG 4.29Å; I38-L42 WeakPolarHBondContact O-CB 3.45Å; I38-L42 VanDerWaalsContact O-CG 3.26Å; I38-L42 WeakPolarHBondContact O-CG 3.44Å; I38-L42 PolarHBondContact O-N 3Å; R39-L42 CarbonylContact O-C 3.31Å; R39-L42 PolarHBondContact O-N 3.5Å; Y40-L42 VanDerWaalsContact C-N 3.25Å; Y40-L42 PolarHBondContact O-N 3.3Å; L42-T45 PolarHBondContact O-OG1 3.04Å; L42-L198 HydrophobicContact CD1-CD1 4.32Å; L42-L198 HydrophobicContact CD1-CD2 3.74Å
43	K	54.9	Low	52	Low	144 Å²	144	95.1 Å²	95.1	63%	0.626	50%	0.503	S	S	*	.	H	α-helix	trans	-111	-29.4	-174.4	-164.7	170.6	-174.9	178.2	0	115.4	R39 Y40 L41 T45 S46	R39-K43 WeakPolarHBondContact O-CB 3.49Å; R39-K43 PolarHBondContact O-N 3.29Å; Y40-K43 CarbonylContact O-C 3.47Å; Y40-K43 WeakPolarHBondContact O-CA 3.48Å; Y40-K43 PolarHBondContact O-N 3.32Å; L41-K43 VanDerWaalsContact C-N 3.26Å; L41-K43 PolarHBondContact O-N 3.12Å; K43-T45 PolarHBondContact O-N 2.69Å; K43-T45 VanDerWaalsContact O-N 3.14Å; K43-S46 WeakPolarHBondContact O-CB 3.42Å; K43-S46 PolarHBondContact O-N 2.97Å
44	I	47.3	Very low	50.5	Low	46 Å²	46	100.2 Å²	100.2	24%	0.236	53%	0.527	C	S	.	.	G	3₁₀ helix	trans	-55.8	-28.2	172.8	-70.5	168.3	0	0	0	110.9	Y40 S46 S47 F48	Y40-I44 HydrophobicContact CD1-CD1 3.2Å; Y40-I44 HydrophobicContact CD1-CG1 3.56Å; Y40-I44 HydrophobicContact CD2-CD1 4.22Å; Y40-I44 HydrophobicContact CD2-CG1 3.58Å; Y40-I44 HydrophobicContact CE1-CD1 2.95Å; Y40-I44 HydrophobicContact CE1-CG1 3.3Å; Y40-I44 HydrophobicContact CE2-CD1 4.02Å; Y40-I44 HydrophobicContact CE2-CG1 3.29Å; Y40-I44 HydrophobicContact CG-CD1 3.83Å; Y40-I44 HydrophobicContact CG-CG1 3.67Å; Y40-I44 WeakPolarHBondContact O-CB 3.49Å; Y40-I44 WeakPolarHBondContact O-CG1 3.44Å; Y40-I44 PolarHBondContact O-N 2.8Å; I44-S46 PolarHBondContact O-N 3.43Å; I44-S47 PolarHBondContact O-N 3.23Å; I44-F48 HydrophobicContact CG2-CB 3.96Å; I44-F48 PolarHBondContact O-N 3.03Å
45	T	45.8	Very low	49.1	Very low	66 Å²	66	103.6 Å²	103.6	41%	0.405	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-56.1	-11	172.4	56.5	0	0	0	0	113.9	L42 K43 Y81	L42-T45 PolarHBondContact O-OG1 3.04Å; K43-T45 PolarHBondContact O-N 2.69Å; K43-T45 VanDerWaalsContact O-N 3.14Å; T45-Y81 HydrophobicContact CG2-CE1 4.25Å
46	S	38.8	Very low	47.7	Very low	94 Å²	94	103.5 Å²	103.5	66%	0.657	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-87.1	-23.9	172.6	118	0	0	0	0	114.7	K43 I44	K43-S46 WeakPolarHBondContact O-CB 3.42Å; K43-S46 PolarHBondContact O-N 2.97Å; I44-S46 PolarHBondContact O-N 3.43Å
47	S	35.8	Very low	46.2	Very low	94 Å²	94	110.6 Å²	110.6	66%	0.657	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.8	-11	-162.5	7.5	0	0	0	0	115.7	I44 S49	I44-S47 PolarHBondContact O-N 3.23Å; S47-S49 PolarHBondContact O-N 3.32Å
48	F	42.3	Very low	45.5	Very low	185 Å²	185	112.3 Å²	112.3	81%	0.811	62%	0.624	S	S	*	*			trans	-88.9	32	177	-135	-98.3	0	0	0	113.8	I44 S50	I44-F48 HydrophobicContact CG2-CB 3.96Å; I44-F48 PolarHBondContact O-N 3.03Å; F48-S50 PolarHBondContact O-N 3.31Å
49	S	40.1	Very low	45.2	Very low	113 Å²	113	117.3 Å²	117.3	79%	0.79	64%	0.643	S	S	*	*			trans	-79.3	91.1	174.1	-72.2	0	0	0	0	110	S47	S47-S49 PolarHBondContact O-N 3.32Å
50	S	39.8	Very low	45.4	Very low	113 Å²	113	114.3 Å²	114.3	79%	0.79	63%	0.632	S	S	*	*			trans	-119.9	117.7	151.3	-157	0	0	0	0	108.7	F48	F48-S50 PolarHBondContact O-N 3.31Å
51	S	37.7	Very low	46.3	Very low	116 Å²	116	108.1 Å²	108.1	81%	0.811	61%	0.609	S	S	*	*	S	Bend	trans	92.1	88.4	175.7	-48.7	0	0	0	0	118.4
52	K	36.4	Very low	47.3	Very low	200 Å²	200	110 Å²	110	87%	0.87	62%	0.622	S	S	*	*			trans	53.8	102.9	146.8	-94.3	175.4	177.8	175.7	0	121.4
53	C	28.8	Very low	48.4	Very low	109 Å²	109	110.4 Å²	110.4	74%	0.736	63%	0.626	S	S	*	*			trans	59.1	96.8	134.9	58	0	0	0	0	121.4
54	M	32.8	Very low	50	Low	195 Å²	195	108.6 Å²	108.6	96%	0.961	62%	0.62	S	S	*	*				-142.5	134.9	114.7	-84.1	-64.8	178.2	0	0	108.3
55	A	34.4	Very low	51.9	Low	98 Å²	98	107.7 Å²	107.7	81%	0.81	62%	0.615	S	S	*	*			trans	-68.3	138.7	-172.6	0	0	0	0	0	113.6	R57	A55-R57 PolarHBondContact O-N 3.3Å
56	G	34.3	Very low	54	Low	82 Å²	82	104.6 Å²	104.6	85%	0.845	60%	0.596	S	S	*	*	S	Bend		71.2	32.5	128.8	0	0	0	0	0	119.7
57	R	36.3	Very low	56.5	Low	235 Å²	235	103.3 Å²	103.3	89%	0.887	58%	0.582	S	S	*	*			trans	-130.3	125.1	163.4	-73	-174.4	173.6	176	-1.8	111	A55 Y59	A55-R57 PolarHBondContact O-N 3.3Å; R57-Y59 PolarHBondContact O-N 2.97Å
58	S	52.8	Low	59.2	Low	95 Å²	95	102.3 Å²	102.3	66%	0.664	57%	0.567	S	S	*	*			trans	-58.1	92.9	159.9	170	0	0	0	0	107.3	R60	S58-R60 PolarHBondContact O-N 2.9Å
59	Y	58.7	Low	61.7	Low	109 Å²	109	93.7 Å²	93.7	43%	0.427	53%	0.529	S	S	.	.			trans	-73.8	97.2	-179.6	-171	-85.1	0	0	0	108.4	R57 E65 Y81	R57-Y59 PolarHBondContact O-N 2.97Å; Y59-E65 PolarHBondContact OH-OE1 2.67Å; Y59-E65 PolarHBondContact OH-OE2 3.21Å; Y59-Y81 WeakPolarHBondContact CB-OH 3.34Å; Y59-Y81 AromaticContact CD1-CD2 3.82Å; Y59-Y81 HydrophobicContact CD1-CD2 3.82Å; Y59-Y81 AromaticContact CD1-CE2 3.16Å; Y59-Y81 HydrophobicContact CD1-CE2 3.16Å; Y59-Y81 AromaticContact CD1-CZ 3.61Å; Y59-Y81 AromaticContact CE1-CD2 3.98Å; Y59-Y81 HydrophobicContact CE1-CD2 3.98Å; Y59-Y81 AromaticContact CE1-CE2 3.69Å; Y59-Y81 HydrophobicContact CE1-CE2 3.69Å; Y59-Y81 HydrophobicContact CG-CE2 4.06Å
60	R	70.9	Confident	64.3	Low	91 Å²	91	90.4 Å²	90.4	34%	0.343	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-83.9	126.4	167.7	-169.8	-172.9	-158.9	170.5	8.7	106.5	S58 T62 V190	S58-R60 PolarHBondContact O-N 2.9Å; R60-T62 PolarHBondContact O-N 2.87Å; R60-V190 HydrophobicContact CG-CG1 4.39Å; R60-V190 PolarHBondContact NE-O 3.34Å; R60-V190 VanDerWaalsContact NE-O 3.13Å; R60-V190 PolarHBondContact NH1-O 2.94Å; R60-V190 VanDerWaalsContact NH2-CA 3.3Å; R60-V190 PolarHBondContact NH2-O 3.47Å
61	P	78.7	Confident	67	Low	12 Å²	12	90.6 Å²	90.6	8%	0.078	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-57.8	135.8	174.7	23.3	-31.1	0	0	0	109.5	E65 V66 W69	P61-E65 VanDerWaalsContact CA-OE2 3.3Å; P61-E65 WeakPolarHBondContact CA-OE2 3.44Å; P61-E65 HydrophobicContact CB-CB 4.46Å; P61-V66 HydrophobicContact CB-CG2 3.96Å; P61-V66 HydrophobicContact CG-CG2 4.11Å; P61-W69 HydrophobicContact CB-CH2 4.01Å; P61-W69 HydrophobicContact CB-CZ2 3.9Å; P61-W69 HydrophobicContact CG-CH2 3.87Å; P61-W69 HydrophobicContact CG-CZ2 4.28Å
62	T	84.8	Confident	69.8	Low	72 Å²	72	86.4 Å²	86.4	44%	0.442	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-68.4	161.6	178.4	62.9	0	0	0	0	110.7	R60 E64 E65 V66	R60-T62 PolarHBondContact O-N 2.87Å; T62-E64 PolarHBondContact O-N 3.34Å; T62-E65 PolarHBondContact N-OE2 3.46Å; T62-E65 PolarHBondContact O-N 3.43Å; T62-E65 VanDerWaalsContact OG1-CG 3.28Å; T62-E65 WeakPolarHBondContact OG1-CG 3.37Å; T62-E65 PolarHBondContact OG1-N 3.08Å; T62-E65 PolarHBondContact OG1-OE2 3.18Å; T62-E65 VanDerWaalsContact OG1-OE2 3.05Å; T62-V66 WeakPolarHBondContact O-CG2 3.36Å; T62-V66 PolarHBondContact O-N 3.27Å
63	V	86.2	Confident	72.7	Confident	50 Å²	50	76.9 Å²	76.9	30%	0.303	43%	0.426	S	S	.	.	H	α-helix	trans	-55.7	-41.1	175.4	178.1	0	0	0	0	111	V66 N67 A191 R192	V63-V66 PolarHBondContact O-N 3.23Å; V63-N67 WeakPolarHBondContact O-CB 3.36Å; V63-N67 PolarHBondContact O-N 2.71Å; V63-N67 PolarHBondContact O-ND2 3.26Å; V63-A191 VanDerWaalsContact CG2-C 3.41Å; V63-A191 HydrophobicContact CG2-CB 3.96Å; V63-A191 WeakPolarHBondContact CG2-O 3.32Å; V63-R192 HydrophobicContact CG1-CG 4.22Å; V63-R192 HydrophobicContact CG2-CB 4.4Å; V63-R192 HydrophobicContact CG2-CG 3.76Å
64	E	87.5	Confident	76	Confident	105 Å²	105	76 Å²	76	49%	0.491	41%	0.414	S	S	.	.	H	α-helix	trans	-63.6	-46.1	179.9	-177	53.3	-148.8	0	0	111.8	T62 V66 N67 Q68	T62-E64 PolarHBondContact O-N 3.34Å; E64-V66 PolarHBondContact O-N 2.95Å; E64-N67 PolarHBondContact O-N 3.46Å; E64-Q68 VanDerWaalsContact O-CG 3.32Å; E64-Q68 WeakPolarHBondContact O-CG 3.37Å; E64-Q68 PolarHBondContact O-N 3Å; E64-Q68 PolarHBondContact OE1-NE2 3.04Å
65	E	88	Confident	79	Confident	28 Å²	28	70.7 Å²	70.7	13%	0.131	39%	0.385	C	S	.	.	H	α-helix	trans	-61.6	-44.3	176.8	-71.6	167.5	139.3	0	0	111.9	Y59 P61 T62 N67 Q68 W69 H79	Y59-E65 PolarHBondContact OH-OE1 2.67Å; Y59-E65 PolarHBondContact OH-OE2 3.21Å; P61-E65 VanDerWaalsContact CA-OE2 3.3Å; P61-E65 WeakPolarHBondContact CA-OE2 3.44Å; P61-E65 HydrophobicContact CB-CB 4.46Å; T62-E65 PolarHBondContact N-OE2 3.46Å; T62-E65 PolarHBondContact O-N 3.43Å; T62-E65 VanDerWaalsContact OG1-CG 3.28Å; T62-E65 WeakPolarHBondContact OG1-CG 3.37Å; T62-E65 PolarHBondContact OG1-N 3.08Å; T62-E65 PolarHBondContact OG1-OE2 3.18Å; T62-E65 VanDerWaalsContact OG1-OE2 3.05Å; E65-N67 VanDerWaalsContact C-N 3.31Å; E65-N67 PolarHBondContact O-N 3.15Å; E65-Q68 WeakPolarHBondContact O-CB 3.36Å; E65-Q68 PolarHBondContact O-N 3.28Å; E65-W69 PolarHBondContact O-N 3.42Å; E65-W69 PolarHBondContact O-NE1 3.27Å; E65-W69 VanDerWaalsContact O-NE1 3.13Å; E65-H79 IonicContact OE1-CD2 3.38Å; E65-H79 IonicContact OE1-CE1 3.04Å; E65-H79 IonicContact OE1-NE2 3.98Å; E65-H79 PolarHBondContact OE1-NE2 2.91Å; E65-H79 VanDerWaalsContact OE1-NE2 3.11Å
66	V	89.5	Confident	81.9	Confident	1 Å²	1	66 Å²	66	1%	0.006	35%	0.347	C	S	.	.	H	α-helix	trans	-64	-40.3	178.3	179.7	0	0	0	0	110.5	P61 T62 V63 E64 Q68 W69 Y184 C188 A191	P61-V66 HydrophobicContact CB-CG2 3.96Å; P61-V66 HydrophobicContact CG-CG2 4.11Å; T62-V66 WeakPolarHBondContact O-CG2 3.36Å; T62-V66 PolarHBondContact O-N 3.27Å; V63-V66 PolarHBondContact O-N 3.23Å; E64-V66 PolarHBondContact O-N 2.95Å; V66-Q68 VanDerWaalsContact C-N 3.32Å; V66-Q68 PolarHBondContact O-N 3Å; V66-W69 HydrophobicContact CG1-CE3 4.33Å; V66-W69 HydrophobicContact CG2-CH2 4.11Å; V66-W69 HydrophobicContact CG2-CZ2 4.41Å; V66-W69 HydrophobicContact CG2-CZ3 4.17Å; V66-W69 WeakPolarHBondContact O-CB 3.47Å; V66-W69 PolarHBondContact O-N 2.97Å; V66-Y184 HydrophobicContact CG1-CE2 3.73Å; V66-Y184 PolarHBondContact O-OH 3.19Å; V66-C188 HydrophobicContact CG1-CB 4.34Å; V66-C188 WeakPolarHBondContact CG1-SG 3.39Å; V66-A191 HydrophobicContact CB-CB 4.47Å; V66-A191 HydrophobicContact CG2-CB 3.94Å
67	N	90.8	Very high	84.8	Confident	67 Å²	67	62.2 Å²	62.2	36%	0.358	31%	0.307	S	S	.	.	H	α-helix	trans	-63.7	-36.9	176.1	-71.7	-18.3	0	0	0	112.3	V63 E64 E65 W69 A70	V63-N67 WeakPolarHBondContact O-CB 3.36Å; V63-N67 PolarHBondContact O-N 2.71Å; V63-N67 PolarHBondContact O-ND2 3.26Å; E64-N67 PolarHBondContact O-N 3.46Å; E65-N67 VanDerWaalsContact C-N 3.31Å; E65-N67 PolarHBondContact O-N 3.15Å; N67-W69 PolarHBondContact O-N 3.09Å; N67-A70 PolarHBondContact O-N 3.36Å
68	Q	93.6	Very high	87.5	Confident	73 Å²	73	55.9 Å²	55.9	34%	0.341	30%	0.299	S	S	.	.	H	α-helix	trans	-63.4	-30.6	176.6	-73.7	174.1	7.9	0	0	112.5	E64 E65 V66 A70 Q71 K75	E64-Q68 VanDerWaalsContact O-CG 3.32Å; E64-Q68 WeakPolarHBondContact O-CG 3.37Å; E64-Q68 PolarHBondContact O-N 3Å; E64-Q68 PolarHBondContact OE1-NE2 3.04Å; E65-Q68 WeakPolarHBondContact O-CB 3.36Å; E65-Q68 PolarHBondContact O-N 3.28Å; V66-Q68 VanDerWaalsContact C-N 3.32Å; V66-Q68 PolarHBondContact O-N 3Å; Q68-A70 PolarHBondContact O-N 3.03Å; Q68-Q71 WeakPolarHBondContact O-CB 3.45Å; Q68-Q71 PolarHBondContact O-N 3.19Å; Q68-Q71 VanDerWaalsContact O-N 3.09Å; Q68-K75 HydrophobicContact CB-CD 4.44Å; Q68-K75 WeakPolarHBondContact O-CB 3.43Å
69	W	94.8	Very high	89.4	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.015	28%	0.275	C	S	.	.	H	α-helix	trans	-63.2	-26.9	176.8	-60.2	-6.4	0	0	0	113.2	P61 E65 V66 N67 Q71 L76 H79 A85 Y175 Y184 L187	P61-W69 HydrophobicContact CB-CH2 4.01Å; P61-W69 HydrophobicContact CB-CZ2 3.9Å; P61-W69 HydrophobicContact CG-CH2 3.87Å; P61-W69 HydrophobicContact CG-CZ2 4.28Å; E65-W69 PolarHBondContact O-N 3.42Å; E65-W69 PolarHBondContact O-NE1 3.27Å; E65-W69 VanDerWaalsContact O-NE1 3.13Å; V66-W69 HydrophobicContact CG1-CE3 4.33Å; V66-W69 HydrophobicContact CG2-CH2 4.11Å; V66-W69 HydrophobicContact CG2-CZ2 4.41Å; V66-W69 HydrophobicContact CG2-CZ3 4.17Å; V66-W69 WeakPolarHBondContact O-CB 3.47Å; V66-W69 PolarHBondContact O-N 2.97Å; N67-W69 PolarHBondContact O-N 3.09Å; W69-Q71 VanDerWaalsContact C-N 3.3Å; W69-L76 HydrophobicContact CB-CB 4.23Å; W69-L76 HydrophobicContact CB-CD1 3.65Å; W69-L76 HydrophobicContact CD2-CD1 3.79Å; W69-L76 HydrophobicContact CE3-CD1 3.96Å; W69-L76 HydrophobicContact CG-CD1 3.63Å; W69-H79 AromaticContact CE2-ND1 3.67Å; W69-H79 AromaticContact CZ2-CE1 3.85Å; W69-H79 AromaticContact CZ2-ND1 3.35Å; W69-H79 WeakPolarHBondContact CZ2-ND1 3.41Å; W69-H79 AromaticContact NE1-CG 3.54Å; W69-H79 AromaticContact NE1-ND1 3.45Å; W69-H79 PolarHBondContact NE1-ND1 2.9Å; W69-A85 HydrophobicContact CZ3-CB 4.34Å; W69-Y175 WeakPolarHBondContact O-CE2 3.44Å; W69-Y175 PolarHBondContact O-OH 3.14Å; W69-Y184 HydrophobicContact CB-CE2 4.15Å; W69-Y184 HydrophobicContact CE3-CD2 4.44Å; W69-Y184 HydrophobicContact CE3-CE2 4.05Å; W69-L187 HydrophobicContact CZ3-CD1 4.3Å
70	A	94.6	Very high	90.8	Very high	44 Å²	44	56.1 Å²	56.1	36%	0.364	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-7.9	176.3	0	0	0	0	0	113.9	N67 Q68 Y175 I179 Y184	N67-A70 PolarHBondContact O-N 3.36Å; Q68-A70 PolarHBondContact O-N 3.03Å; A70-Y175 WeakPolarHBondContact CA-OH 3.45Å; A70-Y175 PolarHBondContact O-OH 3.35Å; A70-I179 HydrophobicContact CB-CD1 4.1Å; A70-I179 HydrophobicContact CB-CG2 3.91Å; A70-Y184 HydrophobicContact CB-CE1 4.35Å; A70-Y184 WeakPolarHBondContact CB-OH 3.34Å
71	Q	95.4	Very high	91.6	Very high	116 Å²	116	54.7 Å²	54.7	54%	0.542	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-34.9	-177.1	-63.4	179.4	19.6	0	0	112.8	Q68 W69 K75	Q68-Q71 WeakPolarHBondContact O-CB 3.45Å; Q68-Q71 PolarHBondContact O-N 3.19Å; Q68-Q71 VanDerWaalsContact O-N 3.09Å; W69-Q71 VanDerWaalsContact C-N 3.3Å; Q71-K75 HydrophobicContact CB-CD 3.98Å
72	S	97.1	Very high	92.3	Very high	28 Å²	28	54.1 Å²	54.1	20%	0.196	28%	0.282	C	S	.	.			trans	-162.1	158.7	171.1	69.8	0	0	0	0	112.2	D74 K75 L76 Y175	S72-D74 VanDerWaalsContact C-N 3.27Å; S72-D74 PolarHBondContact O-N 3.35Å; S72-K75 PolarHBondContact O-N 3.15Å; S72-K75 WeakPolarHBondContact OG-CG 3.4Å; S72-K75 PolarHBondContact OG-N 3.12Å; S72-L76 PolarHBondContact O-N 3.33Å; S72-L76 VanDerWaalsContact O-N 3.17Å; S72-Y175 WeakPolarHBondContact CA-OH 3.48Å; S72-Y175 PolarHBondContact N-OH 2.87Å; S72-Y175 PolarHBondContact O-OH 3.17Å
73	L	97.4	Very high	92.7	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-37.5	172.8	-179.1	59.8	0	0	0	111	K75 L76 L77 F86 F167 M170 E171 Y175	L73-K75 VanDerWaalsContact C-N 3.33Å; L73-K75 PolarHBondContact O-N 2.94Å; L73-L76 HydrophobicContact CD1-CD2 3.94Å; L73-L76 WeakPolarHBondContact O-CB 3.39Å; L73-L76 PolarHBondContact O-N 3.06Å; L73-L76 VanDerWaalsContact O-N 3.14Å; L73-L77 HydrophobicContact CD1-CD1 3.97Å; L73-L77 HydrophobicContact CD1-CD2 3.98Å; L73-L77 HydrophobicContact CD1-CG 3.71Å; L73-L77 HydrophobicContact CD2-CD1 4.31Å; L73-L77 HydrophobicContact CG-CD1 3.86Å; L73-L77 HydrophobicContact CG-CG 3.98Å; L73-L77 VanDerWaalsContact O-CG 3.32Å; L73-L77 WeakPolarHBondContact O-CG 3.42Å; L73-L77 PolarHBondContact O-N 3.03Å; L73-F86 HydrophobicContact CD1-CD1 4.3Å; L73-F86 HydrophobicContact CD1-CE1 3.86Å; L73-F86 HydrophobicContact CD1-CZ 4.22Å; L73-F167 HydrophobicContact CB-CE2 4.05Å; L73-F167 HydrophobicContact CB-CZ 3.77Å; L73-F167 HydrophobicContact CD2-CD1 4.47Å; L73-F167 HydrophobicContact CD2-CD2 3.82Å; L73-F167 HydrophobicContact CD2-CE1 4.29Å; L73-F167 HydrophobicContact CD2-CE2 3.65Å; L73-F167 HydrophobicContact CD2-CG 4.25Å; L73-F167 HydrophobicContact CD2-CZ 3.9Å; L73-F167 HydrophobicContact CG-CD2 4.27Å; L73-F167 HydrophobicContact CG-CE2 3.64Å; L73-F167 HydrophobicContact CG-CZ 3.89Å; L73-M170 HydrophobicContact CD2-CB 3.86Å; L73-E171 HydrophobicContact CB-CB 4.4Å; L73-E171 HydrophobicContact CB-CG 4.31Å; L73-E171 HydrophobicContact CD2-CB 3.8Å; L73-Y175 HydrophobicContact CB-CD1 4.29Å; L73-Y175 HydrophobicContact CB-CD2 4.26Å; L73-Y175 HydrophobicContact CB-CE2 4.48Å; L73-Y175 HydrophobicContact CB-CG 4.15Å; L73-Y175 HydrophobicContact CD1-CD2 3.8Å; L73-Y175 HydrophobicContact CD1-CE2 4.47Å; L73-Y175 HydrophobicContact CD1-CG 4.13Å
74	D	96.8	Very high	93	Very high	91 Å²	91	52.2 Å²	52.2	49%	0.487	27%	0.268	S	S	.	.	H	α-helix	trans	-55.9	-44.7	175.1	-68.4	-75.3	0	0	0	112.8	S72 L76 L77 S78 F167	S72-D74 VanDerWaalsContact C-N 3.27Å; S72-D74 PolarHBondContact O-N 3.35Å; D74-L76 VanDerWaalsContact C-N 3.34Å; D74-L77 PolarHBondContact O-N 3.19Å; D74-S78 WeakPolarHBondContact O-CB 3.13Å; D74-S78 PolarHBondContact O-N 2.96Å; D74-S78 PolarHBondContact O-OG 3.37Å; D74-F167 WeakPolarHBondContact OD2-CZ 3.35Å
75	K	95.9	Very high	93.2	Very high	84 Å²	84	47.2 Å²	47.2	37%	0.365	25%	0.245	S	C	.	.	H	α-helix	trans	-68	-35.3	178.4	-72.4	-178.1	-177.2	-167.1	0	112.2	Q68 Q71 S72 L73 S78	Q68-K75 HydrophobicContact CB-CD 4.44Å; Q68-K75 WeakPolarHBondContact O-CB 3.43Å; Q71-K75 HydrophobicContact CB-CD 3.98Å; S72-K75 PolarHBondContact O-N 3.15Å; S72-K75 WeakPolarHBondContact OG-CG 3.4Å; S72-K75 PolarHBondContact OG-N 3.12Å; L73-K75 VanDerWaalsContact C-N 3.33Å; L73-K75 PolarHBondContact O-N 2.94Å; K75-S78 PolarHBondContact O-OG 3.36Å; K75-S78 VanDerWaalsContact O-OG 3.1Å
76	L	96.3	Very high	93.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.8	-44.9	173.3	176.4	68.2	0	0	0	111.5	W69 S72 L73 D74 G82 K83 F86 Y175 F178	W69-L76 HydrophobicContact CB-CB 4.23Å; W69-L76 HydrophobicContact CB-CD1 3.65Å; W69-L76 HydrophobicContact CD2-CD1 3.79Å; W69-L76 HydrophobicContact CE3-CD1 3.96Å; W69-L76 HydrophobicContact CG-CD1 3.63Å; S72-L76 PolarHBondContact O-N 3.33Å; S72-L76 VanDerWaalsContact O-N 3.17Å; L73-L76 HydrophobicContact CD1-CD2 3.94Å; L73-L76 WeakPolarHBondContact O-CB 3.39Å; L73-L76 PolarHBondContact O-N 3.06Å; L73-L76 VanDerWaalsContact O-N 3.14Å; D74-L76 VanDerWaalsContact C-N 3.34Å; L76-G82 VanDerWaalsContact CD1-C 3.48Å; L76-G82 VanDerWaalsContact CD1-CA 3.4Å; L76-G82 WeakPolarHBondContact CD1-O 3.25Å; L76-G82 CarbonylContact O-C 3.44Å; L76-G82 WeakPolarHBondContact O-CA 3.32Å; L76-K83 PolarHBondContact O-N 2.92Å; L76-F86 HydrophobicContact CD2-CB 3.84Å; L76-F86 HydrophobicContact CD2-CD1 4.22Å; L76-F86 HydrophobicContact CD2-CD2 3.88Å; L76-F86 HydrophobicContact CD2-CG 3.72Å; L76-F86 HydrophobicContact CG-CB 4.35Å; L76-Y175 HydrophobicContact CB-CE2 4.27Å; L76-Y175 HydrophobicContact CD2-CD2 3.66Å; L76-Y175 HydrophobicContact CD2-CE2 3.74Å; L76-F178 HydrophobicContact CD1-CE1 3.69Å; L76-F178 HydrophobicContact CD1-CZ 4.23Å; L76-F178 HydrophobicContact CD2-CD1 3.82Å; L76-F178 HydrophobicContact CD2-CE1 3.75Å; L76-F178 HydrophobicContact CG-CE1 4.43Å
77	L	95.8	Very high	93.9	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-80.3	-24.7	-174.4	-62.9	-170.1	0	0	0	113.9	L73 D74 H79 K83 F86 I99 W102 F167 M170	L73-L77 HydrophobicContact CD1-CD1 3.97Å; L73-L77 HydrophobicContact CD1-CD2 3.98Å; L73-L77 HydrophobicContact CD1-CG 3.71Å; L73-L77 HydrophobicContact CD2-CD1 4.31Å; L73-L77 HydrophobicContact CG-CD1 3.86Å; L73-L77 HydrophobicContact CG-CG 3.98Å; L73-L77 VanDerWaalsContact O-CG 3.32Å; L73-L77 WeakPolarHBondContact O-CG 3.42Å; L73-L77 PolarHBondContact O-N 3.03Å; D74-L77 PolarHBondContact O-N 3.19Å; L77-H79 VanDerWaalsContact C-N 3.26Å; L77-K83 HydrophobicContact CD2-CG 4.37Å; L77-K83 WeakPolarHBondContact O-CE 3.14Å; L77-F86 HydrophobicContact CD2-CD1 3.94Å; L77-I99 HydrophobicContact CD1-CD1 4.08Å; L77-I99 HydrophobicContact CD2-CD1 3.52Å; L77-I99 HydrophobicContact CG-CD1 4.44Å; L77-W102 HydrophobicContact CB-CH2 3.7Å; L77-W102 HydrophobicContact CB-CZ2 4.27Å; L77-W102 HydrophobicContact CB-CZ3 3.97Å; L77-W102 HydrophobicContact CD1-CD2 3.9Å; L77-W102 HydrophobicContact CD1-CE3 3.95Å; L77-W102 HydrophobicContact CD1-CH2 3.9Å; L77-W102 HydrophobicContact CD1-CZ2 3.83Å; L77-W102 HydrophobicContact CD1-CZ3 3.95Å; L77-W102 HydrophobicContact CG-CH2 4.43Å; L77-W102 HydrophobicContact CG-CZ3 4.47Å; L77-F167 HydrophobicContact CD1-CD2 4.11Å; L77-F167 HydrophobicContact CD1-CE2 4.05Å; L77-M170 HydrophobicContact CD1-CE 4.49Å
78	S	92.5	Very high	94	Very high	102 Å²	102	46.3 Å²	46.3	71%	0.713	24%	0.239	S	C	*	.	H	α-helix	trans	-69.6	-27.4	173	68.8	0	0	0	0	112.1	D74 K75	D74-S78 WeakPolarHBondContact O-CB 3.13Å; D74-S78 PolarHBondContact O-N 2.96Å; D74-S78 PolarHBondContact O-OG 3.37Å; K75-S78 PolarHBondContact O-OG 3.36Å; K75-S78 VanDerWaalsContact O-OG 3.1Å
79	H	91.4	Very high	94	Very high	36 Å²	36	43.4 Å²	43.4	17%	0.167	23%	0.226	C	C	.	.	S	Bend	trans	-91	123.4	179.7	-164.3	-97.7	0	0	0	111.9	E65 W69 L77 Y81 G82 K83	E65-H79 IonicContact OE1-CD2 3.38Å; E65-H79 IonicContact OE1-CE1 3.04Å; E65-H79 IonicContact OE1-NE2 3.98Å; E65-H79 PolarHBondContact OE1-NE2 2.91Å; E65-H79 VanDerWaalsContact OE1-NE2 3.11Å; W69-H79 AromaticContact CE2-ND1 3.67Å; W69-H79 AromaticContact CZ2-CE1 3.85Å; W69-H79 AromaticContact CZ2-ND1 3.35Å; W69-H79 WeakPolarHBondContact CZ2-ND1 3.41Å; W69-H79 AromaticContact NE1-CG 3.54Å; W69-H79 AromaticContact NE1-ND1 3.45Å; W69-H79 PolarHBondContact NE1-ND1 2.9Å; L77-H79 VanDerWaalsContact C-N 3.26Å; H79-Y81 VanDerWaalsContact C-N 3.28Å; H79-Y81 AromaticContact CE1-CD2 3.51Å; H79-Y81 PolarHBondContact ND1-N 3.22Å; H79-Y81 PolarHBondContact O-N 3.19Å; H79-G82 PolarHBondContact O-N 3.35Å; H79-K83 PolarHBondContact O-N 3.02Å
80	K	88.8	Confident	94.1	Very high	172 Å²	172	43.2 Å²	43.2	75%	0.748	23%	0.225	S	C	*	.	H	α-helix	trans	-53.1	-42.7	-177	-176	178.3	178.6	180	0	113.2	A84	K80-A84 PolarHBondContact O-N 3.16Å
81	Y	88.6	Confident	94	Very high	62 Å²	62	44.4 Å²	44.4	24%	0.243	22%	0.222	C	C	.	.	H	α-helix	trans	-74	-33.6	179	-66.1	-87.5	0	0	0	112.7	T45 Y59 H79 A84 A85	T45-Y81 HydrophobicContact CG2-CE1 4.25Å; Y59-Y81 WeakPolarHBondContact CB-OH 3.34Å; Y59-Y81 AromaticContact CD1-CD2 3.82Å; Y59-Y81 HydrophobicContact CD1-CD2 3.82Å; Y59-Y81 AromaticContact CD1-CE2 3.16Å; Y59-Y81 HydrophobicContact CD1-CE2 3.16Å; Y59-Y81 AromaticContact CD1-CZ 3.61Å; Y59-Y81 AromaticContact CE1-CD2 3.98Å; Y59-Y81 HydrophobicContact CE1-CD2 3.98Å; Y59-Y81 AromaticContact CE1-CE2 3.69Å; Y59-Y81 HydrophobicContact CE1-CE2 3.69Å; Y59-Y81 HydrophobicContact CG-CE2 4.06Å; H79-Y81 VanDerWaalsContact C-N 3.28Å; H79-Y81 AromaticContact CE1-CD2 3.51Å; H79-Y81 PolarHBondContact ND1-N 3.22Å; H79-Y81 PolarHBondContact O-N 3.19Å; Y81-A84 PolarHBondContact O-N 2.95Å; Y81-A85 WeakPolarHBondContact O-CB 3.37Å; Y81-A85 PolarHBondContact O-N 3.44Å
82	G	92.6	Very high	93.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64	-50.8	177.2	0	0	0	0	0	110.3	L76 H79 A84 A85 F86	L76-G82 VanDerWaalsContact CD1-C 3.48Å; L76-G82 VanDerWaalsContact CD1-CA 3.4Å; L76-G82 WeakPolarHBondContact CD1-O 3.25Å; L76-G82 CarbonylContact O-C 3.44Å; L76-G82 WeakPolarHBondContact O-CA 3.32Å; H79-G82 PolarHBondContact O-N 3.35Å; G82-A84 VanDerWaalsContact C-N 3.32Å; G82-A84 PolarHBondContact O-N 3.14Å; G82-A85 PolarHBondContact O-N 3.08Å; G82-F86 WeakPolarHBondContact O-CB 3.41Å; G82-F86 PolarHBondContact O-N 3.34Å
83	K	93.9	Very high	93.5	Very high	54 Å²	54	42.1 Å²	42.1	24%	0.235	21%	0.212	C	C	.	.	H	α-helix	trans	-53.8	-45.5	173.9	-170	-179.4	-59.6	-175.8	0	112.6	L76 L77 H79 F86 Q87 I99	L76-K83 PolarHBondContact O-N 2.92Å; L77-K83 HydrophobicContact CD2-CG 4.37Å; L77-K83 WeakPolarHBondContact O-CE 3.14Å; H79-K83 PolarHBondContact O-N 3.02Å; K83-F86 PolarHBondContact O-N 3.41Å; K83-Q87 WeakPolarHBondContact O-CB 2.83Å; K83-Q87 PolarHBondContact O-N 3.49Å; K83-I99 HydrophobicContact CG-CD1 4.36Å; K83-I99 HydrophobicContact CG-CG1 4.39Å
84	A	91.6	Very high	93.3	Very high	27 Å²	27	50.6 Å²	50.6	22%	0.223	25%	0.25	C	C	.	.	H	α-helix	trans	-67.2	-41	-179.7	0	0	0	0	0	112.9	L41 K80 Y81 G82 F86 Q87 I88	L41-A84 HydrophobicContact CD2-CB 3.64Å; K80-A84 PolarHBondContact O-N 3.16Å; Y81-A84 PolarHBondContact O-N 2.95Å; G82-A84 VanDerWaalsContact C-N 3.32Å; G82-A84 PolarHBondContact O-N 3.14Å; A84-F86 VanDerWaalsContact C-N 3.35Å; A84-Q87 PolarHBondContact O-N 3.3Å; A84-I88 PolarHBondContact O-N 3.13Å; A84-I88 VanDerWaalsContact O-N 3.14Å
85	A	92.4	Very high	93.2	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-62.4	-43.4	173.7	0	0	0	0	0	111.5	W69 Y81 G82 I88 F89 F178 L187	W69-A85 HydrophobicContact CZ3-CB 4.34Å; Y81-A85 WeakPolarHBondContact O-CB 3.37Å; Y81-A85 PolarHBondContact O-N 3.44Å; G82-A85 PolarHBondContact O-N 3.08Å; A85-I88 PolarHBondContact O-N 3.5Å; A85-F89 PolarHBondContact O-N 3.4Å; A85-F178 HydrophobicContact CB-CE2 4.23Å; A85-F178 HydrophobicContact CB-CZ 4.04Å; A85-L187 HydrophobicContact CB-CD1 3.71Å
86	F	96.2	Very high	93.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.9	-42.2	177.4	-167.2	-129.8	0	0	0	112.2	L73 L76 L77 G82 K83 A84 I88 F89 L90 I99 M170 F178	L73-F86 HydrophobicContact CD1-CD1 4.3Å; L73-F86 HydrophobicContact CD1-CE1 3.86Å; L73-F86 HydrophobicContact CD1-CZ 4.22Å; L76-F86 HydrophobicContact CD2-CB 3.84Å; L76-F86 HydrophobicContact CD2-CD1 4.22Å; L76-F86 HydrophobicContact CD2-CD2 3.88Å; L76-F86 HydrophobicContact CD2-CG 3.72Å; L76-F86 HydrophobicContact CG-CB 4.35Å; L77-F86 HydrophobicContact CD2-CD1 3.94Å; G82-F86 WeakPolarHBondContact O-CB 3.41Å; G82-F86 PolarHBondContact O-N 3.34Å; K83-F86 PolarHBondContact O-N 3.41Å; A84-F86 VanDerWaalsContact C-N 3.35Å; F86-I88 VanDerWaalsContact C-N 3.28Å; F86-I88 PolarHBondContact O-N 3.21Å; F86-F89 HydrophobicContact CD2-CD1 4.38Å; F86-F89 HydrophobicContact CE2-CD1 4.24Å; F86-F89 WeakPolarHBondContact O-CA 3.4Å; F86-F89 VanDerWaalsContact O-CB 3.3Å; F86-F89 WeakPolarHBondContact O-CB 3.31Å; F86-F89 PolarHBondContact O-N 3.09Å; F86-F89 VanDerWaalsContact O-N 3.1Å; F86-L90 HydrophobicContact CD1-CD1 3.84Å; F86-L90 HydrophobicContact CD1-CG 4.39Å; F86-L90 HydrophobicContact CD2-CG 4.47Å; F86-L90 HydrophobicContact CE1-CD1 3.64Å; F86-L90 HydrophobicContact CE1-CD2 4.37Å; F86-L90 HydrophobicContact CE1-CG 4.21Å; F86-L90 HydrophobicContact CE2-CD2 4.12Å; F86-L90 HydrophobicContact CE2-CG 4.27Å; F86-L90 HydrophobicContact CG-CD1 4.41Å; F86-L90 HydrophobicContact CZ-CD1 4.03Å; F86-L90 HydrophobicContact CZ-CD2 3.9Å; F86-L90 HydrophobicContact CZ-CG 4.14Å; F86-L90 WeakPolarHBondContact O-CG 3.24Å; F86-L90 PolarHBondContact O-N 2.76Å; F86-I99 HydrophobicContact CD1-CD1 4.46Å; F86-M170 HydrophobicContact CE1-CB 4.27Å; F86-M170 HydrophobicContact CE1-CG 4.45Å; F86-M170 HydrophobicContact CE1-SD 3.85Å; F86-M170 HydrophobicContact CZ-CB 4.26Å; F86-F178 HydrophobicContact CD2-CB 3.77Å; F86-F178 AromaticContact CD2-CD1 3.92Å; F86-F178 HydrophobicContact CD2-CD1 3.92Å; F86-F178 HydrophobicContact CD2-CD2 4.06Å; F86-F178 AromaticContact CD2-CG 3.63Å; F86-F178 HydrophobicContact CD2-CG 3.63Å; F86-F178 HydrophobicContact CE2-CB 3.75Å; F86-F178 HydrophobicContact CE2-CD1 4.5Å; F86-F178 HydrophobicContact CE2-CG 4.14Å
87	Q	94.9	Very high	93.3	Very high	59 Å²	59	46.8 Å²	46.8	28%	0.276	23%	0.233	S	C	.	.	H	α-helix	trans	-60.4	-37.8	175.4	-171.7	-178.4	14.8	0	0	112.1	K83 A84 F89 L90 K91 I99 E100	K83-Q87 WeakPolarHBondContact O-CB 2.83Å; K83-Q87 PolarHBondContact O-N 3.49Å; A84-Q87 PolarHBondContact O-N 3.3Å; Q87-F89 VanDerWaalsContact C-N 3.35Å; Q87-L90 PolarHBondContact O-N 2.95Å; Q87-K91 HydrophobicContact CG-CD 4.43Å; Q87-K91 WeakPolarHBondContact O-CB 3.48Å; Q87-K91 WeakPolarHBondContact O-CG 3.37Å; Q87-K91 PolarHBondContact O-N 2.85Å; Q87-I99 HydrophobicContact CB-CG2 4.11Å; Q87-I99 HydrophobicContact CG-CG2 3.89Å; Q87-E100 PolarHBondContact NE2-OE1 2.83Å; Q87-E100 VanDerWaalsContact NE2-OE1 3.12Å
88	I	92.7	Very high	93.4	Very high	17 Å²	17	47.1 Å²	47.1	9%	0.087	24%	0.235	C	C	.	.	H	α-helix	trans	-66.6	-38.8	174.9	-83.9	159.4	0	0	0	112.3	R37 L41 A84 A85 F86 S92 L183	R37-I88 HydrophobicContact CB-CD1 4.07Å; R37-I88 HydrophobicContact CB-CG1 4.31Å; R37-I88 HydrophobicContact CB-CG2 3.85Å; R37-I88 PolarHBondContact NH1-O 3.23Å; L41-I88 HydrophobicContact CD1-CD1 3.26Å; L41-I88 HydrophobicContact CD2-CD1 3.5Å; L41-I88 HydrophobicContact CG-CD1 3.15Å; A84-I88 PolarHBondContact O-N 3.13Å; A84-I88 VanDerWaalsContact O-N 3.14Å; A85-I88 PolarHBondContact O-N 3.5Å; F86-I88 VanDerWaalsContact C-N 3.28Å; F86-I88 PolarHBondContact O-N 3.21Å; I88-S92 PolarHBondContact O-N 3.04Å; I88-L183 HydrophobicContact CG2-CD2 4.15Å
89	F	94.8	Very high	93.6	Very high	13 Å²	13	42.3 Å²	42.3	6%	0.057	20%	0.201	C	C	.	.	H	α-helix	trans	-60.1	-52.2	173.1	178.7	-99.3	0	0	0	111	A85 F86 Q87 K91 S92 E93 S174 R177 F178 L183	A85-F89 PolarHBondContact O-N 3.4Å; F86-F89 HydrophobicContact CD2-CD1 4.38Å; F86-F89 HydrophobicContact CE2-CD1 4.24Å; F86-F89 WeakPolarHBondContact O-CA 3.4Å; F86-F89 VanDerWaalsContact O-CB 3.3Å; F86-F89 WeakPolarHBondContact O-CB 3.31Å; F86-F89 PolarHBondContact O-N 3.09Å; F86-F89 VanDerWaalsContact O-N 3.1Å; Q87-F89 VanDerWaalsContact C-N 3.35Å; F89-K91 VanDerWaalsContact C-N 3.32Å; F89-K91 PolarHBondContact O-N 3.21Å; F89-S92 WeakPolarHBondContact O-CA 3.46Å; F89-S92 WeakPolarHBondContact O-CB 3.46Å; F89-S92 PolarHBondContact O-N 3.26Å; F89-S92 PolarHBondContact O-OG 3.09Å; F89-E93 VanDerWaalsContact CE1-CD 3.5Å; F89-E93 HydrophobicContact CE1-CG 4.16Å; F89-E93 WeakPolarHBondContact CE1-OE2 3.19Å; F89-E93 HydrophobicContact CZ-CG 4.04Å; F89-E93 WeakPolarHBondContact CZ-OE1 3.49Å; F89-E93 PolarHBondContact O-N 3.35Å; F89-S174 VanDerWaalsContact CE1-O 3.31Å; F89-S174 WeakPolarHBondContact CE1-O 3.32Å; F89-R177 HydrophobicContact CE1-CB 4.2Å; F89-R177 HydrophobicContact CZ-CB 3.69Å; F89-F178 HydrophobicContact CB-CD2 3.58Å; F89-F178 HydrophobicContact CB-CE2 4.22Å; F89-F178 HydrophobicContact CB-CG 4.49Å; F89-F178 HydrophobicContact CD1-CB 3.71Å; F89-F178 HydrophobicContact CD1-CD2 4.23Å; F89-F178 HydrophobicContact CD1-CG 4.42Å; F89-F178 HydrophobicContact CD2-CB 4.37Å; F89-F178 HydrophobicContact CD2-CD2 4.07Å; F89-F178 HydrophobicContact CE1-CB 3.9Å; F89-F178 HydrophobicContact CG-CB 3.96Å; F89-F178 AromaticContact CG-CD2 3.68Å; F89-F178 HydrophobicContact CG-CD2 3.68Å; F89-F178 HydrophobicContact CG-CG 4.29Å; F89-F178 HydrophobicContact CZ-CB 4.31Å; F89-L183 HydrophobicContact CB-CD2 3.85Å; F89-L183 HydrophobicContact CD2-CD2 4.4Å
90	L	95.6	Very high	93.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.8	-39.5	179.7	-64	175.3	0	0	0	112.2	F86 Q87 S92 E93 F94 C95 D96 I99 M170	F86-L90 HydrophobicContact CD1-CD1 3.84Å; F86-L90 HydrophobicContact CD1-CG 4.39Å; F86-L90 HydrophobicContact CD2-CG 4.47Å; F86-L90 HydrophobicContact CE1-CD1 3.64Å; F86-L90 HydrophobicContact CE1-CD2 4.37Å; F86-L90 HydrophobicContact CE1-CG 4.21Å; F86-L90 HydrophobicContact CE2-CD2 4.12Å; F86-L90 HydrophobicContact CE2-CG 4.27Å; F86-L90 HydrophobicContact CG-CD1 4.41Å; F86-L90 HydrophobicContact CZ-CD1 4.03Å; F86-L90 HydrophobicContact CZ-CD2 3.9Å; F86-L90 HydrophobicContact CZ-CG 4.14Å; F86-L90 WeakPolarHBondContact O-CG 3.24Å; F86-L90 PolarHBondContact O-N 2.76Å; Q87-L90 PolarHBondContact O-N 2.95Å; L90-S92 PolarHBondContact O-N 2.94Å; L90-E93 CarbonylContact O-C 3.59Å; L90-E93 VanDerWaalsContact O-C 3.31Å; L90-E93 WeakPolarHBondContact O-CA 3.24Å; L90-E93 PolarHBondContact O-N 3.03Å; L90-F94 PolarHBondContact O-N 3.43Å; L90-C95 WeakPolarHBondContact CD2-SG 3.49Å; L90-C95 PolarHBondContact O-N 3.37Å; L90-D96 HydrophobicContact CB-CB 3.88Å; L90-I99 HydrophobicContact CD1-CB 3.58Å; L90-I99 HydrophobicContact CD1-CG2 3.47Å; L90-I99 VanDerWaalsContact CD1-CG2 3.47Å; L90-M170 HydrophobicContact CD1-SD 4.09Å
91	K	93.2	Very high	94.4	Very high	68 Å²	68	34 Å²	34	30%	0.296	17%	0.165	S	C	.	.	H	α-helix	trans	-61.1	-27.6	173	-80.5	179	177.4	176.1	0	113.1	Q87 F89 E93 D96 E100	Q87-K91 HydrophobicContact CG-CD 4.43Å; Q87-K91 WeakPolarHBondContact O-CB 3.48Å; Q87-K91 WeakPolarHBondContact O-CG 3.37Å; Q87-K91 PolarHBondContact O-N 2.85Å; F89-K91 VanDerWaalsContact C-N 3.32Å; F89-K91 PolarHBondContact O-N 3.21Å; K91-E93 VanDerWaalsContact C-N 3.33Å; K91-D96 HydrophobicContact CB-CB 4.38Å; K91-D96 WeakPolarHBondContact CE-OD2 3.49Å; K91-D96 HydrophobicContact CG-CB 3.51Å; K91-D96 WeakPolarHBondContact CG-OD2 3.24Å; K91-D96 IonicContact NZ-OD2 2.58Å; K91-E100 IonicContact NZ-OE1 3.08Å; K91-E100 PolarHBondContact NZ-OE1 3.25Å
92	S	89.8	Confident	94.8	Very high	40 Å²	40	32.2 Å²	32.2	28%	0.28	16%	0.158	S	C	.	.	H	α-helix	trans	-81.5	-17.3	175.8	80.4	0	0	0	0	113.2	I88 F89 L90	I88-S92 PolarHBondContact O-N 3.04Å; F89-S92 WeakPolarHBondContact O-CA 3.46Å; F89-S92 WeakPolarHBondContact O-CB 3.46Å; F89-S92 PolarHBondContact O-N 3.26Å; F89-S92 PolarHBondContact O-OG 3.09Å; L90-S92 PolarHBondContact O-N 2.94Å
93	E	92.9	Very high	95	Very high	57 Å²	57	33.9 Å²	33.9	27%	0.266	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	4.8	174	-64.2	-159.2	149.3	0	0	112.7	F89 L90 K91 C95 R177	F89-E93 VanDerWaalsContact CE1-CD 3.5Å; F89-E93 HydrophobicContact CE1-CG 4.16Å; F89-E93 WeakPolarHBondContact CE1-OE2 3.19Å; F89-E93 HydrophobicContact CZ-CG 4.04Å; F89-E93 WeakPolarHBondContact CZ-OE1 3.49Å; F89-E93 PolarHBondContact O-N 3.35Å; L90-E93 CarbonylContact O-C 3.59Å; L90-E93 VanDerWaalsContact O-C 3.31Å; L90-E93 WeakPolarHBondContact O-CA 3.24Å; L90-E93 PolarHBondContact O-N 3.03Å; K91-E93 VanDerWaalsContact C-N 3.33Å; E93-C95 VanDerWaalsContact C-N 3.27Å; E93-C95 PolarHBondContact O-N 3.25Å; E93-R177 IonicContact OE1-CZ 2.59Å; E93-R177 IonicContact OE1-NE 3.38Å; E93-R177 PolarHBondContact OE1-NE 2.84Å; E93-R177 IonicContact OE2-CZ 3.14Å; E93-R177 IonicContact OE2-NE 2.91Å; E93-R177 PolarHBondContact OE2-NE 3.31Å; E93-R177 VanDerWaalsContact OE2-NE 3.08Å; E93-R177 IonicContact OE2-NH2 2.75Å; E93-R177 PolarHBondContact OE2-NH2 3.37Å
94	F	92.3	Very high	95.2	Very high	178 Å²	178	31.6 Å²	31.6	78%	0.781	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	41.5	-177.8	-53.5	-87	0	0	0	113.1	L90	L90-F94 PolarHBondContact O-N 3.43Å
95	C	95.8	Very high	95.4	Very high	18 Å²	18	30.4 Å²	30.4	12%	0.122	15%	0.149	C	C	.	.			trans	-135.8	27.9	180	63.3	0	0	0	0	113	L90 E93 E97 N98	L90-C95 WeakPolarHBondContact CD2-SG 3.49Å; L90-C95 PolarHBondContact O-N 3.37Å; E93-C95 VanDerWaalsContact C-N 3.27Å; E93-C95 PolarHBondContact O-N 3.25Å; C95-E97 VanDerWaalsContact C-N 3.33Å; C95-E97 WeakPolarHBondContact CA-OE1 3.06Å; C95-E97 WeakPolarHBondContact CA-OE2 3.22Å; C95-N98 PolarHBondContact O-ND2 3.38Å
96	D	96.4	Very high	95.6	Very high	34 Å²	34	32.7 Å²	32.7	18%	0.182	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-13	-177.8	57.5	-67.4	0	0	0	115	L90 K91 N98 I99 E100	L90-D96 HydrophobicContact CB-CB 3.88Å; K91-D96 HydrophobicContact CB-CB 4.38Å; K91-D96 WeakPolarHBondContact CE-OD2 3.49Å; K91-D96 HydrophobicContact CG-CB 3.51Å; K91-D96 WeakPolarHBondContact CG-OD2 3.24Å; K91-D96 IonicContact NZ-OD2 2.58Å; D96-N98 PolarHBondContact O-N 3.21Å; D96-N98 VanDerWaalsContact O-N 3.16Å; D96-I99 HydrophobicContact CB-CG2 4.44Å; D96-I99 VanDerWaalsContact O-CG2 3.24Å; D96-I99 WeakPolarHBondContact O-CG2 3.49Å; D96-I99 PolarHBondContact O-N 2.93Å; D96-E100 WeakPolarHBondContact O-CG 3.47Å; D96-E100 PolarHBondContact O-N 3.18Å; D96-E100 VanDerWaalsContact O-N 3.09Å
97	E	97.7	Very high	95.5	Very high	42 Å²	42	37.3 Å²	37.3	20%	0.196	18%	0.181	C	C	.	.	H	α-helix	trans	-53.3	-33.9	169.5	69.6	-67.6	156.8	0	0	112	C95 E100 F101 K135 I137	C95-E97 VanDerWaalsContact C-N 3.33Å; C95-E97 WeakPolarHBondContact CA-OE1 3.06Å; C95-E97 WeakPolarHBondContact CA-OE2 3.22Å; E97-E100 PolarHBondContact O-N 3.23Å; E97-F101 WeakPolarHBondContact O-CB 3.24Å; E97-F101 PolarHBondContact O-N 3.03Å; E97-K135 HydrophobicContact CB-CB 3.87Å; E97-I137 HydrophobicContact CB-CG2 4.38Å; E97-I137 HydrophobicContact CG-CG2 3.97Å
98	N	97.6	Very high	95.5	Very high	9 Å²	9	34.6 Å²	34.6	5%	0.048	17%	0.169	C	C	.	.	H	α-helix	trans	-63.7	-45.2	-179.6	-63.1	-63.2	0	0	0	112.6	C95 D96 W102 V166 M170	C95-N98 PolarHBondContact O-ND2 3.38Å; D96-N98 PolarHBondContact O-N 3.21Å; D96-N98 VanDerWaalsContact O-N 3.16Å; N98-W102 WeakPolarHBondContact O-CB 3.33Å; N98-W102 PolarHBondContact O-N 3.33Å; N98-V166 HydrophobicContact CB-CG1 3.7Å; N98-V166 VanDerWaalsContact O-CG1 3.26Å; N98-V166 WeakPolarHBondContact O-CG1 3.42Å; N98-M170 HydrophobicContact CB-CG 3.75Å; N98-M170 HydrophobicContact CB-SD 3.71Å
99	I	97.4	Very high	95.5	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-77.8	-30.1	179.6	-171.3	58.3	0	0	0	111.8	L77 K83 F86 Q87 L90 D96 W102 T103 M170	L77-I99 HydrophobicContact CD1-CD1 4.08Å; L77-I99 HydrophobicContact CD2-CD1 3.52Å; L77-I99 HydrophobicContact CG-CD1 4.44Å; K83-I99 HydrophobicContact CG-CD1 4.36Å; K83-I99 HydrophobicContact CG-CG1 4.39Å; F86-I99 HydrophobicContact CD1-CD1 4.46Å; Q87-I99 HydrophobicContact CB-CG2 4.11Å; Q87-I99 HydrophobicContact CG-CG2 3.89Å; L90-I99 HydrophobicContact CD1-CB 3.58Å; L90-I99 HydrophobicContact CD1-CG2 3.47Å; L90-I99 VanDerWaalsContact CD1-CG2 3.47Å; D96-I99 HydrophobicContact CB-CG2 4.44Å; D96-I99 VanDerWaalsContact O-CG2 3.24Å; D96-I99 WeakPolarHBondContact O-CG2 3.49Å; D96-I99 PolarHBondContact O-N 2.93Å; I99-W102 HydrophobicContact CD1-CE3 3.96Å; I99-T103 VanDerWaalsContact O-CB 3.31Å; I99-T103 WeakPolarHBondContact O-CB 3.38Å; I99-T103 PolarHBondContact O-N 3.36Å; I99-T103 PolarHBondContact O-OG1 2.94Å; I99-M170 HydrophobicContact CB-SD 3.97Å; I99-M170 HydrophobicContact CD1-CE 4.23Å; I99-M170 HydrophobicContact CD1-SD 4.32Å
100	E	97.7	Very high	95.3	Very high	34 Å²	34	43.2 Å²	43.2	16%	0.159	21%	0.212	C	C	.	.	H	α-helix	trans	-66.7	-45.8	175	-69.6	-171.5	176	0	0	110.6	Q87 K91 D96 E97 T103 A104 F128 K135	Q87-E100 PolarHBondContact NE2-OE1 2.83Å; Q87-E100 VanDerWaalsContact NE2-OE1 3.12Å; K91-E100 IonicContact NZ-OE1 3.08Å; K91-E100 PolarHBondContact NZ-OE1 3.25Å; D96-E100 WeakPolarHBondContact O-CG 3.47Å; D96-E100 PolarHBondContact O-N 3.18Å; D96-E100 VanDerWaalsContact O-N 3.09Å; E97-E100 PolarHBondContact O-N 3.23Å; E100-T103 PolarHBondContact O-N 3.27Å; E100-A104 WeakPolarHBondContact O-CB 3.31Å; E100-A104 PolarHBondContact O-N 3.28Å; E100-F128 HydrophobicContact CB-CE1 3.92Å; E100-F128 HydrophobicContact CB-CZ 3.98Å; E100-K135 WeakPolarHBondContact OE2-CE 3.26Å; E100-K135 IonicContact OE2-NZ 3.95Å; E100-K135 PolarHBondContact OE2-NZ 3.23Å
101	F	98.3	Very high	95.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.5	-51	172	174.5	-104.5	0	0	0	111.9	E97 T103 A104 C105 I124 F128 I129 I137 F159 A162 V166	E97-F101 WeakPolarHBondContact O-CB 3.24Å; E97-F101 PolarHBondContact O-N 3.03Å; F101-T103 PolarHBondContact O-N 2.97Å; F101-A104 WeakPolarHBondContact O-CB 3.26Å; F101-A104 PolarHBondContact O-N 2.68Å; F101-A104 VanDerWaalsContact O-N 3.09Å; F101-C105 VanDerWaalsContact CE2-SG 3.6Å; F101-C105 WeakPolarHBondContact CZ-SG 3.36Å; F101-C105 PolarHBondContact O-N 2.92Å; F101-C105 PolarHBondContact O-SG 3.29Å; F101-C105 VanDerWaalsContact O-SG 3.35Å; F101-I124 HydrophobicContact CD2-CG2 4.08Å; F101-I124 HydrophobicContact CE2-CG2 3.76Å; F101-F128 HydrophobicContact CB-CB 4.38Å; F101-F128 HydrophobicContact CB-CD1 3.71Å; F101-F128 HydrophobicContact CB-CD2 4.43Å; F101-F128 HydrophobicContact CB-CE1 4.03Å; F101-F128 HydrophobicContact CB-CG 3.93Å; F101-F128 HydrophobicContact CD2-CB 3.6Å; F101-F128 HydrophobicContact CD2-CD1 4.39Å; F101-F128 AromaticContact CD2-CD2 3.95Å; F101-F128 HydrophobicContact CD2-CD2 3.95Å; F101-F128 AromaticContact CD2-CG 3.74Å; F101-F128 HydrophobicContact CD2-CG 3.74Å; F101-F128 HydrophobicContact CE2-CB 4.32Å; F101-F128 HydrophobicContact CG-CB 4.33Å; F101-F128 HydrophobicContact CG-CG 4.29Å; F101-I129 HydrophobicContact CD2-CD1 4.43Å; F101-I129 HydrophobicContact CE2-CD1 3.7Å; F101-I129 HydrophobicContact CE2-CG1 4.29Å; F101-I129 HydrophobicContact CZ-CD1 4Å; F101-I137 HydrophobicContact CB-CG2 4.03Å; F101-I137 HydrophobicContact CD1-CD1 3.55Å; F101-I137 HydrophobicContact CD2-CD1 3.99Å; F101-I137 HydrophobicContact CE1-CD1 3.55Å; F101-I137 HydrophobicContact CE2-CD1 4.01Å; F101-I137 HydrophobicContact CG-CD1 3.75Å; F101-I137 HydrophobicContact CG-CG2 4.37Å; F101-I137 HydrophobicContact CZ-CD1 3.79Å; F101-F159 HydrophobicContact CE2-CD1 4.34Å; F101-F159 HydrophobicContact CZ-CB 4.41Å; F101-F159 HydrophobicContact CZ-CD1 4.4Å; F101-A162 HydrophobicContact CE1-CB 4.05Å; F101-A162 HydrophobicContact CZ-CB 3.78Å; F101-V166 HydrophobicContact CD1-CB 4.09Å; F101-V166 HydrophobicContact CD1-CG1 4.2Å; F101-V166 HydrophobicContact CD1-CG2 3.73Å; F101-V166 HydrophobicContact CE1-CB 4.39Å; F101-V166 HydrophobicContact CE1-CG2 3.89Å
102	W	97.9	Very high	94.7	Very high	24 Å²	24	49 Å²	49	9%	0.091	25%	0.25	C	C	.	.	H	α-helix	trans	-58.2	-39.8	-179.5	-178.3	93.1	0	0	0	111.8	L77 N98 I99 C105 E106 Q163 F167 M170	L77-W102 HydrophobicContact CB-CH2 3.7Å; L77-W102 HydrophobicContact CB-CZ2 4.27Å; L77-W102 HydrophobicContact CB-CZ3 3.97Å; L77-W102 HydrophobicContact CD1-CD2 3.9Å; L77-W102 HydrophobicContact CD1-CE3 3.95Å; L77-W102 HydrophobicContact CD1-CH2 3.9Å; L77-W102 HydrophobicContact CD1-CZ2 3.83Å; L77-W102 HydrophobicContact CD1-CZ3 3.95Å; L77-W102 HydrophobicContact CG-CH2 4.43Å; L77-W102 HydrophobicContact CG-CZ3 4.47Å; N98-W102 WeakPolarHBondContact O-CB 3.33Å; N98-W102 PolarHBondContact O-N 3.33Å; I99-W102 HydrophobicContact CD1-CE3 3.96Å; W102-C105 PolarHBondContact O-N 3.03Å; W102-E106 HydrophobicContact CD2-CG 4.19Å; W102-E106 HydrophobicContact CE3-CG 4.02Å; W102-E106 HydrophobicContact CH2-CG 3.61Å; W102-E106 HydrophobicContact CZ2-CG 3.78Å; W102-E106 HydrophobicContact CZ3-CG 3.74Å; W102-E106 PolarHBondContact O-N 3.37Å; W102-E106 VanDerWaalsContact O-N 3.1Å; W102-Q163 HydrophobicContact CG-CG 4.29Å; W102-Q163 PolarHBondContact O-NE2 3.06Å; W102-F167 AromaticContact NE1-CD2 3.66Å; W102-M170 HydrophobicContact CB-CE 3.97Å; W102-M170 HydrophobicContact CG-CE 4.17Å
103	T	96.8	Very high	94.5	Very high	35 Å²	35	49.5 Å²	49.5	22%	0.215	25%	0.253	C	S	.	.	H	α-helix	trans	-67.2	-42.5	176.4	-58.2	0	0	0	0	111.5	I99 E100 F101 C105 E106 E107	I99-T103 VanDerWaalsContact O-CB 3.31Å; I99-T103 WeakPolarHBondContact O-CB 3.38Å; I99-T103 PolarHBondContact O-N 3.36Å; I99-T103 PolarHBondContact O-OG1 2.94Å; E100-T103 PolarHBondContact O-N 3.27Å; F101-T103 PolarHBondContact O-N 2.97Å; T103-C105 VanDerWaalsContact C-N 3.27Å; T103-C105 PolarHBondContact O-N 2.97Å; T103-E106 PolarHBondContact O-N 2.78Å; T103-E107 WeakPolarHBondContact O-CG 3.14Å; T103-E107 PolarHBondContact O-N 3.4Å
104	A	97	Very high	93.7	Very high	5 Å²	5	53.3 Å²	53.3	4%	0.041	28%	0.275	C	S	.	.	H	α-helix	trans	-61.1	-36.2	175.8	0	0	0	0	0	112.2	E100 F101 F108 I124 F128	E100-A104 WeakPolarHBondContact O-CB 3.31Å; E100-A104 PolarHBondContact O-N 3.28Å; F101-A104 WeakPolarHBondContact O-CB 3.26Å; F101-A104 PolarHBondContact O-N 2.68Å; F101-A104 VanDerWaalsContact O-N 3.09Å; A104-F108 VanDerWaalsContact O-CB 3.24Å; A104-F108 WeakPolarHBondContact O-CB 3.21Å; A104-F108 PolarHBondContact O-N 3.14Å; A104-I124 HydrophobicContact CB-CD1 4.2Å; A104-I124 HydrophobicContact CB-CG1 4.14Å; A104-F128 HydrophobicContact CB-CE2 4.33Å
105	C	96.8	Very high	93.1	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.02	27%	0.272	C	S	.	.	H	α-helix	trans	-67.1	-41.9	173.7	-65.2	0	0	0	0	113.1	F101 W102 T103 F108 R109 F159 Q163	F101-C105 VanDerWaalsContact CE2-SG 3.6Å; F101-C105 WeakPolarHBondContact CZ-SG 3.36Å; F101-C105 PolarHBondContact O-N 2.92Å; F101-C105 PolarHBondContact O-SG 3.29Å; F101-C105 VanDerWaalsContact O-SG 3.35Å; W102-C105 PolarHBondContact O-N 3.03Å; T103-C105 VanDerWaalsContact C-N 3.27Å; T103-C105 PolarHBondContact O-N 2.97Å; C105-F108 PolarHBondContact O-N 2.99Å; C105-R109 PolarHBondContact O-N 3.14Å; C105-F159 HydrophobicContact CB-CB 4.47Å; C105-F159 VanDerWaalsContact SG-CB 3.55Å; C105-Q163 HydrophobicContact CB-CB 4.11Å; C105-Q163 VanDerWaalsContact CB-CD 3.43Å; C105-Q163 HydrophobicContact CB-CG 3.79Å
106	E	95.6	Very high	92.8	Very high	49 Å²	49	53.7 Å²	53.7	23%	0.229	29%	0.294	C	S	.	.	H	α-helix	trans	-60.6	-45.6	175.4	-73.8	-61.6	102.3	0	0	111.3	W102 T103 R109 T110 Q163	W102-E106 HydrophobicContact CD2-CG 4.19Å; W102-E106 HydrophobicContact CE3-CG 4.02Å; W102-E106 HydrophobicContact CH2-CG 3.61Å; W102-E106 HydrophobicContact CZ2-CG 3.78Å; W102-E106 HydrophobicContact CZ3-CG 3.74Å; W102-E106 PolarHBondContact O-N 3.37Å; W102-E106 VanDerWaalsContact O-N 3.1Å; T103-E106 PolarHBondContact O-N 2.78Å; E106-R109 PolarHBondContact O-N 3.33Å; E106-R109 IonicContact OE1-CZ 2.78Å; E106-R109 IonicContact OE1-NH1 3.75Å; E106-R109 PolarHBondContact OE1-NH1 3.26Å; E106-R109 IonicContact OE1-NH2 2.78Å; E106-R109 PolarHBondContact OE1-NH2 3.17Å; E106-R109 IonicContact OE2-CZ 3.97Å; E106-R109 IonicContact OE2-NH2 3.11Å; E106-R109 PolarHBondContact OE2-NH2 3.44Å; E106-T110 PolarHBondContact O-N 3.08Å; E106-Q163 PolarHBondContact OE1-NE2 3.17Å
107	E	94.1	Very high	92.6	Very high	97 Å²	97	52.5 Å²	52.5	45%	0.453	29%	0.288	S	S	.	.	H	α-helix	trans	-60.1	-47.9	175.2	-70.2	174	178.2	0	0	111.3	T103 R109 T110 M111 R120	T103-E107 WeakPolarHBondContact O-CG 3.14Å; T103-E107 PolarHBondContact O-N 3.4Å; E107-R109 VanDerWaalsContact C-N 3.3Å; E107-R109 PolarHBondContact O-N 2.81Å; E107-T110 PolarHBondContact O-N 3.27Å; E107-T110 PolarHBondContact O-OG1 2.83Å; E107-M111 WeakPolarHBondContact O-CG 3.48Å; E107-M111 PolarHBondContact O-N 3.31Å; E107-R120 IonicContact OE2-NH2 2.8Å; E107-R120 PolarHBondContact OE2-NH2 3.29Å
108	F	94.7	Very high	92.3	Very high	2 Å²	2	53 Å²	53	1%	0.009	30%	0.296	C	S	.	.	H	α-helix	trans	-56.6	-42.2	179.4	-179.5	-99.8	0	0	0	112.2	A104 C105 T110 M111 L117 R120 A121 I124 S155 L156 C158 F159	A104-F108 VanDerWaalsContact O-CB 3.24Å; A104-F108 WeakPolarHBondContact O-CB 3.21Å; A104-F108 PolarHBondContact O-N 3.14Å; C105-F108 PolarHBondContact O-N 2.99Å; F108-T110 PolarHBondContact O-N 2.79Å; F108-M111 HydrophobicContact CD2-SD 4.1Å; F108-M111 WeakPolarHBondContact O-CB 3.47Å; F108-M111 PolarHBondContact O-N 3.04Å; F108-M111 VanDerWaalsContact O-N 3.14Å; F108-L117 HydrophobicContact CD2-CD1 4.05Å; F108-L117 HydrophobicContact CE1-CD1 4.21Å; F108-L117 HydrophobicContact CE2-CD1 3.4Å; F108-L117 VanDerWaalsContact CE2-CD1 3.4Å; F108-L117 HydrophobicContact CE2-CG 3.91Å; F108-L117 HydrophobicContact CZ-CD1 3.51Å; F108-L117 HydrophobicContact CZ-CG 3.91Å; F108-R120 HydrophobicContact CD2-CB 4.16Å; F108-R120 HydrophobicContact CD2-CG 3.84Å; F108-R120 HydrophobicContact CE2-CB 4.45Å; F108-A121 HydrophobicContact CE2-CB 3.74Å; F108-A121 HydrophobicContact CZ-CB 3.93Å; F108-I124 HydrophobicContact CB-CD1 3.84Å; F108-I124 HydrophobicContact CD2-CD1 4.05Å; F108-I124 HydrophobicContact CG-CD1 4.09Å; F108-S155 WeakPolarHBondContact CE1-O 3.34Å; F108-S155 WeakPolarHBondContact CZ-O 3.43Å; F108-L156 VanDerWaalsContact O-CD2 3.24Å; F108-L156 WeakPolarHBondContact O-CD2 3.44Å; F108-C158 HydrophobicContact CE1-CB 4.23Å; F108-F159 AromaticContact CD1-CD2 3.7Å; F108-F159 HydrophobicContact CD1-CD2 3.7Å; F108-F159 HydrophobicContact CD1-CE2 4.04Å; F108-F159 HydrophobicContact CD2-CE2 4.35Å; F108-F159 AromaticContact CE1-CD2 3.75Å; F108-F159 HydrophobicContact CE1-CD2 3.75Å; F108-F159 AromaticContact CE1-CE2 3.85Å; F108-F159 HydrophobicContact CE1-CE2 3.85Å; F108-F159 HydrophobicContact CE2-CE2 4.19Å; F108-F159 HydrophobicContact CG-CD2 4.21Å; F108-F159 HydrophobicContact CG-CE2 4.26Å; F108-F159 HydrophobicContact CZ-CD2 4.31Å; F108-F159 AromaticContact CZ-CE2 3.93Å; F108-F159 HydrophobicContact CZ-CE2 3.93Å
109	R	92.3	Very high	92.1	Very high	104 Å²	104	55.5 Å²	55.5	39%	0.392	31%	0.314	S	S	.	.	H	α-helix	trans	-66.1	-23.5	179.1	-167.1	174.4	70	-134.2	-6.7	113.4	C105 E106 E107	C105-R109 PolarHBondContact O-N 3.14Å; E106-R109 PolarHBondContact O-N 3.33Å; E106-R109 IonicContact OE1-CZ 2.78Å; E106-R109 IonicContact OE1-NH1 3.75Å; E106-R109 PolarHBondContact OE1-NH1 3.26Å; E106-R109 IonicContact OE1-NH2 2.78Å; E106-R109 PolarHBondContact OE1-NH2 3.17Å; E106-R109 IonicContact OE2-CZ 3.97Å; E106-R109 IonicContact OE2-NH2 3.11Å; E106-R109 PolarHBondContact OE2-NH2 3.44Å; E107-R109 VanDerWaalsContact C-N 3.3Å; E107-R109 PolarHBondContact O-N 2.81Å
110	T	91.1	Very high	92	Very high	107 Å²	107	58.5 Å²	58.5	66%	0.656	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-2.9	177.2	64.8	0	0	0	0	113.7	E106 E107 F108 T112	E106-T110 PolarHBondContact O-N 3.08Å; E107-T110 PolarHBondContact O-N 3.27Å; E107-T110 PolarHBondContact O-OG1 2.83Å; F108-T110 PolarHBondContact O-N 2.79Å; T110-T112 PolarHBondContact O-N 3.32Å
111	M	91.1	Very high	91.9	Very high	49 Å²	49	56.9 Å²	56.9	24%	0.241	32%	0.318	C	S	.	.			trans	-70.7	128	-178.9	-66	-175.3	80.6	0	0	111.8	E107 F108 K116 L117 R120	E107-M111 WeakPolarHBondContact O-CG 3.48Å; E107-M111 PolarHBondContact O-N 3.31Å; F108-M111 HydrophobicContact CD2-SD 4.1Å; F108-M111 WeakPolarHBondContact O-CB 3.47Å; F108-M111 PolarHBondContact O-N 3.04Å; F108-M111 VanDerWaalsContact O-N 3.14Å; M111-K116 HydrophobicContact CE-CB 3.66Å; M111-L117 HydrophobicContact CB-CD1 4.3Å; M111-R120 HydrophobicContact CE-CB 4.02Å; M111-R120 HydrophobicContact CE-CG 4.36Å; M111-R120 HydrophobicContact SD-CB 3.76Å; M111-R120 HydrophobicContact SD-CG 3.64Å
112	T	85.9	Confident	91.8	Very high	139 Å²	139	63.1 Å²	63.1	85%	0.853	34%	0.341	S	S	*	.			trans	-99.5	-15.4	176.5	54	0	0	0	0	113.3	T110 L114	T110-T112 PolarHBondContact O-N 3.32Å; T112-L114 PolarHBondContact O-N 2.75Å
113	S	85.8	Confident	91.7	Very high	51 Å²	51	64.8 Å²	64.8	36%	0.357	35%	0.354	S	S	.	.			trans	-88.4	103.3	-177.2	176.9	0	0	0	0	111.4	G115 K116 L117	S113-G115 VanDerWaalsContact C-N 3.25Å; S113-G115 PolarHBondContact O-N 3.38Å; S113-K116 PolarHBondContact O-N 3.1Å; S113-K116 VanDerWaalsContact O-N 3.11Å; S113-L117 PolarHBondContact O-N 2.7Å; S113-L117 VanDerWaalsContact O-N 3.08Å
114	L	76.3	Confident	91.8	Very high	138 Å²	138	63.1 Å²	63.1	72%	0.723	34%	0.344	S	S	*	.	H	α-helix	trans	-57	-38.2	175.8	-68.6	173.7	0	0	0	112.5	T112 K116 L117	T112-L114 PolarHBondContact O-N 2.75Å; L114-K116 VanDerWaalsContact C-N 3.25Å; L114-K116 PolarHBondContact O-N 2.59Å; L114-L117 HydrophobicContact CD2-CD2 4.34Å; L114-L117 WeakPolarHBondContact O-CB 3.43Å; L114-L117 PolarHBondContact O-N 2.9Å; L114-L117 VanDerWaalsContact O-N 3.15Å
115	G	79.3	Confident	91.8	Very high	70 Å²	70	65 Å²	65	72%	0.722	35%	0.35	S	S	*	.	H	α-helix	trans	-64	-26.5	178.5	0	0	0	0	0	114.4	S113	S113-G115 VanDerWaalsContact C-N 3.25Å; S113-G115 PolarHBondContact O-N 3.38Å
116	K	88.7	Confident	91.8	Very high	134 Å²	134	69.2 Å²	69.2	58%	0.583	37%	0.37	S	S	*	.	H	α-helix	trans	-95.9	-12.1	175.8	-64.7	-178.2	-179.5	-178.3	0	113.1	M111 S113 L114 S119 R120	M111-K116 HydrophobicContact CE-CB 3.66Å; S113-K116 PolarHBondContact O-N 3.1Å; S113-K116 VanDerWaalsContact O-N 3.11Å; L114-K116 VanDerWaalsContact C-N 3.25Å; L114-K116 PolarHBondContact O-N 2.59Å; K116-S119 PolarHBondContact O-OG 2.88Å; K116-R120 WeakPolarHBondContact O-CB 3.33Å; K116-R120 PolarHBondContact O-N 3.45Å
117	L	91.8	Very high	91.9	Very high	8 Å²	8	69.3 Å²	69.3	4%	0.042	37%	0.37	C	S	.	.	H	α-helix	trans	-64.6	-48.5	-176.7	-168.2	73.4	0	0	0	110.7	F108 M111 S113 L114 S119 R120 A121 P154 L156	F108-L117 HydrophobicContact CD2-CD1 4.05Å; F108-L117 HydrophobicContact CE1-CD1 4.21Å; F108-L117 HydrophobicContact CE2-CD1 3.4Å; F108-L117 VanDerWaalsContact CE2-CD1 3.4Å; F108-L117 HydrophobicContact CE2-CG 3.91Å; F108-L117 HydrophobicContact CZ-CD1 3.51Å; F108-L117 HydrophobicContact CZ-CG 3.91Å; M111-L117 HydrophobicContact CB-CD1 4.3Å; S113-L117 PolarHBondContact O-N 2.7Å; S113-L117 VanDerWaalsContact O-N 3.08Å; L114-L117 HydrophobicContact CD2-CD2 4.34Å; L114-L117 WeakPolarHBondContact O-CB 3.43Å; L114-L117 PolarHBondContact O-N 2.9Å; L114-L117 VanDerWaalsContact O-N 3.15Å; L117-S119 PolarHBondContact O-N 3.3Å; L117-R120 PolarHBondContact O-N 3.3Å; L117-A121 WeakPolarHBondContact O-CB 3.37Å; L117-A121 PolarHBondContact O-N 2.95Å; L117-P154 HydrophobicContact CD2-CB 4.38Å; L117-P154 WeakPolarHBondContact CD2-O 3.35Å; L117-P154 HydrophobicContact CG-CB 4.41Å; L117-L156 HydrophobicContact CD1-CD2 3.67Å
118	S	92.1	Very high	92.1	Very high	52 Å²	52	64.9 Å²	64.9	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-65.9	-39.2	-177.8	-55.3	0	0	0	0	113.3	R122	S118-R122 PolarHBondContact O-N 3.44Å; S118-R122 VanDerWaalsContact O-N 3.14Å
119	S	93.7	Very high	92.2	Very high	63 Å²	63	64.9 Å²	64.9	44%	0.441	35%	0.349	S	S	.	.	H	α-helix	trans	-67.6	-43.9	175.9	55.8	0	0	0	0	111.3	K116 L117 A121 R122 T123	K116-S119 PolarHBondContact O-OG 2.88Å; L117-S119 PolarHBondContact O-N 3.3Å; S119-A121 PolarHBondContact O-N 3.05Å; S119-R122 PolarHBondContact O-N 2.65Å; S119-T123 PolarHBondContact O-N 3.09Å; S119-T123 PolarHBondContact O-OG1 2.72Å; S119-T123 VanDerWaalsContact O-OG1 3.11Å
120	R	95.5	Very high	92.4	Very high	65 Å²	65	63.9 Å²	63.9	25%	0.245	35%	0.349	C	S	.	.	H	α-helix	trans	-64.3	-41	177.2	-173.5	61.2	167.6	155.3	-4.2	112.3	E107 F108 M111 K116 L117 R122 T123 I124	E107-R120 IonicContact OE2-NH2 2.8Å; E107-R120 PolarHBondContact OE2-NH2 3.29Å; F108-R120 HydrophobicContact CD2-CB 4.16Å; F108-R120 HydrophobicContact CD2-CG 3.84Å; F108-R120 HydrophobicContact CE2-CB 4.45Å; M111-R120 HydrophobicContact CE-CB 4.02Å; M111-R120 HydrophobicContact CE-CG 4.36Å; M111-R120 HydrophobicContact SD-CB 3.76Å; M111-R120 HydrophobicContact SD-CG 3.64Å; K116-R120 WeakPolarHBondContact O-CB 3.33Å; K116-R120 PolarHBondContact O-N 3.45Å; L117-R120 PolarHBondContact O-N 3.3Å; R120-R122 VanDerWaalsContact C-N 3.3Å; R120-R122 PolarHBondContact O-N 2.9Å; R120-T123 PolarHBondContact O-N 3.4Å; R120-I124 HydrophobicContact CG-CD1 4.06Å; R120-I124 WeakPolarHBondContact O-CG1 3.35Å; R120-I124 PolarHBondContact O-N 3.14Å
121	A	95.8	Very high	92.5	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-59.2	-43.3	176.1	0	0	0	0	0	111.3	F108 L117 S119 I124 Y125 L151 P154 F159	F108-A121 HydrophobicContact CE2-CB 3.74Å; F108-A121 HydrophobicContact CZ-CB 3.93Å; L117-A121 WeakPolarHBondContact O-CB 3.37Å; L117-A121 PolarHBondContact O-N 2.95Å; S119-A121 PolarHBondContact O-N 3.05Å; A121-I124 PolarHBondContact O-N 3.06Å; A121-Y125 PolarHBondContact O-N 3.1Å; A121-L151 HydrophobicContact CB-CD2 3.78Å; A121-P154 HydrophobicContact CB-CB 4.03Å; A121-P154 HydrophobicContact CB-CG 4.28Å; A121-F159 HydrophobicContact CB-CE2 4.2Å; A121-F159 HydrophobicContact CB-CZ 4.24Å; A121-F159 WeakPolarHBondContact O-CZ 3.06Å
122	R	95.5	Very high	92.6	Very high	130 Å²	130	67.8 Å²	67.8	49%	0.491	37%	0.373	S	S	.	.	H	α-helix	trans	-64	-45.2	176	-175.3	165.5	-63.1	113.1	5.8	112.3	S118 S119 R120 I124 Y125 E126	S118-R122 PolarHBondContact O-N 3.44Å; S118-R122 VanDerWaalsContact O-N 3.14Å; S119-R122 PolarHBondContact O-N 2.65Å; R120-R122 VanDerWaalsContact C-N 3.3Å; R120-R122 PolarHBondContact O-N 2.9Å; R122-I124 VanDerWaalsContact C-N 3.34Å; R122-I124 PolarHBondContact O-N 3.09Å; R122-Y125 WeakPolarHBondContact O-CB 3.43Å; R122-Y125 PolarHBondContact O-N 3.36Å; R122-Y125 VanDerWaalsContact O-N 3.15Å; R122-E126 WeakPolarHBondContact CD-OE1 3.49Å; R122-E126 HydrophobicContact CG-CG 4.29Å; R122-E126 WeakPolarHBondContact CG-OE1 3.26Å; R122-E126 WeakPolarHBondContact O-CG 3.43Å; R122-E126 PolarHBondContact O-N 2.87Å
123	T	96.8	Very high	93.1	Very high	59 Å²	59	61.7 Å²	61.7	36%	0.362	34%	0.337	S	S	.	.	H	α-helix	trans	-58.5	-44.5	176.1	-57.3	0	0	0	0	112.2	S119 R120 Y125 E126 E127	S119-T123 PolarHBondContact O-N 3.09Å; S119-T123 PolarHBondContact O-OG1 2.72Å; S119-T123 VanDerWaalsContact O-OG1 3.11Å; R120-T123 PolarHBondContact O-N 3.4Å; T123-Y125 VanDerWaalsContact C-N 3.3Å; T123-Y125 PolarHBondContact O-N 3.21Å; T123-E126 PolarHBondContact O-N 3.45Å; T123-E127 VanDerWaalsContact O-CB 3.31Å; T123-E127 WeakPolarHBondContact O-CB 3.32Å; T123-E127 PolarHBondContact O-N 3.03Å
124	I	97.7	Very high	93.6	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-62.7	-40.6	177.6	-67.9	169.8	0	0	0	110.6	F101 A104 F108 R120 A121 R122 F128 F159	F101-I124 HydrophobicContact CD2-CG2 4.08Å; F101-I124 HydrophobicContact CE2-CG2 3.76Å; A104-I124 HydrophobicContact CB-CD1 4.2Å; A104-I124 HydrophobicContact CB-CG1 4.14Å; F108-I124 HydrophobicContact CB-CD1 3.84Å; F108-I124 HydrophobicContact CD2-CD1 4.05Å; F108-I124 HydrophobicContact CG-CD1 4.09Å; R120-I124 HydrophobicContact CG-CD1 4.06Å; R120-I124 WeakPolarHBondContact O-CG1 3.35Å; R120-I124 PolarHBondContact O-N 3.14Å; A121-I124 PolarHBondContact O-N 3.06Å; R122-I124 VanDerWaalsContact C-N 3.34Å; R122-I124 PolarHBondContact O-N 3.09Å; I124-F128 HydrophobicContact CG2-CD2 4.31Å; I124-F128 WeakPolarHBondContact O-CD2 3.3Å; I124-F128 PolarHBondContact O-N 2.78Å; I124-F128 VanDerWaalsContact O-N 3.1Å; I124-F159 HydrophobicContact CB-CE1 4.3Å; I124-F159 HydrophobicContact CB-CE2 4.18Å; I124-F159 HydrophobicContact CB-CZ 3.83Å; I124-F159 HydrophobicContact CD1-CD2 4.39Å; I124-F159 HydrophobicContact CD1-CE2 4Å; I124-F159 HydrophobicContact CG2-CD1 4.08Å; I124-F159 HydrophobicContact CG2-CD2 4.42Å; I124-F159 HydrophobicContact CG2-CE1 3.69Å; I124-F159 HydrophobicContact CG2-CE2 4.06Å; I124-F159 HydrophobicContact CG2-CG 4.43Å; I124-F159 HydrophobicContact CG2-CZ 3.69Å
125	Y	97.2	Very high	94.6	Very high	45 Å²	45	61.6 Å²	61.6	18%	0.176	34%	0.336	C	S	.	.	I	π-helix	trans	-62.7	-49.6	176.8	172.6	-95.9	0	0	0	112.3	A121 R122 T123 E127 I129 Q130 I147 I148 L151	A121-Y125 PolarHBondContact O-N 3.1Å; R122-Y125 WeakPolarHBondContact O-CB 3.43Å; R122-Y125 PolarHBondContact O-N 3.36Å; R122-Y125 VanDerWaalsContact O-N 3.15Å; T123-Y125 VanDerWaalsContact C-N 3.3Å; T123-Y125 PolarHBondContact O-N 3.21Å; Y125-E127 VanDerWaalsContact C-N 3.33Å; Y125-E127 PolarHBondContact O-N 3.29Å; Y125-I129 HydrophobicContact CD2-CB 3.65Å; Y125-I129 HydrophobicContact CD2-CG1 4.47Å; Y125-I129 HydrophobicContact CD2-CG2 3.69Å; Y125-I129 HydrophobicContact CE2-CB 4.13Å; Y125-I129 HydrophobicContact CE2-CG2 3.82Å; Y125-I129 HydrophobicContact CG-CB 4.37Å; Y125-I129 WeakPolarHBondContact O-CA 3.45Å; Y125-I129 PolarHBondContact O-N 3.14Å; Y125-Q130 HydrophobicContact CD1-CB 4.23Å; Y125-Q130 HydrophobicContact CE1-CB 3.74Å; Y125-Q130 HydrophobicContact CE1-CG 4.04Å; Y125-Q130 PolarHBondContact O-N 3.32Å; Y125-I147 HydrophobicContact CD2-CG2 4.22Å; Y125-I148 HydrophobicContact CD2-CG1 4.46Å; Y125-I148 HydrophobicContact CE2-CD1 4.18Å; Y125-I148 HydrophobicContact CE2-CG1 3.51Å; Y125-L151 HydrophobicContact CD1-CD1 4Å; Y125-L151 HydrophobicContact CD2-CD1 3.6Å; Y125-L151 HydrophobicContact CE2-CD1 4.23Å; Y125-L151 HydrophobicContact CG-CD1 3.47Å; Y125-L151 VanDerWaalsContact CG-CD1 3.47Å
126	E	97.5	Very high	95.4	Very high	91 Å²	91	61.8 Å²	61.8	43%	0.425	32%	0.318	S	S	.	.	I	π-helix	trans	-66.6	-32.8	-178.3	-70	168	176.9	0	0	112.5	R122 T123 A133	R122-E126 WeakPolarHBondContact CD-OE1 3.49Å; R122-E126 HydrophobicContact CG-CG 4.29Å; R122-E126 WeakPolarHBondContact CG-OE1 3.26Å; R122-E126 WeakPolarHBondContact O-CG 3.43Å; R122-E126 PolarHBondContact O-N 2.87Å; T123-E126 PolarHBondContact O-N 3.45Å; E126-A133 WeakPolarHBondContact O-CB 3.47Å
127	E	98	Very high	95.8	Very high	51 Å²	51	55.4 Å²	55.4	24%	0.238	29%	0.291	C	S	.	.	I	π-helix	trans	-80.6	-36	-178.5	-171.8	175.2	-179.4	0	0	112.9	T123 Y125 A133 K135	T123-E127 VanDerWaalsContact O-CB 3.31Å; T123-E127 WeakPolarHBondContact O-CB 3.32Å; T123-E127 PolarHBondContact O-N 3.03Å; Y125-E127 VanDerWaalsContact C-N 3.33Å; Y125-E127 PolarHBondContact O-N 3.29Å; E127-A133 WeakPolarHBondContact O-CB 3.4Å; E127-K135 HydrophobicContact CG-CD 4.23Å; E127-K135 CarbonylContact O-C 3.55Å; E127-K135 WeakPolarHBondContact O-CA 3.32Å; E127-K135 WeakPolarHBondContact O-CB 3.26Å; E127-K135 PolarHBondContact O-N 2.73Å; E127-K135 VanDerWaalsContact O-N 3.12Å; E127-K135 IonicContact OE1-NZ 3.32Å; E127-K135 PolarHBondContact OE1-NZ 3.32Å
128	F	98	Very high	95.9	Very high	4 Å²	4	61.5 Å²	61.5	2%	0.018	32%	0.323	C	S	.	.	I	π-helix	trans	-124.8	-24.9	-168.4	-58.9	-79.6	0	0	0	115.9	E100 F101 A104 I124 K135 E136 I137	E100-F128 HydrophobicContact CB-CE1 3.92Å; E100-F128 HydrophobicContact CB-CZ 3.98Å; F101-F128 HydrophobicContact CB-CB 4.38Å; F101-F128 HydrophobicContact CB-CD1 3.71Å; F101-F128 HydrophobicContact CB-CD2 4.43Å; F101-F128 HydrophobicContact CB-CE1 4.03Å; F101-F128 HydrophobicContact CB-CG 3.93Å; F101-F128 HydrophobicContact CD2-CB 3.6Å; F101-F128 HydrophobicContact CD2-CD1 4.39Å; F101-F128 AromaticContact CD2-CD2 3.95Å; F101-F128 HydrophobicContact CD2-CD2 3.95Å; F101-F128 AromaticContact CD2-CG 3.74Å; F101-F128 HydrophobicContact CD2-CG 3.74Å; F101-F128 HydrophobicContact CE2-CB 4.32Å; F101-F128 HydrophobicContact CG-CB 4.33Å; F101-F128 HydrophobicContact CG-CG 4.29Å; A104-F128 HydrophobicContact CB-CE2 4.33Å; I124-F128 HydrophobicContact CG2-CD2 4.31Å; I124-F128 WeakPolarHBondContact O-CD2 3.3Å; I124-F128 PolarHBondContact O-N 2.78Å; I124-F128 VanDerWaalsContact O-N 3.1Å; F128-K135 HydrophobicContact CD1-CB 3.81Å; F128-K135 WeakPolarHBondContact CD1-O 3.36Å; F128-K135 HydrophobicContact CE1-CB 3.88Å; F128-K135 HydrophobicContact CE1-CD 3.83Å; F128-K135 HydrophobicContact CZ-CD 4.3Å; F128-E136 CarbonylContact O-C 3.52Å; F128-E136 WeakPolarHBondContact O-CA 3.45Å; F128-I137 HydrophobicContact CB-CG1 4.4Å; F128-I137 HydrophobicContact CB-CG2 4.5Å; F128-I137 HydrophobicContact CD1-CG2 4.37Å; F128-I137 VanDerWaalsContact O-CG1 3.26Å; F128-I137 WeakPolarHBondContact O-CG1 3.5Å; F128-I137 PolarHBondContact O-N 3.4Å
129	I	97.1	Very high	96	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.01	31%	0.309	C	S	.	.	I	π-helix	trans	-111	-38.7	-166.7	-52.9	-63.9	0	0	0	113	F101 Y125 I137 L139 K144 I147	F101-I129 HydrophobicContact CD2-CD1 4.43Å; F101-I129 HydrophobicContact CE2-CD1 3.7Å; F101-I129 HydrophobicContact CE2-CG1 4.29Å; F101-I129 HydrophobicContact CZ-CD1 4Å; Y125-I129 HydrophobicContact CD2-CB 3.65Å; Y125-I129 HydrophobicContact CD2-CG1 4.47Å; Y125-I129 HydrophobicContact CD2-CG2 3.69Å; Y125-I129 HydrophobicContact CE2-CB 4.13Å; Y125-I129 HydrophobicContact CE2-CG2 3.82Å; Y125-I129 HydrophobicContact CG-CB 4.37Å; Y125-I129 WeakPolarHBondContact O-CA 3.45Å; Y125-I129 PolarHBondContact O-N 3.14Å; I129-I137 HydrophobicContact CD1-CD1 3.65Å; I129-I137 HydrophobicContact CD1-CG1 3.88Å; I129-L139 HydrophobicContact CD1-CD1 3.61Å; I129-K144 HydrophobicContact CG2-CB 4.43Å; I129-K144 HydrophobicContact CG2-CG 4.15Å; I129-I147 HydrophobicContact CD1-CD1 3.91Å; I129-I147 HydrophobicContact CG1-CD1 4.24Å; I129-I147 HydrophobicContact CG2-CD1 4.01Å; I129-I147 HydrophobicContact CG2-CG2 4.42Å
130	Q	95.4	Very high	96	Very high	83 Å²	83	59.6 Å²	59.6	39%	0.388	30%	0.304	S	S	.	.	S	Bend	trans	-55.9	145.1	-179.2	-175	179.2	-35.9	0	0	110.3	Y125 D132 A133	Y125-Q130 HydrophobicContact CD1-CB 4.23Å; Y125-Q130 HydrophobicContact CE1-CB 3.74Å; Y125-Q130 HydrophobicContact CE1-CG 4.04Å; Y125-Q130 PolarHBondContact O-N 3.32Å; Q130-D132 PolarHBondContact O-N 3.26Å; Q130-A133 HydrophobicContact CB-CB 4.28Å; Q130-A133 WeakPolarHBondContact O-CB 3.49Å; Q130-A133 PolarHBondContact O-N 2.98Å
131	C	93.3	Very high	96	Very high	84 Å²	84	65.3 Å²	65.3	57%	0.568	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	134.6	170.7	-59.6	0	0	0	0	110	A133	C131-A133 PolarHBondContact O-N 2.85Å
132	D	93.7	Very high	95.9	Very high	154 Å²	154	72.8 Å²	72.8	82%	0.824	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	22	-176.8	-50.4	-54.9	0	0	0	113.3	Q130 E136	Q130-D132 PolarHBondContact O-N 3.26Å; D132-E136 PolarHBondContact N-OE2 3.14Å
133	A	96.7	Very high	95.9	Very high	12 Å²	12	67 Å²	67	10%	0.099	34%	0.341	C	S	.	.			trans	-60	143.9	172.2	0	0	0	0	0	110.3	E126 E127 Q130 C131 K135 E136	E126-A133 WeakPolarHBondContact O-CB 3.47Å; E127-A133 WeakPolarHBondContact O-CB 3.4Å; Q130-A133 HydrophobicContact CB-CB 4.28Å; Q130-A133 WeakPolarHBondContact O-CB 3.49Å; Q130-A133 PolarHBondContact O-N 2.98Å; C131-A133 PolarHBondContact O-N 2.85Å; A133-K135 PolarHBondContact O-N 2.96Å; A133-E136 HydrophobicContact CB-CB 4.04Å; A133-E136 WeakPolarHBondContact O-CB 3.38Å; A133-E136 PolarHBondContact O-N 3.12Å; A133-E136 VanDerWaalsContact O-N 3.08Å
134	P	96.4	Very high	95.8	Very high	117 Å²	117	65.6 Å²	65.6	76%	0.76	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-23.5	-175.7	25	-35.6	0	0	0	113.5
135	K	96.6	Very high	95.7	Very high	69 Å²	69	68.4 Å²	68.4	30%	0.3	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.5	42.6	176.2	-60.2	-178.6	-171.8	165.2	0	110.8	E97 E100 E127 F128 A133 I137	E97-K135 HydrophobicContact CB-CB 3.87Å; E100-K135 WeakPolarHBondContact OE2-CE 3.26Å; E100-K135 IonicContact OE2-NZ 3.95Å; E100-K135 PolarHBondContact OE2-NZ 3.23Å; E127-K135 HydrophobicContact CG-CD 4.23Å; E127-K135 CarbonylContact O-C 3.55Å; E127-K135 WeakPolarHBondContact O-CA 3.32Å; E127-K135 WeakPolarHBondContact O-CB 3.26Å; E127-K135 PolarHBondContact O-N 2.73Å; E127-K135 VanDerWaalsContact O-N 3.12Å; E127-K135 IonicContact OE1-NZ 3.32Å; E127-K135 PolarHBondContact OE1-NZ 3.32Å; F128-K135 HydrophobicContact CD1-CB 3.81Å; F128-K135 WeakPolarHBondContact CD1-O 3.36Å; F128-K135 HydrophobicContact CE1-CB 3.88Å; F128-K135 HydrophobicContact CE1-CD 3.83Å; F128-K135 HydrophobicContact CZ-CD 4.3Å; A133-K135 PolarHBondContact O-N 2.96Å; K135-I137 PolarHBondContact O-N 3.34Å
136	E	96.6	Very high	95.6	Very high	74 Å²	74	69.1 Å²	69.1	35%	0.346	36%	0.36	S	S	.	.			trans	-53.7	123.1	-177.6	-169.6	178.6	163.2	0	0	112.1	F128 D132 A133 K144	F128-E136 CarbonylContact O-C 3.52Å; F128-E136 WeakPolarHBondContact O-CA 3.45Å; D132-E136 PolarHBondContact N-OE2 3.14Å; A133-E136 HydrophobicContact CB-CB 4.04Å; A133-E136 WeakPolarHBondContact O-CB 3.38Å; A133-E136 PolarHBondContact O-N 3.12Å; A133-E136 VanDerWaalsContact O-N 3.08Å; E136-K144 IonicContact OE1-NZ 2.81Å; E136-K144 PolarHBondContact OE1-NZ 3.21Å
137	I	96.6	Very high	95.5	Very high	1 Å²	1	65 Å²	65	1%	0.005	34%	0.341	C	S	.	.			trans	-88.7	146.7	175.5	56	161.4	0	0	0	111.4	E97 F101 F128 I129 K135 L139 V166	E97-I137 HydrophobicContact CB-CG2 4.38Å; E97-I137 HydrophobicContact CG-CG2 3.97Å; F101-I137 HydrophobicContact CB-CG2 4.03Å; F101-I137 HydrophobicContact CD1-CD1 3.55Å; F101-I137 HydrophobicContact CD2-CD1 3.99Å; F101-I137 HydrophobicContact CE1-CD1 3.55Å; F101-I137 HydrophobicContact CE2-CD1 4.01Å; F101-I137 HydrophobicContact CG-CD1 3.75Å; F101-I137 HydrophobicContact CG-CG2 4.37Å; F101-I137 HydrophobicContact CZ-CD1 3.79Å; F128-I137 HydrophobicContact CB-CG1 4.4Å; F128-I137 HydrophobicContact CB-CG2 4.5Å; F128-I137 HydrophobicContact CD1-CG2 4.37Å; F128-I137 VanDerWaalsContact O-CG1 3.26Å; F128-I137 WeakPolarHBondContact O-CG1 3.5Å; F128-I137 PolarHBondContact O-N 3.4Å; I129-I137 HydrophobicContact CD1-CD1 3.65Å; I129-I137 HydrophobicContact CD1-CG1 3.88Å; K135-I137 PolarHBondContact O-N 3.34Å; I137-L139 HydrophobicContact CD1-CD1 3.49Å; I137-L139 VanDerWaalsContact CD1-CD1 3.49Å; I137-L139 HydrophobicContact CD1-CD2 4.2Å; I137-L139 HydrophobicContact CD1-CG 3.72Å; I137-L139 HydrophobicContact CG1-CD1 3.95Å; I137-L139 HydrophobicContact CG1-CG 3.98Å; I137-L139 PolarHBondContact O-N 3.1Å; I137-V166 HydrophobicContact CB-CG2 4.44Å; I137-V166 HydrophobicContact CD1-CG2 3.46Å; I137-V166 VanDerWaalsContact CD1-CG2 3.46Å
138	N	93.9	Very high	95.3	Very high	135 Å²	135	65.7 Å²	65.7	72%	0.722	35%	0.345	S	S	*	.			trans	-73.8	98.6	179.6	-173.5	6.7	0	0	0	111.4
139	L	94.7	Very high	95.1	Very high	14 Å²	14	69.4 Å²	69.4	7%	0.073	36%	0.363	C	S	.	.			trans	-128.3	146.1	176	-66.5	177.8	0	0	0	110.9	I129 I137 T143 K144 I147 A162 K165 V166	I129-L139 HydrophobicContact CD1-CD1 3.61Å; I137-L139 HydrophobicContact CD1-CD1 3.49Å; I137-L139 VanDerWaalsContact CD1-CD1 3.49Å; I137-L139 HydrophobicContact CD1-CD2 4.2Å; I137-L139 HydrophobicContact CD1-CG 3.72Å; I137-L139 HydrophobicContact CG1-CD1 3.95Å; I137-L139 HydrophobicContact CG1-CG 3.98Å; I137-L139 PolarHBondContact O-N 3.1Å; L139-T143 HydrophobicContact CD1-CG2 4.26Å; L139-T143 HydrophobicContact CD2-CG2 4.4Å; L139-K144 HydrophobicContact CB-CG 4.01Å; L139-I147 HydrophobicContact CD1-CD1 4.32Å; L139-A162 HydrophobicContact CD1-CB 3.73Å; L139-A162 HydrophobicContact CD2-CB 4.27Å; L139-K165 HydrophobicContact CD2-CB 3.99Å; L139-K165 HydrophobicContact CD2-CD 4.32Å; L139-V166 HydrophobicContact CD2-CG2 4.31Å
140	D	93.9	Very high	94.9	Very high	62 Å²	62	70.7 Å²	70.7	33%	0.332	37%	0.372	S	S	.	.			trans	-66.7	154.6	170	55.9	90.7	0	0	0	112.5	Q142 T143 K144 K165	D140-Q142 VanDerWaalsContact C-N 3.29Å; D140-Q142 PolarHBondContact O-N 2.73Å; D140-Q142 PolarHBondContact OD1-N 2.75Å; D140-T143 VanDerWaalsContact CG-OG1 3.23Å; D140-T143 PolarHBondContact O-N 2.97Å; D140-T143 VanDerWaalsContact O-N 3.12Å; D140-T143 WeakPolarHBondContact OD1-CB 3.41Å; D140-T143 PolarHBondContact OD1-N 3.32Å; D140-T143 PolarHBondContact OD1-OG1 3.4Å; D140-T143 PolarHBondContact OD2-OG1 2.91Å; D140-T143 VanDerWaalsContact OD2-OG1 3.1Å; D140-K144 PolarHBondContact O-N 2.71Å; D140-K144 VanDerWaalsContact O-N 3.15Å; D140-K165 VanDerWaalsContact CG-NZ 3.34Å; D140-K165 IonicContact OD1-NZ 2.9Å; D140-K165 PolarHBondContact OD1-NZ 3.34Å; D140-K165 IonicContact OD2-NZ 2.69Å; D140-K165 PolarHBondContact OD2-NZ 2.74Å
141	Y	93.8	Very high	94.7	Very high	185 Å²	185	68 Å²	68	73%	0.725	36%	0.36	S	S	*	.	H	α-helix	trans	-52.7	-43.7	-179.3	175.8	-95.4	0	0	0	113.1	T143 K144 D145	Y141-T143 VanDerWaalsContact C-N 3.28Å; Y141-T143 PolarHBondContact O-N 2.95Å; Y141-K144 PolarHBondContact O-N 3.22Å; Y141-D145 HydrophobicContact CE1-CB 4.38Å; Y141-D145 PolarHBondContact O-N 2.78Å
142	Q	94.9	Very high	94.5	Very high	157 Å²	157	73.5 Å²	73.5	73%	0.734	37%	0.369	S	S	*	.	H	α-helix	trans	-61.1	-39.5	-177.9	-65.9	179.7	-18.5	0	0	111.7	D140 A146	D140-Q142 VanDerWaalsContact C-N 3.29Å; D140-Q142 PolarHBondContact O-N 2.73Å; D140-Q142 PolarHBondContact OD1-N 2.75Å; Q142-A146 WeakPolarHBondContact O-CB 3.49Å; Q142-A146 PolarHBondContact O-N 2.91Å
143	T	94.8	Very high	94.3	Very high	8 Å²	8	73.4 Å²	73.4	5%	0.049	37%	0.368	C	S	.	.	H	α-helix	trans	-69	-42.6	177.4	-52.8	0	0	0	0	111.5	L139 D140 Y141 A146 I147 A162 K165	L139-T143 HydrophobicContact CD1-CG2 4.26Å; L139-T143 HydrophobicContact CD2-CG2 4.4Å; D140-T143 VanDerWaalsContact CG-OG1 3.23Å; D140-T143 PolarHBondContact O-N 2.97Å; D140-T143 VanDerWaalsContact O-N 3.12Å; D140-T143 WeakPolarHBondContact OD1-CB 3.41Å; D140-T143 PolarHBondContact OD1-N 3.32Å; D140-T143 PolarHBondContact OD1-OG1 3.4Å; D140-T143 PolarHBondContact OD2-OG1 2.91Å; D140-T143 VanDerWaalsContact OD2-OG1 3.1Å; Y141-T143 VanDerWaalsContact C-N 3.28Å; Y141-T143 PolarHBondContact O-N 2.95Å; T143-A146 PolarHBondContact O-N 3.4Å; T143-I147 HydrophobicContact CG2-CD1 4.44Å; T143-I147 WeakPolarHBondContact O-CG1 3.24Å; T143-I147 PolarHBondContact O-N 3.46Å; T143-I147 VanDerWaalsContact O-N 3.14Å; T143-A162 HydrophobicContact CG2-CB 3.98Å; T143-K165 HydrophobicContact CG2-CD 4.32Å; T143-K165 PolarHBondContact OG1-NZ 3.33Å
144	K	95.5	Very high	93.9	Very high	30 Å²	30	73.9 Å²	73.9	13%	0.13	37%	0.37	C	S	.	.	H	α-helix	trans	-61.8	-45.8	176.5	-67.5	-171.9	175.6	-171.2	0	111.3	I129 E136 L139 D140 Y141 A146 I147 I148	I129-K144 HydrophobicContact CG2-CB 4.43Å; I129-K144 HydrophobicContact CG2-CG 4.15Å; E136-K144 IonicContact OE1-NZ 2.81Å; E136-K144 PolarHBondContact OE1-NZ 3.21Å; L139-K144 HydrophobicContact CB-CG 4.01Å; D140-K144 PolarHBondContact O-N 2.71Å; D140-K144 VanDerWaalsContact O-N 3.15Å; Y141-K144 PolarHBondContact O-N 3.22Å; K144-A146 PolarHBondContact O-N 3.07Å; K144-I147 WeakPolarHBondContact O-CB 2.97Å; K144-I147 PolarHBondContact O-N 3.09Å; K144-I148 WeakPolarHBondContact O-CG1 3.38Å; K144-I148 PolarHBondContact O-N 3.45Å
145	D	94.8	Very high	93.7	Very high	59 Å²	59	70.5 Å²	70.5	32%	0.316	35%	0.349	S	S	.	.	H	α-helix	trans	-61.6	-44.4	177.9	-176.8	60.3	0	0	0	112	Y141 I147 I148 Q149	Y141-D145 HydrophobicContact CE1-CB 4.38Å; Y141-D145 PolarHBondContact O-N 2.78Å; D145-I147 VanDerWaalsContact C-N 3.28Å; D145-I147 PolarHBondContact O-N 2.95Å; D145-I148 WeakPolarHBondContact O-CB 3.34Å; D145-I148 PolarHBondContact O-N 3.49Å; D145-I148 VanDerWaalsContact O-N 3.08Å; D145-Q149 WeakPolarHBondContact O-CG 3.12Å; D145-Q149 PolarHBondContact O-N 2.86Å; D145-Q149 PolarHBondContact OD1-NE2 3.41Å
146	A	94.7	Very high	93.5	Very high	60 Å²	60	70.7 Å²	70.7	50%	0.496	35%	0.353	S	S	.	.	H	α-helix	trans	-58.1	-40.2	176	0	0	0	0	0	112.7	Q142 T143 K144 Q149 S150	Q142-A146 WeakPolarHBondContact O-CB 3.49Å; Q142-A146 PolarHBondContact O-N 2.91Å; T143-A146 PolarHBondContact O-N 3.4Å; K144-A146 PolarHBondContact O-N 3.07Å; A146-Q149 PolarHBondContact O-N 2.95Å; A146-S150 PolarHBondContact O-N 2.63Å; A146-S150 VanDerWaalsContact O-N 3.08Å
147	I	95.4	Very high	93.3	Very high	4 Å²	4	71.5 Å²	71.5	2%	0.021	36%	0.363	C	S	.	.	H	α-helix	trans	-63.2	-48.8	174.3	-65.6	165.2	0	0	0	109.9	Y125 I129 L139 T143 K144 D145 Q149 S150 L151 F159 A162	Y125-I147 HydrophobicContact CD2-CG2 4.22Å; I129-I147 HydrophobicContact CD1-CD1 3.91Å; I129-I147 HydrophobicContact CG1-CD1 4.24Å; I129-I147 HydrophobicContact CG2-CD1 4.01Å; I129-I147 HydrophobicContact CG2-CG2 4.42Å; L139-I147 HydrophobicContact CD1-CD1 4.32Å; T143-I147 HydrophobicContact CG2-CD1 4.44Å; T143-I147 WeakPolarHBondContact O-CG1 3.24Å; T143-I147 PolarHBondContact O-N 3.46Å; T143-I147 VanDerWaalsContact O-N 3.14Å; K144-I147 WeakPolarHBondContact O-CB 2.97Å; K144-I147 PolarHBondContact O-N 3.09Å; D145-I147 VanDerWaalsContact C-N 3.28Å; D145-I147 PolarHBondContact O-N 2.95Å; I147-Q149 VanDerWaalsContact C-N 3.28Å; I147-Q149 PolarHBondContact O-N 3.37Å; I147-S150 CarbonylContact O-C 3.58Å; I147-S150 WeakPolarHBondContact O-CA 3.47Å; I147-S150 WeakPolarHBondContact O-CB 3.36Å; I147-S150 PolarHBondContact O-N 2.8Å; I147-S150 PolarHBondContact O-OG 3.2Å; I147-L151 HydrophobicContact CG2-CG 4.43Å; I147-L151 WeakPolarHBondContact O-CG 3.47Å; I147-L151 PolarHBondContact O-N 3.34Å; I147-F159 HydrophobicContact CD1-CD1 4.38Å; I147-F159 HydrophobicContact CG2-CD1 4.14Å; I147-F159 HydrophobicContact CG2-CE1 3.69Å; I147-A162 HydrophobicContact CD1-CB 3.76Å
148	I	94.5	Very high	93.2	Very high	66 Å²	66	72 Å²	72	34%	0.338	37%	0.366	S	S	.	.	H	α-helix	trans	-55.3	-44.1	179.9	-68.1	164.3	0	0	0	111.2	Y125 K144 D145 S150 L151	Y125-I148 HydrophobicContact CD2-CG1 4.46Å; Y125-I148 HydrophobicContact CE2-CD1 4.18Å; Y125-I148 HydrophobicContact CE2-CG1 3.51Å; K144-I148 WeakPolarHBondContact O-CG1 3.38Å; K144-I148 PolarHBondContact O-N 3.45Å; D145-I148 WeakPolarHBondContact O-CB 3.34Å; D145-I148 PolarHBondContact O-N 3.49Å; D145-I148 VanDerWaalsContact O-N 3.08Å; I148-S150 VanDerWaalsContact C-N 3.35Å; I148-S150 PolarHBondContact O-N 3.5Å; I148-L151 PolarHBondContact O-N 3.09Å
149	Q	93.9	Very high	93.3	Very high	81 Å²	81	65.7 Å²	65.7	38%	0.379	33%	0.333	S	S	.	.	H	α-helix	trans	-63.9	-40.8	175.9	-59.2	-51.9	-33.7	0	0	111.8	D145 A146 I147 L151 R152	D145-Q149 WeakPolarHBondContact O-CG 3.12Å; D145-Q149 PolarHBondContact O-N 2.86Å; D145-Q149 PolarHBondContact OD1-NE2 3.41Å; A146-Q149 PolarHBondContact O-N 2.95Å; I147-Q149 VanDerWaalsContact C-N 3.28Å; I147-Q149 PolarHBondContact O-N 3.37Å; Q149-L151 VanDerWaalsContact C-N 3.25Å; Q149-L151 PolarHBondContact O-N 2.87Å; Q149-R152 PolarHBondContact O-N 3.34Å; Q149-R152 VanDerWaalsContact OE1-CZ 3.26Å
150	S	92.1	Very high	93.3	Very high	30 Å²	30	68.5 Å²	68.5	21%	0.21	35%	0.347	C	S	.	.	H	α-helix	trans	-65.9	-23.8	178.7	81.3	0	0	0	0	113.8	A146 I147 I148 R152 L153 P154 C158	A146-S150 PolarHBondContact O-N 2.63Å; A146-S150 VanDerWaalsContact O-N 3.08Å; I147-S150 CarbonylContact O-C 3.58Å; I147-S150 WeakPolarHBondContact O-CA 3.47Å; I147-S150 WeakPolarHBondContact O-CB 3.36Å; I147-S150 PolarHBondContact O-N 2.8Å; I147-S150 PolarHBondContact O-OG 3.2Å; I148-S150 VanDerWaalsContact C-N 3.35Å; I148-S150 PolarHBondContact O-N 3.5Å; S150-R152 PolarHBondContact O-N 2.97Å; S150-L153 CarbonylContact O-C 3.59Å; S150-L153 PolarHBondContact O-N 2.81Å; S150-P154 WeakPolarHBondContact O-CA 3.31Å; S150-C158 PolarHBondContact OG-SG 3.17Å
151	L	91.9	Very high	93.4	Very high	27 Å²	27	69 Å²	69	14%	0.141	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-15.5	178.7	-67.6	176	0	0	0	113.7	A121 Y125 I147 I148 Q149 P154 F159	A121-L151 HydrophobicContact CB-CD2 3.78Å; Y125-L151 HydrophobicContact CD1-CD1 4Å; Y125-L151 HydrophobicContact CD2-CD1 3.6Å; Y125-L151 HydrophobicContact CE2-CD1 4.23Å; Y125-L151 HydrophobicContact CG-CD1 3.47Å; Y125-L151 VanDerWaalsContact CG-CD1 3.47Å; I147-L151 HydrophobicContact CG2-CG 4.43Å; I147-L151 WeakPolarHBondContact O-CG 3.47Å; I147-L151 PolarHBondContact O-N 3.34Å; I148-L151 PolarHBondContact O-N 3.09Å; Q149-L151 VanDerWaalsContact C-N 3.25Å; Q149-L151 PolarHBondContact O-N 2.87Å; L151-P154 WeakPolarHBondContact O-CG 3.25Å; L151-F159 HydrophobicContact CD2-CZ 4.41Å
152	R	89.2	Confident	93.5	Very high	198 Å²	198	60.2 Å²	60.2	75%	0.747	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-39.4	175.2	-63.6	-179.5	-179	-179.4	1.9	111.8	Q149 S150	Q149-R152 PolarHBondContact O-N 3.34Å; Q149-R152 VanDerWaalsContact OE1-CZ 3.26Å; S150-R152 PolarHBondContact O-N 2.97Å
153	L	89	Confident	93.7	Very high	152 Å²	152	53.3 Å²	53.3	80%	0.796	29%	0.289	S	S	*	.	S	Bend	trans	-134.5	83	174	-174.5	65.1	0	0	0	108.8	S150 S155	S150-L153 CarbonylContact O-C 3.59Å; S150-L153 PolarHBondContact O-N 2.81Å; L153-S155 PolarHBondContact O-N 2.87Å
154	P	89.3	Confident	93.8	Very high	22 Å²	22	59.7 Å²	59.7	14%	0.143	32%	0.316	C	S	.	.			trans	-61	134.6	-174.5	-27.1	38	0	0	0	112.4	L117 A121 S150 L151	L117-P154 HydrophobicContact CD2-CB 4.38Å; L117-P154 WeakPolarHBondContact CD2-O 3.35Å; L117-P154 HydrophobicContact CG-CB 4.41Å; A121-P154 HydrophobicContact CB-CB 4.03Å; A121-P154 HydrophobicContact CB-CG 4.28Å; S150-P154 WeakPolarHBondContact O-CA 3.31Å; L151-P154 WeakPolarHBondContact O-CG 3.25Å
155	S	91.3	Very high	93.8	Very high	46 Å²	46	62.1 Å²	62.1	32%	0.322	33%	0.327	S	S	.	.			trans	-128	165.5	172.9	73.5	0	0	0	0	109.3	F108 L153 T157 C158	F108-S155 WeakPolarHBondContact CE1-O 3.34Å; F108-S155 WeakPolarHBondContact CZ-O 3.43Å; L153-S155 PolarHBondContact O-N 2.87Å; S155-T157 PolarHBondContact O-N 3.46Å; S155-T157 PolarHBondContact OG-N 3.42Å; S155-T157 PolarHBondContact OG-OG1 3.41Å; S155-C158 PolarHBondContact N-SG 2.94Å; S155-C158 PolarHBondContact O-N 3.05Å; S155-C158 PolarHBondContact O-SG 2.89Å
156	L	92.3	Very high	94	Very high	73 Å²	73	59.4 Å²	59.4	38%	0.382	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-9.2	175	-60.2	174.8	0	0	0	113.3	F108 L117	F108-L156 VanDerWaalsContact O-CD2 3.24Å; F108-L156 WeakPolarHBondContact O-CD2 3.44Å; L117-L156 HydrophobicContact CD1-CD2 3.67Å
157	T	92.8	Very high	94.1	Very high	91 Å²	91	57.6 Å²	57.6	56%	0.558	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-5.7	-178.7	64	0	0	0	0	114.1	S155 F159 L160	S155-T157 PolarHBondContact O-N 3.46Å; S155-T157 PolarHBondContact OG-N 3.42Å; S155-T157 PolarHBondContact OG-OG1 3.41Å; T157-F159 PolarHBondContact O-N 3.36Å; T157-L160 HydrophobicContact CG2-CD1 3.69Å; T157-L160 PolarHBondContact O-N 2.96Å; T157-L160 VanDerWaalsContact O-N 3.14Å
158	C	93.9	Very high	94.2	Very high	12 Å²	12	60.2 Å²	60.2	8%	0.081	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.6	-41.7	-176.6	-78.8	0	0	0	0	114.1	F108 S150 S155	F108-C158 HydrophobicContact CE1-CB 4.23Å; S150-C158 PolarHBondContact OG-SG 3.17Å; S155-C158 PolarHBondContact N-SG 2.94Å; S155-C158 PolarHBondContact O-N 3.05Å; S155-C158 PolarHBondContact O-SG 2.89Å
159	F	96.6	Very high	94.3	Very high	3 Å²	3	60 Å²	60	1%	0.013	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	2	-172.2	-55.8	-71.6	0	0	0	114.5	F101 C105 F108 A121 I124 I147 L151 T157 S161 A162 Q163	F101-F159 HydrophobicContact CE2-CD1 4.34Å; F101-F159 HydrophobicContact CZ-CB 4.41Å; F101-F159 HydrophobicContact CZ-CD1 4.4Å; C105-F159 HydrophobicContact CB-CB 4.47Å; C105-F159 VanDerWaalsContact SG-CB 3.55Å; F108-F159 AromaticContact CD1-CD2 3.7Å; F108-F159 HydrophobicContact CD1-CD2 3.7Å; F108-F159 HydrophobicContact CD1-CE2 4.04Å; F108-F159 HydrophobicContact CD2-CE2 4.35Å; F108-F159 AromaticContact CE1-CD2 3.75Å; F108-F159 HydrophobicContact CE1-CD2 3.75Å; F108-F159 AromaticContact CE1-CE2 3.85Å; F108-F159 HydrophobicContact CE1-CE2 3.85Å; F108-F159 HydrophobicContact CE2-CE2 4.19Å; F108-F159 HydrophobicContact CG-CD2 4.21Å; F108-F159 HydrophobicContact CG-CE2 4.26Å; F108-F159 HydrophobicContact CZ-CD2 4.31Å; F108-F159 AromaticContact CZ-CE2 3.93Å; F108-F159 HydrophobicContact CZ-CE2 3.93Å; A121-F159 HydrophobicContact CB-CE2 4.2Å; A121-F159 HydrophobicContact CB-CZ 4.24Å; A121-F159 WeakPolarHBondContact O-CZ 3.06Å; I124-F159 HydrophobicContact CB-CE1 4.3Å; I124-F159 HydrophobicContact CB-CE2 4.18Å; I124-F159 HydrophobicContact CB-CZ 3.83Å; I124-F159 HydrophobicContact CD1-CD2 4.39Å; I124-F159 HydrophobicContact CD1-CE2 4Å; I124-F159 HydrophobicContact CG2-CD1 4.08Å; I124-F159 HydrophobicContact CG2-CD2 4.42Å; I124-F159 HydrophobicContact CG2-CE1 3.69Å; I124-F159 HydrophobicContact CG2-CE2 4.06Å; I124-F159 HydrophobicContact CG2-CG 4.43Å; I124-F159 HydrophobicContact CG2-CZ 3.69Å; I147-F159 HydrophobicContact CD1-CD1 4.38Å; I147-F159 HydrophobicContact CG2-CD1 4.14Å; I147-F159 HydrophobicContact CG2-CE1 3.69Å; L151-F159 HydrophobicContact CD2-CZ 4.41Å; T157-F159 PolarHBondContact O-N 3.36Å; F159-S161 VanDerWaalsContact C-N 3.33Å; F159-S161 PolarHBondContact O-N 3.17Å; F159-A162 PolarHBondContact O-N 2.9Å; F159-Q163 VanDerWaalsContact O-CB 3.26Å; F159-Q163 WeakPolarHBondContact O-CB 2.83Å; F159-Q163 PolarHBondContact O-N 3.43Å
160	L	94.8	Very high	94.5	Very high	72 Å²	72	56.2 Å²	56.2	38%	0.377	29%	0.289	S	S	.	.	H	α-helix	trans	-58.5	-42.6	-171.8	-72.2	177.7	0	0	0	113.3	T157 K164	T157-L160 HydrophobicContact CG2-CD1 3.69Å; T157-L160 PolarHBondContact O-N 2.96Å; T157-L160 VanDerWaalsContact O-N 3.14Å; L160-K164 WeakPolarHBondContact O-CB 3.28Å; L160-K164 PolarHBondContact O-N 2.95Å
161	S	95.3	Very high	94.8	Very high	73 Å²	73	57.6 Å²	57.6	51%	0.51	29%	0.292	S	S	.	.	H	α-helix	trans	-64.7	-47.4	179.2	-174.4	0	0	0	0	111.5	F159 K164 K165	F159-S161 VanDerWaalsContact C-N 3.33Å; F159-S161 PolarHBondContact O-N 3.17Å; S161-K164 PolarHBondContact O-N 2.96Å; S161-K165 WeakPolarHBondContact O-CG 3.43Å; S161-K165 PolarHBondContact O-N 2.99Å; S161-K165 VanDerWaalsContact O-N 3.09Å
162	A	97	Very high	95	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-64.6	-43.9	177	0	0	0	0	0	112.5	F101 L139 T143 I147 F159 K164 K165 V166	F101-A162 HydrophobicContact CE1-CB 4.05Å; F101-A162 HydrophobicContact CZ-CB 3.78Å; L139-A162 HydrophobicContact CD1-CB 3.73Å; L139-A162 HydrophobicContact CD2-CB 4.27Å; T143-A162 HydrophobicContact CG2-CB 3.98Å; I147-A162 HydrophobicContact CD1-CB 3.76Å; F159-A162 PolarHBondContact O-N 2.9Å; A162-K164 VanDerWaalsContact C-N 3.29Å; A162-K164 PolarHBondContact O-N 3.33Å; A162-K165 WeakPolarHBondContact O-CB 3.34Å; A162-K165 PolarHBondContact O-N 2.78Å; A162-K165 VanDerWaalsContact O-N 3.09Å; A162-V166 WeakPolarHBondContact O-CG2 3.42Å; A162-V166 PolarHBondContact O-N 3.37Å
163	Q	97.8	Very high	95.4	Very high	11 Å²	11	56.3 Å²	56.3	5%	0.051	30%	0.3	C	S	.	.	H	α-helix	trans	-58	-43.4	177.5	-170.9	-175.3	20.3	0	0	111.2	W102 C105 E106 F159 V166 F167	W102-Q163 HydrophobicContact CG-CG 4.29Å; W102-Q163 PolarHBondContact O-NE2 3.06Å; C105-Q163 HydrophobicContact CB-CB 4.11Å; C105-Q163 VanDerWaalsContact CB-CD 3.43Å; C105-Q163 HydrophobicContact CB-CG 3.79Å; E106-Q163 PolarHBondContact OE1-NE2 3.17Å; F159-Q163 VanDerWaalsContact O-CB 3.26Å; F159-Q163 WeakPolarHBondContact O-CB 2.83Å; F159-Q163 PolarHBondContact O-N 3.43Å; Q163-V166 PolarHBondContact O-N 3.45Å; Q163-F167 VanDerWaalsContact O-CB 3.32Å; Q163-F167 WeakPolarHBondContact O-CB 3.43Å; Q163-F167 PolarHBondContact O-N 3.22Å
164	K	96.9	Very high	95.7	Very high	143 Å²	143	49.2 Å²	49.2	62%	0.622	26%	0.263	S	S	*	.	H	α-helix	trans	-62.6	-41.7	175	-173.8	176.8	-178	178.4	0	112	L160 S161 A162 F167 N168	L160-K164 WeakPolarHBondContact O-CB 3.28Å; L160-K164 PolarHBondContact O-N 2.95Å; S161-K164 PolarHBondContact O-N 2.96Å; A162-K164 VanDerWaalsContact C-N 3.29Å; A162-K164 PolarHBondContact O-N 3.33Å; K164-F167 PolarHBondContact O-N 3.27Å; K164-N168 WeakPolarHBondContact O-CB 3.43Å; K164-N168 PolarHBondContact O-N 3.01Å; K164-N168 PolarHBondContact O-OD1 2.84Å
165	K	97.1	Very high	96.2	Very high	81 Å²	81	49.2 Å²	49.2	35%	0.352	26%	0.26	S	S	.	.	H	α-helix	trans	-63.3	-45.7	177.1	-74.1	-175.7	173.9	-174.3	0	112.1	L139 D140 T143 S161 A162 N168 L169	L139-K165 HydrophobicContact CD2-CB 3.99Å; L139-K165 HydrophobicContact CD2-CD 4.32Å; D140-K165 VanDerWaalsContact CG-NZ 3.34Å; D140-K165 IonicContact OD1-NZ 2.9Å; D140-K165 PolarHBondContact OD1-NZ 3.34Å; D140-K165 IonicContact OD2-NZ 2.69Å; D140-K165 PolarHBondContact OD2-NZ 2.74Å; T143-K165 HydrophobicContact CG2-CD 4.32Å; T143-K165 PolarHBondContact OG1-NZ 3.33Å; S161-K165 WeakPolarHBondContact O-CG 3.43Å; S161-K165 PolarHBondContact O-N 2.99Å; S161-K165 VanDerWaalsContact O-N 3.09Å; A162-K165 WeakPolarHBondContact O-CB 3.34Å; A162-K165 PolarHBondContact O-N 2.78Å; A162-K165 VanDerWaalsContact O-N 3.09Å; K165-N168 PolarHBondContact O-N 3.28Å; K165-L169 WeakPolarHBondContact O-CB 3.37Å; K165-L169 PolarHBondContact O-N 3.32Å
166	V	97.6	Very high	96.5	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-66.9	-39.1	177.9	176.1	0	0	0	0	111.6	N98 F101 I137 L139 A162 Q163 L169 M170	N98-V166 HydrophobicContact CB-CG1 3.7Å; N98-V166 VanDerWaalsContact O-CG1 3.26Å; N98-V166 WeakPolarHBondContact O-CG1 3.42Å; F101-V166 HydrophobicContact CD1-CB 4.09Å; F101-V166 HydrophobicContact CD1-CG1 4.2Å; F101-V166 HydrophobicContact CD1-CG2 3.73Å; F101-V166 HydrophobicContact CE1-CB 4.39Å; F101-V166 HydrophobicContact CE1-CG2 3.89Å; I137-V166 HydrophobicContact CB-CG2 4.44Å; I137-V166 HydrophobicContact CD1-CG2 3.46Å; I137-V166 VanDerWaalsContact CD1-CG2 3.46Å; L139-V166 HydrophobicContact CD2-CG2 4.31Å; A162-V166 WeakPolarHBondContact O-CG2 3.42Å; A162-V166 PolarHBondContact O-N 3.37Å; Q163-V166 PolarHBondContact O-N 3.45Å; V166-L169 WeakPolarHBondContact O-CB 3.43Å; V166-L169 PolarHBondContact O-N 2.78Å; V166-M170 HydrophobicContact CG1-CE 4.18Å; V166-M170 WeakPolarHBondContact O-CG 3.15Å; V166-M170 PolarHBondContact O-N 3.09Å
167	F	98	Very high	96.7	Very high	22 Å²	22	50.5 Å²	50.5	10%	0.096	26%	0.26	C	S	.	.	H	α-helix	trans	-57.7	-51.8	172.4	-179.3	-86.8	0	0	0	111	L73 D74 L77 W102 Q163 K164 L169 M170 E171	L73-F167 HydrophobicContact CB-CE2 4.05Å; L73-F167 HydrophobicContact CB-CZ 3.77Å; L73-F167 HydrophobicContact CD2-CD1 4.47Å; L73-F167 HydrophobicContact CD2-CD2 3.82Å; L73-F167 HydrophobicContact CD2-CE1 4.29Å; L73-F167 HydrophobicContact CD2-CE2 3.65Å; L73-F167 HydrophobicContact CD2-CG 4.25Å; L73-F167 HydrophobicContact CD2-CZ 3.9Å; L73-F167 HydrophobicContact CG-CD2 4.27Å; L73-F167 HydrophobicContact CG-CE2 3.64Å; L73-F167 HydrophobicContact CG-CZ 3.89Å; D74-F167 WeakPolarHBondContact OD2-CZ 3.35Å; L77-F167 HydrophobicContact CD1-CD2 4.11Å; L77-F167 HydrophobicContact CD1-CE2 4.05Å; W102-F167 AromaticContact NE1-CD2 3.66Å; Q163-F167 VanDerWaalsContact O-CB 3.32Å; Q163-F167 WeakPolarHBondContact O-CB 3.43Å; Q163-F167 PolarHBondContact O-N 3.22Å; K164-F167 PolarHBondContact O-N 3.27Å; F167-L169 VanDerWaalsContact C-N 3.28Å; F167-L169 PolarHBondContact O-N 3.38Å; F167-M170 PolarHBondContact O-N 2.97Å; F167-M170 VanDerWaalsContact O-N 3.17Å; F167-E171 HydrophobicContact CE1-CB 4.34Å; F167-E171 WeakPolarHBondContact O-CB 3.47Å; F167-E171 PolarHBondContact O-N 3.21Å
168	N	97.5	Very high	96.9	Very high	60 Å²	60	46.2 Å²	46.2	32%	0.321	23%	0.234	S	C	.	.	H	α-helix	trans	-61.5	-37.3	178.1	-69.5	-5.9	0	0	0	112	K164 K165 E171 N172	K164-N168 WeakPolarHBondContact O-CB 3.43Å; K164-N168 PolarHBondContact O-N 3.01Å; K164-N168 PolarHBondContact O-OD1 2.84Å; K165-N168 PolarHBondContact O-N 3.28Å; N168-E171 PolarHBondContact O-N 3.18Å; N168-N172 WeakPolarHBondContact O-CB 3.39Å; N168-N172 PolarHBondContact O-N 3.43Å; N168-N172 PolarHBondContact O-ND2 3.02Å
169	L	96.8	Very high	97	Very high	61 Å²	61	47 Å²	47	32%	0.319	24%	0.237	S	C	.	.	H	α-helix	trans	-60.8	-48.7	175.2	176.8	64.2	0	0	0	110.7	K165 V166 F167 N173	K165-L169 WeakPolarHBondContact O-CB 3.37Å; K165-L169 PolarHBondContact O-N 3.32Å; V166-L169 WeakPolarHBondContact O-CB 3.43Å; V166-L169 PolarHBondContact O-N 2.78Å; F167-L169 VanDerWaalsContact C-N 3.28Å; F167-L169 PolarHBondContact O-N 3.38Å; L169-N173 WeakPolarHBondContact O-CB 3.2Å; L169-N173 PolarHBondContact O-N 3.08Å; L169-N173 VanDerWaalsContact O-N 3.09Å
170	M	97.7	Very high	96.9	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	27%	0.267	C	S	.	.	I	π-helix	trans	-63.3	-44.1	176.2	-69.9	-172.4	-64.3	0	0	111.5	L73 L77 F86 L90 N98 I99 W102 V166 F167 N172 N173 S174 Y175	L73-M170 HydrophobicContact CD2-CB 3.86Å; L77-M170 HydrophobicContact CD1-CE 4.49Å; F86-M170 HydrophobicContact CE1-CB 4.27Å; F86-M170 HydrophobicContact CE1-CG 4.45Å; F86-M170 HydrophobicContact CE1-SD 3.85Å; F86-M170 HydrophobicContact CZ-CB 4.26Å; L90-M170 HydrophobicContact CD1-SD 4.09Å; N98-M170 HydrophobicContact CB-CG 3.75Å; N98-M170 HydrophobicContact CB-SD 3.71Å; I99-M170 HydrophobicContact CB-SD 3.97Å; I99-M170 HydrophobicContact CD1-CE 4.23Å; I99-M170 HydrophobicContact CD1-SD 4.32Å; W102-M170 HydrophobicContact CB-CE 3.97Å; W102-M170 HydrophobicContact CG-CE 4.17Å; V166-M170 HydrophobicContact CG1-CE 4.18Å; V166-M170 WeakPolarHBondContact O-CG 3.15Å; V166-M170 PolarHBondContact O-N 3.09Å; F167-M170 PolarHBondContact O-N 2.97Å; F167-M170 VanDerWaalsContact O-N 3.17Å; M170-N172 PolarHBondContact O-N 2.92Å; M170-N173 PolarHBondContact O-N 2.63Å; M170-S174 PolarHBondContact O-N 3.22Å; M170-Y175 VanDerWaalsContact O-CB 3.25Å; M170-Y175 WeakPolarHBondContact O-CB 3.1Å; M170-Y175 PolarHBondContact O-N 3.43Å
171	E	98.1	Very high	96.9	Very high	60 Å²	60	50.9 Å²	50.9	28%	0.28	25%	0.254	S	S	.	.	I	π-helix	trans	-62.3	-40.2	-177.9	-173.9	172.5	-130.2	0	0	112.7	L73 F167 N168 P176	L73-E171 HydrophobicContact CB-CB 4.4Å; L73-E171 HydrophobicContact CB-CG 4.31Å; L73-E171 HydrophobicContact CD2-CB 3.8Å; F167-E171 HydrophobicContact CE1-CB 4.34Å; F167-E171 WeakPolarHBondContact O-CB 3.47Å; F167-E171 PolarHBondContact O-N 3.21Å; N168-E171 PolarHBondContact O-N 3.18Å; E171-P176 WeakPolarHBondContact O-CD 3.35Å; E171-P176 WeakPolarHBondContact O-CG 3.39Å
172	N	97	Very high	96.6	Very high	125 Å²	125	52.2 Å²	52.2	67%	0.668	25%	0.253	S	S	*	.	I	π-helix	trans	-90	-15.3	-177	-67.6	-65.1	0	0	0	113.6	N168 M170	N168-N172 WeakPolarHBondContact O-CB 3.39Å; N168-N172 PolarHBondContact O-N 3.43Å; N168-N172 PolarHBondContact O-ND2 3.02Å; M170-N172 PolarHBondContact O-N 2.92Å
173	N	95.9	Very high	96.2	Very high	73 Å²	73	52.5 Å²	52.5	39%	0.39	25%	0.254	S	S	.	.	I	π-helix	trans	-117.8	-69.2	-174	-169.2	42.2	0	0	0	112.8	L169 M170 R177	L169-N173 WeakPolarHBondContact O-CB 3.2Å; L169-N173 PolarHBondContact O-N 3.08Å; L169-N173 VanDerWaalsContact O-N 3.09Å; M170-N173 PolarHBondContact O-N 2.63Å; N173-R177 PolarHBondContact ND2-NH2 3.34Å; N173-R177 PolarHBondContact O-NH1 3.2Å; N173-R177 PolarHBondContact OD1-NH1 3.38Å
174	S	96.8	Very high	95.9	Very high	3 Å²	3	52.7 Å²	52.7	2%	0.021	25%	0.254	C	S	.	.	I	π-helix	trans	-85	-31.6	-169.4	-53.5	0	0	0	0	113	F89 M170 R177 F178	F89-S174 VanDerWaalsContact CE1-O 3.31Å; F89-S174 WeakPolarHBondContact CE1-O 3.32Å; M170-S174 PolarHBondContact O-N 3.22Å; S174-R177 PolarHBondContact O-N 3.27Å; S174-R177 PolarHBondContact OG-NH2 3.36Å; S174-F178 WeakPolarHBondContact O-CB 3.32Å; S174-F178 PolarHBondContact O-N 2.85Å
175	Y	98	Very high	95.6	Very high	21 Å²	21	50.9 Å²	50.9	8%	0.082	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-47.1	-180	171.8	-110.1	0	0	0	113.3	W69 A70 S72 L73 L76 M170 R177 F178 I179	W69-Y175 WeakPolarHBondContact O-CE2 3.44Å; W69-Y175 PolarHBondContact O-OH 3.14Å; A70-Y175 WeakPolarHBondContact CA-OH 3.45Å; A70-Y175 PolarHBondContact O-OH 3.35Å; S72-Y175 WeakPolarHBondContact CA-OH 3.48Å; S72-Y175 PolarHBondContact N-OH 2.87Å; S72-Y175 PolarHBondContact O-OH 3.17Å; L73-Y175 HydrophobicContact CB-CD1 4.29Å; L73-Y175 HydrophobicContact CB-CD2 4.26Å; L73-Y175 HydrophobicContact CB-CE2 4.48Å; L73-Y175 HydrophobicContact CB-CG 4.15Å; L73-Y175 HydrophobicContact CD1-CD2 3.8Å; L73-Y175 HydrophobicContact CD1-CE2 4.47Å; L73-Y175 HydrophobicContact CD1-CG 4.13Å; L76-Y175 HydrophobicContact CB-CE2 4.27Å; L76-Y175 HydrophobicContact CD2-CD2 3.66Å; L76-Y175 HydrophobicContact CD2-CE2 3.74Å; M170-Y175 VanDerWaalsContact O-CB 3.25Å; M170-Y175 WeakPolarHBondContact O-CB 3.1Å; M170-Y175 PolarHBondContact O-N 3.43Å; Y175-R177 VanDerWaalsContact C-N 3.27Å; Y175-R177 PolarHBondContact O-N 3.06Å; Y175-F178 WeakPolarHBondContact O-CB 3.42Å; Y175-F178 PolarHBondContact O-N 3.13Å; Y175-F178 VanDerWaalsContact O-N 3.09Å; Y175-I179 HydrophobicContact CD2-CD1 4.45Å; Y175-I179 HydrophobicContact CD2-CG1 4.14Å; Y175-I179 HydrophobicContact CE1-CG1 4.38Å; Y175-I179 HydrophobicContact CE2-CD1 3.73Å; Y175-I179 HydrophobicContact CE2-CG1 3.65Å; Y175-I179 PolarHBondContact O-N 3.29Å
176	P	97.7	Very high	95.1	Very high	53 Å²	53	48.9 Å²	48.9	34%	0.344	24%	0.238	S	C	.	.	H	α-helix	trans	-62	-38.9	176.5	-22.3	35.3	0	0	0	110.9	E171 F178 I179 H180	E171-P176 WeakPolarHBondContact O-CD 3.35Å; E171-P176 WeakPolarHBondContact O-CG 3.39Å; P176-F178 PolarHBondContact O-N 3.45Å; P176-I179 PolarHBondContact O-N 3.24Å; P176-H180 PolarHBondContact O-N 3.45Å; P176-H180 PolarHBondContact O-ND1 3.3Å
177	R	97.2	Very high	94.7	Very high	94 Å²	94	49.4 Å²	49.4	36%	0.355	24%	0.241	S	C	.	.	H	α-helix	trans	-64.4	-39	174.5	-67.5	-162.4	-63.2	-87.7	-3.7	112.4	F89 E93 N173 S174 Y175 H180 S181	F89-R177 HydrophobicContact CE1-CB 4.2Å; F89-R177 HydrophobicContact CZ-CB 3.69Å; E93-R177 IonicContact OE1-CZ 2.59Å; E93-R177 IonicContact OE1-NE 3.38Å; E93-R177 PolarHBondContact OE1-NE 2.84Å; E93-R177 IonicContact OE2-CZ 3.14Å; E93-R177 IonicContact OE2-NE 2.91Å; E93-R177 PolarHBondContact OE2-NE 3.31Å; E93-R177 VanDerWaalsContact OE2-NE 3.08Å; E93-R177 IonicContact OE2-NH2 2.75Å; E93-R177 PolarHBondContact OE2-NH2 3.37Å; N173-R177 PolarHBondContact ND2-NH2 3.34Å; N173-R177 PolarHBondContact O-NH1 3.2Å; N173-R177 PolarHBondContact OD1-NH1 3.38Å; S174-R177 PolarHBondContact O-N 3.27Å; S174-R177 PolarHBondContact OG-NH2 3.36Å; Y175-R177 VanDerWaalsContact C-N 3.27Å; Y175-R177 PolarHBondContact O-N 3.06Å; R177-H180 CarbonylContact O-C 3.47Å; R177-H180 PolarHBondContact O-N 3.05Å; R177-S181 WeakPolarHBondContact O-CB 3.24Å; R177-S181 PolarHBondContact O-N 2.8Å
178	F	96.9	Very high	94.2	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-49.7	175.3	168.9	-107	0	0	0	111.7	L76 A85 F86 F89 S174 Y175 P176 H180 S181 L183 Y184	L76-F178 HydrophobicContact CD1-CE1 3.69Å; L76-F178 HydrophobicContact CD1-CZ 4.23Å; L76-F178 HydrophobicContact CD2-CD1 3.82Å; L76-F178 HydrophobicContact CD2-CE1 3.75Å; L76-F178 HydrophobicContact CG-CE1 4.43Å; A85-F178 HydrophobicContact CB-CE2 4.23Å; A85-F178 HydrophobicContact CB-CZ 4.04Å; F86-F178 HydrophobicContact CD2-CB 3.77Å; F86-F178 AromaticContact CD2-CD1 3.92Å; F86-F178 HydrophobicContact CD2-CD1 3.92Å; F86-F178 HydrophobicContact CD2-CD2 4.06Å; F86-F178 AromaticContact CD2-CG 3.63Å; F86-F178 HydrophobicContact CD2-CG 3.63Å; F86-F178 HydrophobicContact CE2-CB 3.75Å; F86-F178 HydrophobicContact CE2-CD1 4.5Å; F86-F178 HydrophobicContact CE2-CG 4.14Å; F89-F178 HydrophobicContact CB-CD2 3.58Å; F89-F178 HydrophobicContact CB-CE2 4.22Å; F89-F178 HydrophobicContact CB-CG 4.49Å; F89-F178 HydrophobicContact CD1-CB 3.71Å; F89-F178 HydrophobicContact CD1-CD2 4.23Å; F89-F178 HydrophobicContact CD1-CG 4.42Å; F89-F178 HydrophobicContact CD2-CB 4.37Å; F89-F178 HydrophobicContact CD2-CD2 4.07Å; F89-F178 HydrophobicContact CE1-CB 3.9Å; F89-F178 HydrophobicContact CG-CB 3.96Å; F89-F178 AromaticContact CG-CD2 3.68Å; F89-F178 HydrophobicContact CG-CD2 3.68Å; F89-F178 HydrophobicContact CG-CG 4.29Å; F89-F178 HydrophobicContact CZ-CB 4.31Å; S174-F178 WeakPolarHBondContact O-CB 3.32Å; S174-F178 PolarHBondContact O-N 2.85Å; Y175-F178 WeakPolarHBondContact O-CB 3.42Å; Y175-F178 PolarHBondContact O-N 3.13Å; Y175-F178 VanDerWaalsContact O-N 3.09Å; P176-F178 PolarHBondContact O-N 3.45Å; F178-H180 PolarHBondContact O-N 3.1Å; F178-S181 VanDerWaalsContact O-CB 3.24Å; F178-S181 WeakPolarHBondContact O-CB 3.42Å; F178-S181 PolarHBondContact O-N 2.68Å; F178-S181 PolarHBondContact O-OG 3.12Å; F178-L183 HydrophobicContact CD2-CD2 4.48Å; F178-L183 HydrophobicContact CE2-CD2 4.16Å; F178-L183 HydrophobicContact CE2-CG 4.4Å; F178-Y184 AromaticContact CE1-CD2 3.73Å; F178-Y184 HydrophobicContact CE1-CD2 3.73Å; F178-Y184 HydrophobicContact CE1-CE2 4.37Å; F178-Y184 HydrophobicContact CE1-CG 4.43Å; F178-Y184 AromaticContact CZ-CD2 3.81Å; F178-Y184 HydrophobicContact CZ-CD2 3.81Å; F178-Y184 WeakPolarHBondContact O-CB 3.39Å
179	I	97	Very high	93.7	Very high	29 Å²	29	47.1 Å²	47.1	15%	0.149	23%	0.234	C	C	.	.	H	α-helix	trans	-62.9	-31.3	-179.7	-61.3	-55.8	0	0	0	112.1	A70 Y175 P176 Y184	A70-I179 HydrophobicContact CB-CD1 4.1Å; A70-I179 HydrophobicContact CB-CG2 3.91Å; Y175-I179 HydrophobicContact CD2-CD1 4.45Å; Y175-I179 HydrophobicContact CD2-CG1 4.14Å; Y175-I179 HydrophobicContact CE1-CG1 4.38Å; Y175-I179 HydrophobicContact CE2-CD1 3.73Å; Y175-I179 HydrophobicContact CE2-CG1 3.65Å; Y175-I179 PolarHBondContact O-N 3.29Å; P176-I179 PolarHBondContact O-N 3.24Å; I179-Y184 HydrophobicContact CD1-CD1 4.44Å; I179-Y184 HydrophobicContact CD1-CD2 4.16Å; I179-Y184 HydrophobicContact CD1-CE1 4.23Å; I179-Y184 HydrophobicContact CD1-CE2 3.97Å; I179-Y184 HydrophobicContact CD1-CG 4.39Å; I179-Y184 HydrophobicContact CG2-CD1 4.28Å; I179-Y184 HydrophobicContact CG2-CE1 4.06Å; I179-Y184 WeakPolarHBondContact O-CD1 3.25Å
180	H	94.9	Very high	93.1	Very high	139 Å²	139	44.5 Å²	44.5	64%	0.644	22%	0.22	S	C	*	.	H	α-helix	trans	-89.3	-3.7	176	-64.1	90.7	0	0	0	113.9	P176 R177 F178 K185	P176-H180 PolarHBondContact O-N 3.45Å; P176-H180 PolarHBondContact O-ND1 3.3Å; R177-H180 CarbonylContact O-C 3.47Å; R177-H180 PolarHBondContact O-N 3.05Å; F178-H180 PolarHBondContact O-N 3.1Å; H180-K185 WeakPolarHBondContact O-CE 3.28Å
181	S	93.4	Very high	92.5	Very high	17 Å²	17	45.3 Å²	45.3	12%	0.119	23%	0.227	C	C	.	.	S	Bend	trans	-72.7	154.3	-175.6	74.8	0	0	0	0	112.5	R177 F178 L183 Y184 K185	R177-S181 WeakPolarHBondContact O-CB 3.24Å; R177-S181 PolarHBondContact O-N 2.8Å; F178-S181 VanDerWaalsContact O-CB 3.24Å; F178-S181 WeakPolarHBondContact O-CB 3.42Å; F178-S181 PolarHBondContact O-N 2.68Å; F178-S181 PolarHBondContact O-OG 3.12Å; S181-L183 PolarHBondContact O-N 3.42Å; S181-L183 PolarHBondContact OG-N 2.75Å; S181-Y184 PolarHBondContact O-N 3.13Å; S181-Y184 PolarHBondContact OG-N 3.37Å; S181-K185 WeakPolarHBondContact O-CG 3.3Å; S181-K185 PolarHBondContact O-N 2.9Å; S181-K185 VanDerWaalsContact O-N 3.09Å
182	E	90.3	Very high	91.8	Very high	102 Å²	102	48 Å²	48	48%	0.477	24%	0.235	S	C	.	.	H	α-helix	trans	-60.4	-30.2	171.8	-64.3	-57.8	121.1	0	0	112.4	K185 E186	E182-K185 IonicContact OE1-NZ 3.96Å; E182-K185 PolarHBondContact OE1-NZ 3.44Å; E182-E186 WeakPolarHBondContact O-CB 3.42Å; E182-E186 PolarHBondContact O-N 3.11Å
183	L	88.4	Confident	90.9	Very high	7 Å²	7	44.9 Å²	44.9	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-60.3	-50.2	175	167.8	61.7	0	0	0	111.1	I38 I88 F89 F178 S181 E186 L187	I38-L183 HydrophobicContact CD1-CD1 3.31Å; I38-L183 HydrophobicContact CG1-CD1 3.33Å; I88-L183 HydrophobicContact CG2-CD2 4.15Å; F89-L183 HydrophobicContact CB-CD2 3.85Å; F89-L183 HydrophobicContact CD2-CD2 4.4Å; F178-L183 HydrophobicContact CD2-CD2 4.48Å; F178-L183 HydrophobicContact CE2-CD2 4.16Å; F178-L183 HydrophobicContact CE2-CG 4.4Å; S181-L183 PolarHBondContact O-N 3.42Å; S181-L183 PolarHBondContact OG-N 2.75Å; L183-E186 PolarHBondContact O-N 3.05Å; L183-L187 HydrophobicContact CD1-CD1 4.13Å; L183-L187 HydrophobicContact CD1-CG 4.48Å; L183-L187 HydrophobicContact CG-CD1 4.33Å; L183-L187 WeakPolarHBondContact O-CG 3.43Å; L183-L187 PolarHBondContact O-N 2.53Å
184	Y	91	Very high	89.9	Confident	14 Å²	14	47.1 Å²	47.1	6%	0.055	24%	0.24	C	C	.	.	H	α-helix	trans	-67.9	-41.9	179.5	-177.8	-102.7	0	0	0	111.6	V66 W69 A70 F178 I179 S181 E186 L187 C188	V66-Y184 HydrophobicContact CG1-CE2 3.73Å; V66-Y184 PolarHBondContact O-OH 3.19Å; W69-Y184 HydrophobicContact CB-CE2 4.15Å; W69-Y184 HydrophobicContact CE3-CD2 4.44Å; W69-Y184 HydrophobicContact CE3-CE2 4.05Å; A70-Y184 HydrophobicContact CB-CE1 4.35Å; A70-Y184 WeakPolarHBondContact CB-OH 3.34Å; F178-Y184 AromaticContact CE1-CD2 3.73Å; F178-Y184 HydrophobicContact CE1-CD2 3.73Å; F178-Y184 HydrophobicContact CE1-CE2 4.37Å; F178-Y184 HydrophobicContact CE1-CG 4.43Å; F178-Y184 AromaticContact CZ-CD2 3.81Å; F178-Y184 HydrophobicContact CZ-CD2 3.81Å; F178-Y184 WeakPolarHBondContact O-CB 3.39Å; I179-Y184 HydrophobicContact CD1-CD1 4.44Å; I179-Y184 HydrophobicContact CD1-CD2 4.16Å; I179-Y184 HydrophobicContact CD1-CE1 4.23Å; I179-Y184 HydrophobicContact CD1-CE2 3.97Å; I179-Y184 HydrophobicContact CD1-CG 4.39Å; I179-Y184 HydrophobicContact CG2-CD1 4.28Å; I179-Y184 HydrophobicContact CG2-CE1 4.06Å; I179-Y184 WeakPolarHBondContact O-CD1 3.25Å; S181-Y184 PolarHBondContact O-N 3.13Å; S181-Y184 PolarHBondContact OG-N 3.37Å; Y184-E186 VanDerWaalsContact C-N 3.29Å; Y184-E186 PolarHBondContact O-N 2.85Å; Y184-L187 WeakPolarHBondContact O-CB 3.33Å; Y184-L187 PolarHBondContact O-N 2.6Å; Y184-L187 VanDerWaalsContact O-N 3.08Å; Y184-C188 WeakPolarHBondContact CE1-SG 3.49Å; Y184-C188 PolarHBondContact O-N 3.09Å; Y184-C188 PolarHBondContact O-SG 3.28Å
185	K	90.9	Very high	88.2	Confident	105 Å²	105	47.9 Å²	47.9	46%	0.457	25%	0.248	S	C	.	.	H	α-helix	trans	-57.1	-41.8	174.8	-67.5	176.2	-165.9	167.6	0	112.4	H180 S181 E182 C188 A189	H180-K185 WeakPolarHBondContact O-CE 3.28Å; S181-K185 WeakPolarHBondContact O-CG 3.3Å; S181-K185 PolarHBondContact O-N 2.9Å; S181-K185 VanDerWaalsContact O-N 3.09Å; E182-K185 IonicContact OE1-NZ 3.96Å; E182-K185 PolarHBondContact OE1-NZ 3.44Å; K185-C188 PolarHBondContact O-N 3.22Å; K185-A189 PolarHBondContact O-N 3.44Å
186	E	86.9	Confident	86.1	Confident	39 Å²	39	55.5 Å²	55.5	18%	0.182	28%	0.281	C	S	.	.	H	α-helix	trans	-65.8	-42.2	175.6	-178	152.3	145.7	0	0	111.7	W34 I38 E182 L183 Y184 C188 A189 V190	W34-E186 WeakPolarHBondContact CH2-OE2 3.33Å; W34-E186 HydrophobicContact CZ3-CB 4.48Å; W34-E186 HydrophobicContact CZ3-CG 4.31Å; W34-E186 VanDerWaalsContact CZ3-OE1 3.28Å; W34-E186 WeakPolarHBondContact CZ3-OE1 3.49Å; W34-E186 WeakPolarHBondContact CZ3-OE2 3.43Å; I38-E186 HydrophobicContact CD1-CB 4.39Å; I38-E186 HydrophobicContact CD1-CG 4.25Å; E182-E186 WeakPolarHBondContact O-CB 3.42Å; E182-E186 PolarHBondContact O-N 3.11Å; L183-E186 PolarHBondContact O-N 3.05Å; Y184-E186 VanDerWaalsContact C-N 3.29Å; Y184-E186 PolarHBondContact O-N 2.85Å; E186-C188 VanDerWaalsContact C-N 3.29Å; E186-C188 PolarHBondContact O-N 3.2Å; E186-A189 PolarHBondContact O-N 3.06Å; E186-V190 HydrophobicContact CG-CG2 4.13Å; E186-V190 VanDerWaalsContact O-CB 3.24Å; E186-V190 WeakPolarHBondContact O-CB 3.35Å; E186-V190 VanDerWaalsContact O-CG2 3.25Å; E186-V190 WeakPolarHBondContact O-CG2 3.22Å; E186-V190 PolarHBondContact O-N 3.45Å
187	L	87.4	Confident	83.9	Confident	12 Å²	12	61 Å²	61	6%	0.063	30%	0.296	C	S	.	.	H	α-helix	trans	-59.2	-40.3	174.8	-70.6	167.3	0	0	0	111.7	W69 A85 L183 Y184 A191	W69-L187 HydrophobicContact CZ3-CD1 4.3Å; A85-L187 HydrophobicContact CB-CD1 3.71Å; L183-L187 HydrophobicContact CD1-CD1 4.13Å; L183-L187 HydrophobicContact CD1-CG 4.48Å; L183-L187 HydrophobicContact CG-CD1 4.33Å; L183-L187 WeakPolarHBondContact O-CG 3.43Å; L183-L187 PolarHBondContact O-N 2.53Å; Y184-L187 WeakPolarHBondContact O-CB 3.33Å; Y184-L187 PolarHBondContact O-N 2.6Å; Y184-L187 VanDerWaalsContact O-N 3.08Å; L187-A191 WeakPolarHBondContact O-CB 3.48Å; L187-A191 PolarHBondContact O-N 3.28Å
188	C	88.7	Confident	81.5	Confident	15 Å²	15	64.2 Å²	64.2	10%	0.101	32%	0.32	C	S	.	.	H	α-helix	trans	-64.7	-45.3	174.1	-58.5	0	0	0	0	112.4	V66 Y184 K185 E186 V190 A191 R192	V66-C188 HydrophobicContact CG1-CB 4.34Å; V66-C188 WeakPolarHBondContact CG1-SG 3.39Å; Y184-C188 WeakPolarHBondContact CE1-SG 3.49Å; Y184-C188 PolarHBondContact O-N 3.09Å; Y184-C188 PolarHBondContact O-SG 3.28Å; K185-C188 PolarHBondContact O-N 3.22Å; E186-C188 VanDerWaalsContact C-N 3.29Å; E186-C188 PolarHBondContact O-N 3.2Å; C188-V190 VanDerWaalsContact C-N 3.34Å; C188-A191 PolarHBondContact O-N 2.86Å; C188-R192 PolarHBondContact O-N 3.27Å
189	A	86.8	Confident	80.7	Confident	20 Å²	20	67.5 Å²	67.5	17%	0.165	34%	0.336	C	S	.	.	H	α-helix	trans	-63.5	-42.3	178	0	0	0	0	0	111.4	K185 E186 R192 G193 E194 G195	K185-A189 PolarHBondContact O-N 3.44Å; E186-A189 PolarHBondContact O-N 3.06Å; A189-R192 PolarHBondContact O-N 3.25Å; A189-G193 PolarHBondContact O-N 2.91Å; A189-E194 CarbonylContact O-C 3.55Å; A189-E194 PolarHBondContact O-N 3.22Å; A189-G195 PolarHBondContact O-N 3.29Å
190	V	83.9	Confident	79.9	Confident	6 Å²	6	69.5 Å²	69.5	4%	0.036	35%	0.346	C	S	.	.	H	α-helix	trans	-56.7	-54.3	171.3	160	0	0	0	0	108.9	R60 E186 C188 R192 G193 L198	R60-V190 HydrophobicContact CG-CG1 4.39Å; R60-V190 PolarHBondContact NE-O 3.34Å; R60-V190 VanDerWaalsContact NE-O 3.13Å; R60-V190 PolarHBondContact NH1-O 2.94Å; R60-V190 VanDerWaalsContact NH2-CA 3.3Å; R60-V190 PolarHBondContact NH2-O 3.47Å; E186-V190 HydrophobicContact CG-CG2 4.13Å; E186-V190 VanDerWaalsContact O-CB 3.24Å; E186-V190 WeakPolarHBondContact O-CB 3.35Å; E186-V190 VanDerWaalsContact O-CG2 3.25Å; E186-V190 WeakPolarHBondContact O-CG2 3.22Å; E186-V190 PolarHBondContact O-N 3.45Å; C188-V190 VanDerWaalsContact C-N 3.34Å; V190-R192 PolarHBondContact O-N 3.45Å; V190-R192 VanDerWaalsContact O-N 3.12Å; V190-G193 PolarHBondContact O-N 3.39Å; V190-L198 HydrophobicContact CG1-CD1 4.11Å; V190-L198 HydrophobicContact CG2-CD1 4.32Å
191	A	85.4	Confident	79	Confident	17 Å²	17	65.6 Å²	65.6	14%	0.14	33%	0.329	C	S	.	.	H	α-helix	trans	-55.9	-34.9	179.9	0	0	0	0	0	113.5	V63 V66 L187 C188 G193	V63-A191 VanDerWaalsContact CG2-C 3.41Å; V63-A191 HydrophobicContact CG2-CB 3.96Å; V63-A191 WeakPolarHBondContact CG2-O 3.32Å; V66-A191 HydrophobicContact CB-CB 4.47Å; V66-A191 HydrophobicContact CG2-CB 3.94Å; L187-A191 WeakPolarHBondContact O-CB 3.48Å; L187-A191 PolarHBondContact O-N 3.28Å; C188-A191 PolarHBondContact O-N 2.86Å; A191-G193 VanDerWaalsContact C-N 3.31Å; A191-G193 PolarHBondContact O-N 3.04Å
192	R	83.9	Confident	78.2	Confident	118 Å²	118	68.5 Å²	68.5	45%	0.445	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-6.2	175.9	-69.7	-169.8	-61.4	-86.7	-1.2	115.2	V63 C188 A189 V190 E194	V63-R192 HydrophobicContact CG1-CG 4.22Å; V63-R192 HydrophobicContact CG2-CB 4.4Å; V63-R192 HydrophobicContact CG2-CG 3.76Å; C188-R192 PolarHBondContact O-N 3.27Å; A189-R192 PolarHBondContact O-N 3.25Å; V190-R192 PolarHBondContact O-N 3.45Å; V190-R192 VanDerWaalsContact O-N 3.12Å; R192-E194 VanDerWaalsContact C-N 3.28Å; R192-E194 HydrophobicContact CB-CG 4.09Å; R192-E194 IonicContact CZ-OE2 3.61Å; R192-E194 IonicContact NE-OE2 2.85Å; R192-E194 PolarHBondContact NE-OE2 3.24Å; R192-E194 IonicContact NH2-OE2 3.44Å; R192-E194 PolarHBondContact NH2-OE2 3.26Å
193	G	78.3	Confident	77.4	Confident	58 Å²	58	66.4 Å²	66.4	60%	0.598	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	7.1	-174	0	0	0	0	0	114.4	A189 V190 A191	A189-G193 PolarHBondContact O-N 2.91Å; V190-G193 PolarHBondContact O-N 3.39Å; A191-G193 VanDerWaalsContact C-N 3.31Å; A191-G193 PolarHBondContact O-N 3.04Å
194	E	73.3	Confident	76.7	Confident	121 Å²	121	70.3 Å²	70.3	57%	0.565	35%	0.353	S	S	*	.			trans	-98.4	0.9	-178	-60.5	170.7	164.9	0	0	112.8	A189 R192 K196	A189-E194 CarbonylContact O-C 3.55Å; A189-E194 PolarHBondContact O-N 3.22Å; R192-E194 VanDerWaalsContact C-N 3.28Å; R192-E194 HydrophobicContact CB-CG 4.09Å; R192-E194 IonicContact CZ-OE2 3.61Å; R192-E194 IonicContact NE-OE2 2.85Å; R192-E194 PolarHBondContact NE-OE2 3.24Å; R192-E194 IonicContact NH2-OE2 3.44Å; R192-E194 PolarHBondContact NH2-OE2 3.26Å; E194-K196 PolarHBondContact O-N 3.07Å
195	G	61.9	Low	75.7	Confident	18 Å²	18	74.4 Å²	74.4	19%	0.186	37%	0.374	C	S	.	.			trans	-58.9	112.8	-177.8	0	0	0	0	0	110.9	A189 Y197	A189-G195 PolarHBondContact O-N 3.29Å; G195-Y197 PolarHBondContact O-N 3.31Å
196	K	54.4	Low	74.5	Confident	181 Å²	181	72 Å²	72	79%	0.787	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-6.6	-172.4	-78.8	-171.9	174.1	-179.4	0	115.7	E194	E194-K196 PolarHBondContact O-N 3.07Å
197	Y	51.5	Low	73.5	Confident	169 Å²	169	74.8 Å²	74.8	66%	0.663	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-154.9	62.3	-175	-62.7	-76.6	0	0	0	113.3	G195	G195-Y197 PolarHBondContact O-N 3.31Å
198	L	46.3	Very low	72.2	Confident	162 Å²	162	80.5 Å²	80.5	85%	0.848	41%	0.412	S	S	*	.			trans	-105.1	0	147.5	-79	173.3	0	0	0	109.2	L42 V190	L42-L198 HydrophobicContact CD1-CD1 4.32Å; L42-L198 HydrophobicContact CD1-CD2 3.74Å; V190-L198 HydrophobicContact CG1-CD1 4.11Å; V190-L198 HydrophobicContact CG2-CD1 4.32Å

Retrieved 198 of 198 residues in 1726.2 ms (Link to these results)

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