X2JD86_DROME Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession X2JD86, Species DROME (Drosophila melanogaster, Fruit fly), Gene Cdkl, Length 421 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	27.2	Very low	28.7	Very low	233 Å²	233	191.4 Å²	191.4	100%	1.148	88%	0.882	S	S	*	*				0	91.3	0	-72.9	178.2	-163.5	0	0	107.8
2	D	34	Very low	28.4	Very low	145 Å²	145	188.1 Å²	188.1	78%	0.775	88%	0.875	S	S	*	*			trans	23.6	122.6	139.9	-49.3	-54.6	0	0	0	119.1
3	K	27.6	Very low	28.6	Very low	197 Å²	197	189 Å²	189	86%	0.857	88%	0.875	S	S	*	*			trans	174.2	63.9	134.9	-99.3	175.4	-179.6	-176.1	0	112.6
4	W	26.9	Very low	28.7	Very low	260 Å²	260	180.5 Å²	180.5	99%	0.985	86%	0.864	S	S	*	*			trans	-148.5	26.7	160.1	-83.3	95.9	0	0	0	112.6
5	F	30.5	Very low	29.1	Very low	221 Å²	221	178.7 Å²	178.7	97%	0.969	86%	0.862	S	S	*	*			trans	-103.9	105.7	165.4	-81.6	-80.4	0	0	0	108.5
6	G	25.9	Very low	29.1	Very low	72 Å²	72	179.1 Å²	179.1	74%	0.742	86%	0.861	S	S	*	*			trans	-163.2	76.9	179.5	0	0	0	0	0	110.5
7	E	29.6	Very low	29.5	Very low	176 Å²	176	174.9 Å²	174.9	82%	0.822	84%	0.844	S	S	*	*			trans	25.9	115.9	154.7	-62.4	-177.2	139.5	0	0	120.7
8	K	27.6	Very low	29.6	Very low	216 Å²	216	171.2 Å²	171.2	94%	0.939	84%	0.836	S	S	*	*				-152.1	123.1	119	-104.2	172.8	-171	-178.1	0	109.9
9	R	30.7	Very low	30.2	Very low	202 Å²	202	170.5 Å²	170.5	76%	0.762	84%	0.835	S	S	*	*			trans	-64.3	126.2	-173.9	-72.5	172.5	170.9	-179.1	-4.2	112.3
10	L	25.7	Very low	30.8	Very low	177 Å²	177	167.2 Å²	167.2	93%	0.927	82%	0.821	S	S	*	*			trans	-134.1	103.2	142.2	-109	117.3	0	0	0	108.1
11	W	29.8	Very low	31.1	Very low	206 Å²	206	163.6 Å²	163.6	78%	0.78	81%	0.81	S	S	*	*			trans	-85	106.5	179.9	-81	86.8	0	0	0	109.9
12	L	25.3	Very low	31.9	Very low	152 Å²	152	164.7 Å²	164.7	80%	0.796	80%	0.802	S	S	*	*			trans	-143.8	87.2	153.5	-77	177	0	0	0	108.6
13	F	30.7	Very low	32.5	Very low	200 Å²	200	166.2 Å²	166.2	88%	0.877	80%	0.796	S	S	*	*	S	Bend	trans	51.9	101.2	162	-63.5	-80.8	0	0	0	119.6
14	G	29.7	Very low	33	Very low	70 Å²	70	162.2 Å²	162.2	72%	0.722	79%	0.791	S	S	*	*				89.4	57.4	127.7	0	0	0	0	0	117.8	H16	G14-H16 VanDerWaalsContact C-N 3.26Å; G14-H16 PolarHBondContact O-N 3.42Å
15	N	35	Very low	33.9	Very low	154 Å²	154	159.8 Å²	159.8	82%	0.824	79%	0.79	S	S	*	*			trans	-68.9	83.3	159.6	-84.6	-22.8	0	0	0	110.2
16	H	29.3	Very low	34.4	Very low	185 Å²	185	152.9 Å²	152.9	86%	0.856	78%	0.782	S	S	*	*			trans	-168.8	72.7	150	-83.3	-56.4	0	0	0	107.5	G14	G14-H16 VanDerWaalsContact C-N 3.26Å; G14-H16 PolarHBondContact O-N 3.42Å
17	L	35.3	Very low	35.1	Very low	108 Å²	108	153.2 Å²	153.2	57%	0.565	77%	0.773	S	S	*	*			trans	-70.8	129.9	146	-109.8	84	0	0	0	105.2	L19	L17-L19 VanDerWaalsContact C-N 3.34Å; L17-L19 PolarHBondContact O-N 3.26Å
18	P	32.2	Very low	35.9	Very low	107 Å²	107	149.4 Å²	149.4	70%	0.695	77%	0.765	S	S	*	*			trans	-54.1	112.4	155.4	-11.2	24.8	0	0	0	104.6	L20	P18-L20 PolarHBondContact O-N 2.79Å
19	L	41.3	Very low	36.9	Very low	158 Å²	158	143 Å²	143	83%	0.827	74%	0.737	S	S	*	*			trans	-43.7	121.3	156.1	-74.4	164.9	0	0	0	104.2	L17	L17-L19 VanDerWaalsContact C-N 3.34Å; L17-L19 PolarHBondContact O-N 3.26Å
20	L	42.2	Very low	37.8	Very low	104 Å²	104	138.9 Å²	138.9	55%	0.545	73%	0.728	S	S	.	*	S	Bend	trans	-28.8	117.9	179.6	-72.5	164.5	0	0	0	108.2	P18 R22 V98	P18-L20 PolarHBondContact O-N 2.79Å; L20-R22 PolarHBondContact O-N 3.22Å; L20-V98 HydrophobicContact CD1-CG1 4.46Å
21	P	35.9	Very low	39.8	Very low	93 Å²	93	136 Å²	136	60%	0.604	71%	0.714	S	S	*	*			trans	-50.1	124.6	-168.2	14	-27.4	0	0	0	108.3	R23	P21-R23 PolarHBondContact O-N 3.33Å
22	R	44.7	Very low	42.4	Very low	255 Å²	255	128.2 Å²	128.2	96%	0.962	68%	0.684	S	S	*	*			trans	-59.6	94	167.8	-96.8	-172	169.1	-169.7	-1.3	105.4	L20	L20-R22 PolarHBondContact O-N 3.22Å
23	R	46.8	Very low	45.6	Very low	177 Å²	177	123 Å²	123	67%	0.668	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-70.4	144.5	-176.7	-83.9	-175.3	177.2	-175.3	-1.6	109.6	P21	P21-R23 PolarHBondContact O-N 3.33Å
24	P	37.5	Very low	48.6	Very low	114 Å²	114	116.2 Å²	116.2	74%	0.74	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-58.4	147.7	169.8	-14	27.5	0	0	0	110	G26	P24-G26 PolarHBondContact O-N 3.42Å
25	Q	46.6	Very low	51.7	Low	208 Å²	208	118.8 Å²	118.8	97%	0.972	62%	0.617	S	S	*	*	S	Bend	trans	-52.7	118.9	166.1	-79.5	168.1	-28.2	0	0	109
26	G	41.7	Very low	54.6	Low	77 Å²	77	115.1 Å²	115.1	79%	0.794	60%	0.597	S	S	*	*			trans	130.4	62.4	173.2	0	0	0	0	0	115.5	P24	P24-G26 PolarHBondContact O-N 3.42Å
27	S	39.2	Very low	57.7	Low	78 Å²	78	108.8 Å²	108.8	55%	0.545	57%	0.573	S	S	.	*			trans	-156.4	119	150.9	135.2	0	0	0	0	107.7	K29	S27-K29 PolarHBondContact O-N 3.04Å
28	S	46.6	Very low	60.4	Low	96 Å²	96	110.5 Å²	110.5	67%	0.671	57%	0.572	S	S	*	*			trans	-77.6	57.9	-173.8	66.5	0	0	0	0	113	M30	S28-M30 PolarHBondContact O-N 3.46Å
29	K	49.1	Very low	63	Low	81 Å²	81	109.4 Å²	109.4	35%	0.352	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-61	-0	152.8	-82.7	-159.7	175.4	-157.9	0	112.3	S27 D31 R32 E97	S27-K29 PolarHBondContact O-N 3.04Å; K29-D31 PolarHBondContact O-N 3Å; K29-D31 VanDerWaalsContact O-N 3.12Å; K29-R32 PolarHBondContact O-N 3.45Å; K29-E97 IonicContact NZ-OE1 3.69Å; K29-E97 PolarHBondContact NZ-OE1 3.32Å; K29-E97 IonicContact NZ-OE2 3.85Å; K29-E97 PolarHBondContact NZ-OE2 3.37Å
30	M	48.5	Very low	64.8	Low	116 Å²	116	103.2 Å²	103.2	57%	0.571	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-61.1	-18.6	-169.1	-70.9	-173.1	-80.5	0	0	115	S28 R101	S28-M30 PolarHBondContact O-N 3.46Å; M30-R101 PolarHBondContact O-NH1 3.38Å
31	D	68.4	Low	66.3	Low	116 Å²	116	104.1 Å²	104.1	62%	0.62	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-129.3	10.6	177.7	-65.6	-44.8	0	0	0	114.3	K29 Y33 R53	K29-D31 PolarHBondContact O-N 3Å; K29-D31 VanDerWaalsContact O-N 3.12Å; D31-Y33 VanDerWaalsContact C-N 3.32Å; D31-Y33 PolarHBondContact O-N 3.16Å; D31-R53 WeakPolarHBondContact O-CD 3.48Å; D31-R53 PolarHBondContact O-NE 3.28Å; D31-R53 VanDerWaalsContact O-NE 3.09Å
32	R	85.5	Confident	67.8	Low	44 Å²	44	101.7 Å²	101.7	17%	0.166	53%	0.528	C	S	.	.	S	Bend	trans	-58.1	-41.4	-174.7	179	176.9	173.6	170.6	-12.7	112.7	K29 D52 R53 E54	K29-R32 PolarHBondContact O-N 3.45Å; R32-D52 WeakPolarHBondContact CG-OD1 3.38Å; R32-D52 IonicContact CZ-OD1 2.79Å; R32-D52 IonicContact CZ-OD2 2.98Å; R32-D52 VanDerWaalsContact NE-CG 3.31Å; R32-D52 IonicContact NE-OD1 2.83Å; R32-D52 PolarHBondContact NE-OD1 2.88Å; R32-D52 IonicContact NE-OD2 3.73Å; R32-D52 PolarHBondContact NE-OD2 3.46Å; R32-D52 IonicContact NH2-OD1 3.59Å; R32-D52 IonicContact NH2-OD2 2.62Å; R32-D52 PolarHBondContact NH2-OD2 2.88Å; R32-D52 CarbonylContact O-C 3.58Å; R32-R53 WeakPolarHBondContact O-CB 3.26Å; R32-R53 WeakPolarHBondContact O-CG 3.29Å; R32-R53 PolarHBondContact O-N 3.47Å; R32-E54 HydrophobicContact CG-CG 4.12Å; R32-E54 IonicContact CZ-OE2 2.6Å; R32-E54 IonicContact NE-OE2 3.93Å; R32-E54 PolarHBondContact NE-OE2 3.29Å; R32-E54 IonicContact NH1-OE1 3.14Å; R32-E54 IonicContact NH1-OE2 3.51Å; R32-E54 PolarHBondContact NH1-OE2 3.04Å; R32-E54 IonicContact NH2-OE2 2.82Å
33	Y	91.9	Very high	68.5	Low	42 Å²	42	94.2 Å²	94.2	17%	0.165	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	101.4	179.7	-61.8	-66.1	0	0	0	110.5	D31 K35 R51 D52 V59 E97 F99 V108	D31-Y33 VanDerWaalsContact C-N 3.32Å; D31-Y33 PolarHBondContact O-N 3.16Å; Y33-K35 PolarHBondContact O-N 3.17Å; Y33-R51 WeakPolarHBondContact CA-O 3.45Å; Y33-D52 HydrophobicContact CD1-CB 4.09Å; Y33-D52 HydrophobicContact CE1-CB 3.86Å; Y33-V59 HydrophobicContact CD1-CG2 3.62Å; Y33-V59 HydrophobicContact CE1-CG2 3.78Å; Y33-E97 PolarHBondContact OH-OE2 2.85Å; Y33-F99 AromaticContact CD2-CE1 3.7Å; Y33-F99 HydrophobicContact CD2-CE1 3.7Å; Y33-F99 HydrophobicContact CD2-CZ 4.03Å; Y33-F99 HydrophobicContact CE2-CD1 4.22Å; Y33-F99 AromaticContact CE2-CE1 3.69Å; Y33-F99 HydrophobicContact CE2-CE1 3.69Å; Y33-F99 HydrophobicContact CE2-CZ 4.46Å; Y33-V108 HydrophobicContact CD2-CG2 4.43Å; Y33-V108 HydrophobicContact CE1-CG1 3.94Å; Y33-V108 HydrophobicContact CE2-CG2 3.8Å
34	E	93.9	Very high	69.4	Low	57 Å²	57	88.4 Å²	88.4	27%	0.266	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	116.1	172	177.1	170.8	-124.4	0	0	109.8	L36 C50 R51 R53	E34-L36 HydrophobicContact CG-CD2 4.09Å; E34-L36 PolarHBondContact O-N 2.69Å; E34-C50 CarbonylContact O-C 3.42Å; E34-C50 WeakPolarHBondContact O-CA 3.48Å; E34-C50 WeakPolarHBondContact O-CB 3.12Å; E34-R51 HydrophobicContact CB-CB 4.34Å; E34-R51 PolarHBondContact N-O 2.82Å; E34-R51 PolarHBondContact O-N 3.09Å; E34-R53 HydrophobicContact CB-CG 4.29Å; E34-R53 IonicContact OE1-CZ 3.39Å; E34-R53 IonicContact OE1-NH1 3.22Å; E34-R53 PolarHBondContact OE1-NH1 2.85Å; E34-R53 IonicContact OE1-NH2 2.79Å; E34-R53 PolarHBondContact OE1-NH2 2.63Å; E34-R53 IonicContact OE2-CZ 3.95Å; E34-R53 IonicContact OE2-NH1 3.54Å; E34-R53 IonicContact OE2-NH2 3.98Å
35	K	94.6	Very high	71.2	Confident	125 Å²	125	83.1 Å²	83.1	54%	0.543	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	122.1	177.2	-172	-167.3	-172.7	-170.7	0	110	Y33 Y48	Y33-K35 PolarHBondContact O-N 3.17Å; K35-Y48 HydrophobicContact CD-CD1 4.2Å; K35-Y48 HydrophobicContact CD-CE1 4.41Å; K35-Y48 HydrophobicContact CD-CG 4.49Å; K35-Y48 HydrophobicContact CG-CD1 4.25Å; K35-Y48 HydrophobicContact CG-CG 4.32Å
36	L	95.4	Very high	73.1	Confident	77 Å²	77	73.5 Å²	73.5	40%	0.403	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	-56.9	-179.8	-59.3	-179.8	0	0	0	111.8	E34 K49 R51 L58	E34-L36 HydrophobicContact CG-CD2 4.09Å; E34-L36 PolarHBondContact O-N 2.69Å; L36-K49 HydrophobicContact CB-CG 4.44Å; L36-K49 WeakPolarHBondContact CB-O 3.48Å; L36-K49 HydrophobicContact CD1-CG 4.32Å; L36-K49 PolarHBondContact N-O 2.98Å; L36-R51 HydrophobicContact CD1-CB 4.07Å; L36-R51 HydrophobicContact CD2-CB 4.46Å; L36-R51 HydrophobicContact CG-CB 4.37Å; L36-L58 HydrophobicContact CD1-CD2 3.61Å
37	S	94.6	Very high	75.4	Confident	52 Å²	52	71.7 Å²	71.7	36%	0.364	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	163.6	-178	64.7	0	0	0	0	111.5	Y48 K49	S37-Y48 CarbonylContact O-C 3.57Å; S37-Y48 WeakPolarHBondContact O-CA 3.38Å; S37-K49 PolarHBondContact N-O 3.38Å; S37-K49 PolarHBondContact O-N 2.89Å; S37-K49 WeakPolarHBondContact OG-CB 3.45Å
38	R	92.6	Very high	78	Confident	143 Å²	143	69.1 Å²	69.1	54%	0.54	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	131.1	170.3	-178.6	175.4	165.1	-179.9	-9.3	108.5	E41 V46 Y48	R38-E41 IonicContact CZ-OE2 3.02Å; R38-E41 IonicContact NH1-OE2 3.78Å; R38-E41 IonicContact NH2-OE2 2.76Å; R38-E41 PolarHBondContact NH2-OE2 3.29Å; R38-V46 HydrophobicContact CG-CG1 3.94Å; R38-Y48 HydrophobicContact CB-CD1 4.01Å; R38-Y48 HydrophobicContact CB-CE1 3.99Å; R38-Y48 HydrophobicContact CG-CD1 4.31Å; R38-Y48 HydrophobicContact CG-CE1 4.07Å
39	L	86.5	Confident	80.3	Confident	85 Å²	85	67 Å²	67	45%	0.445	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-35.3	178.3	-67.4	174.6	0	0	0	111.8	V47 K49 A60 F111	L39-V47 HydrophobicContact CB-CB 4.43Å; L39-V47 HydrophobicContact CB-CG1 4.26Å; L39-V47 HydrophobicContact CD1-CG1 4.22Å; L39-V47 PolarHBondContact N-O 3.4Å; L39-K49 HydrophobicContact CD1-CB 3.93Å; L39-K49 HydrophobicContact CD2-CB 3.95Å; L39-K49 HydrophobicContact CG-CB 3.84Å; L39-A60 HydrophobicContact CD1-CB 4.21Å; L39-F111 HydrophobicContact CD1-CD2 4.14Å; L39-F111 HydrophobicContact CD1-CE2 3.87Å; L39-F111 HydrophobicContact CD2-CE2 4.06Å
40	G	78.4	Confident	82.5	Confident	28 Å²	28	63.4 Å²	63.4	29%	0.289	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.2	173.7	-179.5	0	0	0	0	0	112.6	V46 V47	G40-V46 WeakPolarHBondContact O-CG1 3.35Å; G40-V47 PolarHBondContact N-O 3.41Å; G40-V47 PolarHBondContact O-N 3.28Å
41	E	75	Confident	84.8	Confident	122 Å²	122	63.4 Å²	63.4	57%	0.57	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.5	128.5	169.4	171.7	167	-140.2	0	0	107.8	R38 V46	R38-E41 IonicContact CZ-OE2 3.02Å; R38-E41 IonicContact NH1-OE2 3.78Å; R38-E41 IonicContact NH2-OE2 2.76Å; R38-E41 PolarHBondContact NH2-OE2 3.29Å; E41-V46 HydrophobicContact CB-CG2 4.42Å; E41-V46 HydrophobicContact CG-CG2 4.23Å
42	G	65.8	Low	86.1	Confident	43 Å²	43	58.1 Å²	58.1	44%	0.443	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	180	174.4	0	0	0	0	0	110.1	Y44 G45	G42-Y44 PolarHBondContact O-N 3.09Å; G42-G45 PolarHBondContact N-O 2.83Å; G42-G45 PolarHBondContact O-N 3.12Å
43	S	59.6	Low	86.5	Confident	98 Å²	98	62.8 Å²	62.8	69%	0.685	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-27.2	-172.5	-46.7	0	0	0	0	114.8
44	Y	65.4	Low	86.5	Confident	54 Å²	54	66.7 Å²	66.7	21%	0.212	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-5	-173.8	-52.6	-71.2	0	0	0	114	G42 F64 V65 I73 I76 F176	G42-Y44 PolarHBondContact O-N 3.09Å; Y44-F64 WeakPolarHBondContact O-CA 3.09Å; Y44-F64 WeakPolarHBondContact O-CD1 3.4Å; Y44-V65 PolarHBondContact O-N 3.27Å; Y44-I73 HydrophobicContact CD1-CD1 4.45Å; Y44-I76 HydrophobicContact CD1-CD1 4.33Å; Y44-I76 HydrophobicContact CD1-CG2 4.48Å; Y44-I76 HydrophobicContact CE1-CD1 3.64Å; Y44-I76 HydrophobicContact CE1-CG2 4.36Å; Y44-F176 HydrophobicContact CE2-CE1 4.16Å; Y44-F176 AromaticContact CE2-CZ 3.85Å; Y44-F176 HydrophobicContact CE2-CZ 3.85Å; Y44-F176 WeakPolarHBondContact OH-CE1 3.29Å
45	G	76.8	Confident	86.4	Confident	3 Å²	3	68.3 Å²	68.3	3%	0.031	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176	167.6	-166.9	0	0	0	0	0	116.4	G42 R63	G42-G45 PolarHBondContact N-O 2.83Å; G42-G45 PolarHBondContact O-N 3.12Å; G45-R63 CarbonylContact C-O 3.52Å; G45-R63 WeakPolarHBondContact CA-O 3.4Å
46	V	85.4	Confident	86.4	Confident	6 Å²	6	64.6 Å²	64.6	4%	0.036	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	133	173.3	-171.8	0	0	0	0	109	R38 G40 E41 Y48 R63 V65	R38-V46 HydrophobicContact CG-CG1 3.94Å; G40-V46 WeakPolarHBondContact O-CG1 3.35Å; E41-V46 HydrophobicContact CB-CG2 4.42Å; E41-V46 HydrophobicContact CG-CG2 4.23Å; V46-Y48 HydrophobicContact CB-CE2 3.88Å; V46-Y48 HydrophobicContact CG1-CD1 4.39Å; V46-Y48 HydrophobicContact CG1-CD2 4.43Å; V46-Y48 HydrophobicContact CG1-CE1 3.69Å; V46-Y48 HydrophobicContact CG1-CE2 3.75Å; V46-Y48 WeakPolarHBondContact CG1-OH 3.44Å; V46-R63 PolarHBondContact N-O 3.01Å; V46-R63 PolarHBondContact O-N 2.85Å; V46-V65 HydrophobicContact CG2-CG2 4.38Å
47	V	89.8	Confident	86.4	Confident	39 Å²	39	63.1 Å²	63.1	24%	0.236	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	130.1	178.3	-171.6	0	0	0	0	109.6	L39 G40 A60 V61 K62	L39-V47 HydrophobicContact CB-CB 4.43Å; L39-V47 HydrophobicContact CB-CG1 4.26Å; L39-V47 HydrophobicContact CD1-CG1 4.22Å; L39-V47 PolarHBondContact N-O 3.4Å; G40-V47 PolarHBondContact N-O 3.41Å; G40-V47 PolarHBondContact O-N 3.28Å; V47-A60 HydrophobicContact CG1-CB 4.28Å; V47-V61 WeakPolarHBondContact CA-O 3.07Å; V47-K62 HydrophobicContact CG2-CB 4.19Å; V47-K62 HydrophobicContact CG2-CG 4.11Å
48	Y	93.7	Very high	86.5	Confident	25 Å²	25	63.6 Å²	63.6	10%	0.098	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	140.6	179.3	-61.9	-70.9	0	0	0	111.4	K35 S37 R38 V46 A60 V61 R63	K35-Y48 HydrophobicContact CD-CD1 4.2Å; K35-Y48 HydrophobicContact CD-CE1 4.41Å; K35-Y48 HydrophobicContact CD-CG 4.49Å; K35-Y48 HydrophobicContact CG-CD1 4.25Å; K35-Y48 HydrophobicContact CG-CG 4.32Å; S37-Y48 CarbonylContact O-C 3.57Å; S37-Y48 WeakPolarHBondContact O-CA 3.38Å; R38-Y48 HydrophobicContact CB-CD1 4.01Å; R38-Y48 HydrophobicContact CB-CE1 3.99Å; R38-Y48 HydrophobicContact CG-CD1 4.31Å; R38-Y48 HydrophobicContact CG-CE1 4.07Å; V46-Y48 HydrophobicContact CB-CE2 3.88Å; V46-Y48 HydrophobicContact CG1-CD1 4.39Å; V46-Y48 HydrophobicContact CG1-CD2 4.43Å; V46-Y48 HydrophobicContact CG1-CE1 3.69Å; V46-Y48 HydrophobicContact CG1-CE2 3.75Å; V46-Y48 WeakPolarHBondContact CG1-OH 3.44Å; Y48-A60 CarbonylContact O-C 3.57Å; Y48-A60 WeakPolarHBondContact O-CA 3.4Å; Y48-V61 PolarHBondContact N-O 3.41Å; Y48-V61 PolarHBondContact O-N 2.84Å; Y48-R63 HydrophobicContact CE2-CB 4.31Å; Y48-R63 PolarHBondContact OH-NH2 2.94Å; Y48-R63 VanDerWaalsContact OH-NH2 3.09Å
49	K	95.6	Very high	86.6	Confident	50 Å²	50	57 Å²	57	22%	0.217	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	125.4	161.7	-174.6	176.2	-177.8	168.5	0	107.6	L36 S37 L39 F111	L36-K49 HydrophobicContact CB-CG 4.44Å; L36-K49 WeakPolarHBondContact CB-O 3.48Å; L36-K49 HydrophobicContact CD1-CG 4.32Å; L36-K49 PolarHBondContact N-O 2.98Å; S37-K49 PolarHBondContact N-O 3.38Å; S37-K49 PolarHBondContact O-N 2.89Å; S37-K49 WeakPolarHBondContact OG-CB 3.45Å; L39-K49 HydrophobicContact CD1-CB 3.93Å; L39-K49 HydrophobicContact CD2-CB 3.95Å; L39-K49 HydrophobicContact CG-CB 3.84Å; K49-F111 HydrophobicContact CB-CE2 4.35Å; K49-F111 HydrophobicContact CD-CD2 4.47Å; K49-F111 HydrophobicContact CD-CE2 3.77Å; K49-F111 HydrophobicContact CD-CZ 3.86Å; K49-F111 HydrophobicContact CG-CD2 4.1Å; K49-F111 HydrophobicContact CG-CE2 3.82Å; K49-F111 HydrophobicContact CG-CZ 4.37Å
50	C	96.3	Very high	87	Confident	7 Å²	7	53.6 Å²	53.6	5%	0.047	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	156.5	176.3	-59.5	0	0	0	0	110.6	E34 L58 V59 V61	E34-C50 CarbonylContact O-C 3.42Å; E34-C50 WeakPolarHBondContact O-CA 3.48Å; E34-C50 WeakPolarHBondContact O-CB 3.12Å; C50-L58 WeakPolarHBondContact O-CA 3.45Å; C50-V59 HydrophobicContact CB-CG2 3.88Å; C50-V59 PolarHBondContact N-O 2.74Å; C50-V59 PolarHBondContact O-N 3.32Å; C50-V61 HydrophobicContact CB-CG2 3.93Å; C50-V61 VanDerWaalsContact SG-CG2 3.59Å
51	R	96.4	Very high	87.7	Confident	115 Å²	115	52.5 Å²	52.5	43%	0.434	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127	164.7	177.7	175.9	-70.3	168.5	-2.3	108.8	Y33 E34 L36 R53 L58	Y33-R51 WeakPolarHBondContact CA-O 3.45Å; E34-R51 HydrophobicContact CB-CB 4.34Å; E34-R51 PolarHBondContact N-O 2.82Å; E34-R51 PolarHBondContact O-N 3.09Å; L36-R51 HydrophobicContact CD1-CB 4.07Å; L36-R51 HydrophobicContact CD2-CB 4.46Å; L36-R51 HydrophobicContact CG-CB 4.37Å; R51-R53 PolarHBondContact O-N 2.75Å; R51-L58 HydrophobicContact CB-CD2 4.44Å
52	D	94.8	Very high	88.4	Confident	6 Å²	6	47.8 Å²	47.8	3%	0.032	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	112.7	167.4	-177.3	-4.4	0	0	0	109	R32 Y33 E54 T55 G56 A57	R32-D52 WeakPolarHBondContact CG-OD1 3.38Å; R32-D52 IonicContact CZ-OD1 2.79Å; R32-D52 IonicContact CZ-OD2 2.98Å; R32-D52 VanDerWaalsContact NE-CG 3.31Å; R32-D52 IonicContact NE-OD1 2.83Å; R32-D52 PolarHBondContact NE-OD1 2.88Å; R32-D52 IonicContact NE-OD2 3.73Å; R32-D52 PolarHBondContact NE-OD2 3.46Å; R32-D52 IonicContact NH2-OD1 3.59Å; R32-D52 IonicContact NH2-OD2 2.62Å; R32-D52 PolarHBondContact NH2-OD2 2.88Å; R32-D52 CarbonylContact O-C 3.58Å; Y33-D52 HydrophobicContact CD1-CB 4.09Å; Y33-D52 HydrophobicContact CE1-CB 3.86Å; D52-E54 PolarHBondContact O-N 3.29Å; D52-E54 PolarHBondContact OD1-N 2.92Å; D52-T55 VanDerWaalsContact CB-OG1 3.32Å; D52-T55 WeakPolarHBondContact CB-OG1 3.2Å; D52-T55 PolarHBondContact O-N 3.33Å; D52-T55 PolarHBondContact OD2-OG1 3.49Å; D52-G56 CarbonylContact O-C 3.59Å; D52-G56 WeakPolarHBondContact O-CA 3.49Å; D52-G56 PolarHBondContact O-N 3.06Å; D52-A57 PolarHBondContact N-O 3.37Å
53	R	93.3	Very high	89.5	Confident	142 Å²	142	49.2 Å²	49.2	54%	0.536	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-22.5	-178.6	-66.8	-169.7	-174.4	-77.3	-0.7	113.2	D31 R32 E34 R51	D31-R53 WeakPolarHBondContact O-CD 3.48Å; D31-R53 PolarHBondContact O-NE 3.28Å; D31-R53 VanDerWaalsContact O-NE 3.09Å; R32-R53 WeakPolarHBondContact O-CB 3.26Å; R32-R53 WeakPolarHBondContact O-CG 3.29Å; R32-R53 PolarHBondContact O-N 3.47Å; E34-R53 HydrophobicContact CB-CG 4.29Å; E34-R53 IonicContact OE1-CZ 3.39Å; E34-R53 IonicContact OE1-NH1 3.22Å; E34-R53 PolarHBondContact OE1-NH1 2.85Å; E34-R53 IonicContact OE1-NH2 2.79Å; E34-R53 PolarHBondContact OE1-NH2 2.63Å; E34-R53 IonicContact OE2-CZ 3.95Å; E34-R53 IonicContact OE2-NH1 3.54Å; E34-R53 IonicContact OE2-NH2 3.98Å; R51-R53 PolarHBondContact O-N 2.75Å
54	E	91.9	Very high	90.6	Very high	124 Å²	124	44.6 Å²	44.6	58%	0.579	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-39.9	179.2	-71.3	176.8	-170	0	0	111.4	R32 D52	R32-E54 HydrophobicContact CG-CG 4.12Å; R32-E54 IonicContact CZ-OE2 2.6Å; R32-E54 IonicContact NE-OE2 3.93Å; R32-E54 PolarHBondContact NE-OE2 3.29Å; R32-E54 IonicContact NH1-OE1 3.14Å; R32-E54 IonicContact NH1-OE2 3.51Å; R32-E54 PolarHBondContact NH1-OE2 3.04Å; R32-E54 IonicContact NH2-OE2 2.82Å; D52-E54 PolarHBondContact O-N 3.29Å; D52-E54 PolarHBondContact OD1-N 2.92Å
55	T	93.7	Very high	90.9	Very high	91 Å²	91	45 Å²	45	56%	0.558	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-15	-174.1	61.8	0	0	0	0	113.5	D52 A57	D52-T55 VanDerWaalsContact CB-OG1 3.32Å; D52-T55 WeakPolarHBondContact CB-OG1 3.2Å; D52-T55 PolarHBondContact O-N 3.33Å; D52-T55 PolarHBondContact OD2-OG1 3.49Å; T55-A57 PolarHBondContact O-N 3.08Å; T55-A57 WeakPolarHBondContact OG1-CB 3.23Å; T55-A57 PolarHBondContact OG1-N 2.84Å
56	G	93.5	Very high	90.6	Very high	47 Å²	47	49.7 Å²	49.7	49%	0.485	26%	0.255	S	S	.	.			trans	74	-7.3	-169.1	0	0	0	0	0	114.2	D52	D52-G56 CarbonylContact O-C 3.59Å; D52-G56 WeakPolarHBondContact O-CA 3.49Å; D52-G56 PolarHBondContact O-N 3.06Å
57	A	94.6	Very high	89.9	Confident	46 Å²	46	51 Å²	51	38%	0.38	27%	0.265	S	S	.	.			trans	-70.5	148	-173.6	0	0	0	0	0	112.5	D52 T55	D52-A57 PolarHBondContact N-O 3.37Å; T55-A57 PolarHBondContact O-N 3.08Å; T55-A57 WeakPolarHBondContact OG1-CB 3.23Å; T55-A57 PolarHBondContact OG1-N 2.84Å
58	L	96.7	Very high	88.6	Confident	61 Å²	61	50.7 Å²	50.7	32%	0.319	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	137.6	169.1	-65.7	175.7	0	0	0	109.9	L36 C50 R51 F111	L36-L58 HydrophobicContact CD1-CD2 3.61Å; C50-L58 WeakPolarHBondContact O-CA 3.45Å; R51-L58 HydrophobicContact CB-CD2 4.44Å; L58-F111 HydrophobicContact CB-CB 3.95Å; L58-F111 HydrophobicContact CB-CD1 3.9Å; L58-F111 HydrophobicContact CB-CG 3.99Å; L58-F111 HydrophobicContact CD1-CD1 4.11Å; L58-F111 HydrophobicContact CD1-CE1 4.22Å; L58-F111 WeakPolarHBondContact O-CB 3.41Å
59	V	96.3	Very high	87.5	Confident	5 Å²	5	53.1 Å²	53.1	3%	0.03	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	156.4	178.5	-61.2	0	0	0	0	110.8	Y33 C50 V61 L96 V108 F109	Y33-V59 HydrophobicContact CD1-CG2 3.62Å; Y33-V59 HydrophobicContact CE1-CG2 3.78Å; C50-V59 HydrophobicContact CB-CG2 3.88Å; C50-V59 PolarHBondContact N-O 2.74Å; C50-V59 PolarHBondContact O-N 3.32Å; V59-V61 HydrophobicContact CG2-CG2 4.08Å; V59-L96 HydrophobicContact CG1-CD1 4.06Å; V59-V108 HydrophobicContact CB-CG1 3.8Å; V59-V108 HydrophobicContact CG1-CG1 4.1Å; V59-V108 HydrophobicContact CG2-CG1 3.9Å; V59-F109 WeakPolarHBondContact CA-O 3.48Å; V59-F109 WeakPolarHBondContact CB-O 3.4Å
60	A	95.1	Very high	86.4	Confident	13 Å²	13	53.8 Å²	53.8	11%	0.107	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.5	169.7	0	0	0	0	0	109.9	L39 V47 Y48 V108 F109	L39-A60 HydrophobicContact CD1-CB 4.21Å; V47-A60 HydrophobicContact CG1-CB 4.28Å; Y48-A60 CarbonylContact O-C 3.57Å; Y48-A60 WeakPolarHBondContact O-CA 3.4Å; A60-V108 WeakPolarHBondContact O-CA 3.4Å; A60-F109 HydrophobicContact CB-CB 4.32Å; A60-F109 PolarHBondContact N-O 3.21Å; A60-F109 PolarHBondContact O-N 3.31Å
61	V	92.9	Very high	85.3	Confident	6 Å²	6	58.4 Å²	58.4	4%	0.036	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	107.9	179.7	-175.9	0	0	0	0	109.8	V47 Y48 C50 V59 F99 H106 L107 V108	V47-V61 WeakPolarHBondContact CA-O 3.07Å; Y48-V61 PolarHBondContact N-O 3.41Å; Y48-V61 PolarHBondContact O-N 2.84Å; C50-V61 HydrophobicContact CB-CG2 3.93Å; C50-V61 VanDerWaalsContact SG-CG2 3.59Å; V59-V61 HydrophobicContact CG2-CG2 4.08Å; V61-F99 HydrophobicContact CG1-CZ 4.47Å; V61-H106 HydrophobicContact CG1-CB 4.1Å; V61-L107 CarbonylContact C-O 3.59Å; V61-L107 WeakPolarHBondContact CA-O 3.47Å; V61-V108 HydrophobicContact CG2-CG1 4.41Å; V61-V108 HydrophobicContact CG2-CG2 4.29Å
62	K	89.4	Confident	84	Confident	22 Å²	22	55.7 Å²	55.7	10%	0.096	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	111.9	172.1	-175.2	173.3	178.1	-178	0	108.6	V47 F64 E80 H106 L107 F109 D173	V47-K62 HydrophobicContact CG2-CB 4.19Å; V47-K62 HydrophobicContact CG2-CG 4.11Å; K62-F64 HydrophobicContact CD-CE2 4.46Å; K62-F64 HydrophobicContact CG-CE2 4.37Å; K62-E80 IonicContact NZ-OE1 2.72Å; K62-E80 PolarHBondContact NZ-OE1 2.86Å; K62-E80 IonicContact NZ-OE2 2.87Å; K62-E80 PolarHBondContact NZ-OE2 2.78Å; K62-H106 WeakPolarHBondContact O-CA 3.43Å; K62-L107 HydrophobicContact CB-CB 4.46Å; K62-L107 PolarHBondContact N-O 3Å; K62-L107 PolarHBondContact O-N 3.45Å; K62-F109 HydrophobicContact CB-CE2 4.01Å; K62-D173 IonicContact NZ-OD1 2.7Å
63	R	88.4	Confident	82.7	Confident	73 Å²	73	56.2 Å²	56.2	28%	0.275	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	118.6	176.1	178.1	-177.1	75.8	176.3	4.1	109.6	G45 V46 Y48 H106	G45-R63 CarbonylContact C-O 3.52Å; G45-R63 WeakPolarHBondContact CA-O 3.4Å; V46-R63 PolarHBondContact N-O 3.01Å; V46-R63 PolarHBondContact O-N 2.85Å; Y48-R63 HydrophobicContact CE2-CB 4.31Å; Y48-R63 PolarHBondContact OH-NH2 2.94Å; Y48-R63 VanDerWaalsContact OH-NH2 3.09Å; R63-H106 WeakPolarHBondContact CG-NE2 3.41Å
64	F	81.8	Confident	81.6	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.009	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	135.2	173.3	-75.3	-104.6	0	0	0	110.5	Y44 K62 I73 A77 R104 L105 L107	Y44-F64 WeakPolarHBondContact O-CA 3.09Å; Y44-F64 WeakPolarHBondContact O-CD1 3.4Å; K62-F64 HydrophobicContact CD-CE2 4.46Å; K62-F64 HydrophobicContact CG-CE2 4.37Å; F64-I73 HydrophobicContact CD1-CG2 4.25Å; F64-A77 HydrophobicContact CE1-CB 4.01Å; F64-A77 HydrophobicContact CZ-CB 4.08Å; F64-R104 WeakPolarHBondContact O-CD 3.23Å; F64-L105 HydrophobicContact CB-CB 4.47Å; F64-L105 HydrophobicContact CD2-CB 4.22Å; F64-L105 HydrophobicContact CD2-CD2 4.36Å; F64-L105 HydrophobicContact CD2-CG 4.47Å; F64-L105 HydrophobicContact CE2-CD2 4.42Å; F64-L105 HydrophobicContact CG-CB 4.49Å; F64-L105 PolarHBondContact N-O 2.95Å; F64-L107 HydrophobicContact CD2-CD1 4.2Å; F64-L107 HydrophobicContact CE2-CD1 3.68Å; F64-L107 HydrophobicContact CE2-CD2 4.08Å; F64-L107 HydrophobicContact CE2-CG 4.44Å
65	V	72.9	Confident	80.7	Confident	63 Å²	63	56.6 Å²	56.6	38%	0.382	32%	0.317	S	S	.	.	S	Bend	trans	-73.8	-49.1	-178.7	170.1	0	0	0	0	110.4	Y44 V46 R104	Y44-V65 PolarHBondContact O-N 3.27Å; V46-V65 HydrophobicContact CG2-CG2 4.38Å; V65-R104 PolarHBondContact O-NE 2.98Å
66	E	71.2	Confident	79.6	Confident	100 Å²	100	54.4 Å²	54.4	47%	0.467	30%	0.301	S	S	.	.	S	Bend	trans	-80.5	154.9	-179.2	-68.7	-177.9	-172.4	0	0	111.9	I73	E66-I73 HydrophobicContact CB-CD1 4.38Å; E66-I73 HydrophobicContact CB-CG1 3.92Å; E66-I73 HydrophobicContact CB-CG2 4.49Å; E66-I73 VanDerWaalsContact OE2-CD1 3.28Å; E66-I73 WeakPolarHBondContact OE2-CD1 3.5Å; E66-I73 WeakPolarHBondContact OE2-CG1 3.47Å
67	S	69.1	Low	78.4	Confident	33 Å²	33	52.2 Å²	52.2	23%	0.231	28%	0.279	C	S	.	.			trans	-78.4	146	175.3	-164.9	0	0	0	0	110	D69 D70 R103	S67-D69 PolarHBondContact O-N 2.94Å; S67-D69 PolarHBondContact OG-OD2 2.87Å; S67-D69 VanDerWaalsContact OG-OD2 3.08Å; S67-D70 PolarHBondContact O-N 2.85Å; S67-R103 PolarHBondContact OG-O 2.99Å
68	E	64	Low	77.4	Confident	33 Å²	33	53.1 Å²	53.1	15%	0.154	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-6.8	171.2	-58.8	172.6	132.8	0	0	113.3	D70 R74 R100 L105	E68-D70 PolarHBondContact O-N 2.91Å; E68-R74 PolarHBondContact O-NE 2.6Å; E68-R74 PolarHBondContact O-NH2 2.8Å; E68-R100 IonicContact OE2-CZ 3.87Å; E68-R100 IonicContact OE2-NH1 2.68Å; E68-R100 PolarHBondContact OE2-NH1 3.48Å; E68-L105 HydrophobicContact CG-CB 4.14Å; E68-L105 WeakPolarHBondContact OE1-CD1 3.44Å
69	D	69.8	Low	76.2	Confident	76 Å²	76	54.2 Å²	54.2	41%	0.406	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-23.4	170.8	-59.2	-41.6	0	0	0	111.6	S67 P71 R103	S67-D69 PolarHBondContact O-N 2.94Å; S67-D69 PolarHBondContact OG-OD2 2.87Å; S67-D69 VanDerWaalsContact OG-OD2 3.08Å; D69-P71 WeakPolarHBondContact O-CD 3.16Å; D69-R103 VanDerWaalsContact CG-NH2 3.26Å; D69-R103 IonicContact OD1-NH2 3.29Å; D69-R103 PolarHBondContact OD1-NH2 3.31Å; D69-R103 IonicContact OD2-CZ 3.22Å; D69-R103 IonicContact OD2-NE 3.06Å; D69-R103 PolarHBondContact OD2-NE 3.41Å; D69-R103 IonicContact OD2-NH2 2.63Å; D69-R103 PolarHBondContact OD2-NH2 2.8Å
70	D	71.8	Confident	75	Confident	65 Å²	65	54.1 Å²	54.1	35%	0.348	28%	0.276	S	S	.	.	S	Bend	trans	-72	118.8	165.9	-171.5	-55.1	0	0	0	110.6	S67 E68 A72 I73 R74	S67-D70 PolarHBondContact O-N 2.85Å; E68-D70 PolarHBondContact O-N 2.91Å; D70-A72 VanDerWaalsContact C-N 3.31Å; D70-A72 PolarHBondContact O-N 2.88Å; D70-A72 WeakPolarHBondContact OD1-CA 3.47Å; D70-A72 VanDerWaalsContact OD1-CB 3.27Å; D70-A72 WeakPolarHBondContact OD1-CB 3.39Å; D70-A72 PolarHBondContact OD1-N 2.68Å; D70-I73 HydrophobicContact CB-CB 4.09Å; D70-I73 HydrophobicContact CB-CG1 3.92Å; D70-I73 PolarHBondContact O-N 2.8Å; D70-I73 PolarHBondContact OD1-N 3.33Å; D70-R74 WeakPolarHBondContact O-CB 3.32Å; D70-R74 PolarHBondContact O-N 3.21Å
71	P	73.7	Confident	74.1	Confident	104 Å²	104	54.3 Å²	54.3	68%	0.675	28%	0.275	S	S	*	.	H	α-helix	trans	-61	-33.1	179.7	-23.8	34.8	0	0	0	114.7	D69 K75	D69-P71 WeakPolarHBondContact O-CD 3.16Å; P71-K75 WeakPolarHBondContact O-CB 3.18Å; P71-K75 PolarHBondContact O-N 3.37Å
72	A	68.8	Low	73.4	Confident	58 Å²	58	60.6 Å²	60.6	48%	0.479	30%	0.298	S	S	.	.	H	α-helix	trans	-70.6	-46.7	179.4	0	0	0	0	0	110.8	D70 R74 K75 I76	D70-A72 VanDerWaalsContact C-N 3.31Å; D70-A72 PolarHBondContact O-N 2.88Å; D70-A72 WeakPolarHBondContact OD1-CA 3.47Å; D70-A72 VanDerWaalsContact OD1-CB 3.27Å; D70-A72 WeakPolarHBondContact OD1-CB 3.39Å; D70-A72 PolarHBondContact OD1-N 2.68Å; A72-R74 VanDerWaalsContact C-N 3.33Å; A72-R74 PolarHBondContact O-N 2.71Å; A72-K75 WeakPolarHBondContact O-CB 3.18Å; A72-K75 PolarHBondContact O-N 2.86Å; A72-I76 WeakPolarHBondContact O-CG1 3.47Å; A72-I76 PolarHBondContact O-N 3.33Å
73	I	67.6	Low	72.7	Confident	17 Å²	17	60.2 Å²	60.2	9%	0.087	30%	0.297	C	S	.	.	H	α-helix	trans	-61.8	-43.3	175.3	-61.9	-61	0	0	0	111.1	Y44 F64 E66 D70 K75 I76 A77	Y44-I73 HydrophobicContact CD1-CD1 4.45Å; F64-I73 HydrophobicContact CD1-CG2 4.25Å; E66-I73 HydrophobicContact CB-CD1 4.38Å; E66-I73 HydrophobicContact CB-CG1 3.92Å; E66-I73 HydrophobicContact CB-CG2 4.49Å; E66-I73 VanDerWaalsContact OE2-CD1 3.28Å; E66-I73 WeakPolarHBondContact OE2-CD1 3.5Å; E66-I73 WeakPolarHBondContact OE2-CG1 3.47Å; D70-I73 HydrophobicContact CB-CB 4.09Å; D70-I73 HydrophobicContact CB-CG1 3.92Å; D70-I73 PolarHBondContact O-N 2.8Å; D70-I73 PolarHBondContact OD1-N 3.33Å; I73-K75 VanDerWaalsContact C-N 3.3Å; I73-K75 PolarHBondContact O-N 3.05Å; I73-I76 PolarHBondContact O-N 2.84Å; I73-A77 WeakPolarHBondContact O-CB 3.46Å; I73-A77 PolarHBondContact O-N 3.25Å
74	R	71.4	Confident	72.2	Confident	107 Å²	107	57 Å²	57	40%	0.404	29%	0.285	S	S	.	.	H	α-helix	trans	-58.7	-42.6	175.6	-171.6	-177.9	-59.8	-151.2	1.8	111.6	E68 D70 A72 L78	E68-R74 PolarHBondContact O-NE 2.6Å; E68-R74 PolarHBondContact O-NH2 2.8Å; D70-R74 WeakPolarHBondContact O-CB 3.32Å; D70-R74 PolarHBondContact O-N 3.21Å; A72-R74 VanDerWaalsContact C-N 3.33Å; A72-R74 PolarHBondContact O-N 2.71Å; R74-L78 HydrophobicContact CG-CD1 3.81Å; R74-L78 HydrophobicContact CG-CG 4.27Å; R74-L78 VanDerWaalsContact O-CB 3.24Å; R74-L78 WeakPolarHBondContact O-CB 3.2Å; R74-L78 WeakPolarHBondContact O-CG 3.28Å; R74-L78 PolarHBondContact O-N 2.94Å
75	K	72.5	Confident	72.1	Confident	166 Å²	166	62.1 Å²	62.1	72%	0.722	31%	0.308	S	S	*	.	H	α-helix	trans	-63.8	-45.2	178.2	-172.6	178.4	179.8	-179.5	0	111.6	P71 A72 I73 R79	P71-K75 WeakPolarHBondContact O-CB 3.18Å; P71-K75 PolarHBondContact O-N 3.37Å; A72-K75 WeakPolarHBondContact O-CB 3.18Å; A72-K75 PolarHBondContact O-N 2.86Å; I73-K75 VanDerWaalsContact C-N 3.3Å; I73-K75 PolarHBondContact O-N 3.05Å; K75-R79 VanDerWaalsContact O-CB 3.32Å; K75-R79 WeakPolarHBondContact O-CB 3.34Å; K75-R79 PolarHBondContact O-N 3.27Å
76	I	69.4	Low	72.6	Confident	46 Å²	46	65.2 Å²	65.2	24%	0.236	32%	0.322	C	S	.	.	H	α-helix	trans	-63.2	-51.4	178.2	-66.6	169.2	0	0	0	110.5	Y44 A72 I73 L78 R79 E80	Y44-I76 HydrophobicContact CD1-CD1 4.33Å; Y44-I76 HydrophobicContact CD1-CG2 4.48Å; Y44-I76 HydrophobicContact CE1-CD1 3.64Å; Y44-I76 HydrophobicContact CE1-CG2 4.36Å; A72-I76 WeakPolarHBondContact O-CG1 3.47Å; A72-I76 PolarHBondContact O-N 3.33Å; I73-I76 PolarHBondContact O-N 2.84Å; I76-L78 PolarHBondContact O-N 3.35Å; I76-R79 WeakPolarHBondContact O-CB 3.38Å; I76-R79 PolarHBondContact O-N 2.88Å; I76-E80 PolarHBondContact O-N 3.29Å
77	A	69.1	Low	73.2	Confident	1 Å²	1	61 Å²	61	1%	0.008	30%	0.302	C	S	.	.	H	α-helix	trans	-64	-43.1	-178.1	0	0	0	0	0	112.8	F64 I73 R79 E80 I81 L105	F64-A77 HydrophobicContact CE1-CB 4.01Å; F64-A77 HydrophobicContact CZ-CB 4.08Å; I73-A77 WeakPolarHBondContact O-CB 3.46Å; I73-A77 PolarHBondContact O-N 3.25Å; A77-R79 VanDerWaalsContact C-N 3.29Å; A77-R79 PolarHBondContact O-N 2.83Å; A77-E80 PolarHBondContact O-N 2.76Å; A77-I81 WeakPolarHBondContact O-CB 3.35Å; A77-I81 WeakPolarHBondContact O-CD1 3.02Å; A77-I81 VanDerWaalsContact O-CG1 3.25Å; A77-I81 WeakPolarHBondContact O-CG1 3.28Å; A77-I81 PolarHBondContact O-N 3.48Å; A77-L105 HydrophobicContact CB-CD2 3.53Å
78	L	73.4	Confident	74.3	Confident	65 Å²	65	64.5 Å²	64.5	34%	0.34	31%	0.314	S	S	.	.	H	α-helix	trans	-65.3	-34	176.1	-73	176.6	0	0	0	112	R74 I76 R82	R74-L78 HydrophobicContact CG-CD1 3.81Å; R74-L78 HydrophobicContact CG-CG 4.27Å; R74-L78 VanDerWaalsContact O-CB 3.24Å; R74-L78 WeakPolarHBondContact O-CB 3.2Å; R74-L78 WeakPolarHBondContact O-CG 3.28Å; R74-L78 PolarHBondContact O-N 2.94Å; I76-L78 PolarHBondContact O-N 3.35Å; L78-R82 WeakPolarHBondContact O-CB 3.35Å; L78-R82 WeakPolarHBondContact O-CG 3.48Å; L78-R82 PolarHBondContact O-N 2.93Å
79	R	71.3	Confident	75.8	Confident	83 Å²	83	65.2 Å²	65.2	31%	0.313	32%	0.317	S	S	.	.	H	α-helix	trans	-63.8	-51.9	173.5	-176.8	-167.5	-168.4	141.8	24.8	110.8	K75 I76 A77 I81 R82 L83 A177 R178	K75-R79 VanDerWaalsContact O-CB 3.32Å; K75-R79 WeakPolarHBondContact O-CB 3.34Å; K75-R79 PolarHBondContact O-N 3.27Å; I76-R79 WeakPolarHBondContact O-CB 3.38Å; I76-R79 PolarHBondContact O-N 2.88Å; A77-R79 VanDerWaalsContact C-N 3.29Å; A77-R79 PolarHBondContact O-N 2.83Å; R79-I81 VanDerWaalsContact C-N 3.31Å; R79-I81 PolarHBondContact O-N 3.03Å; R79-R82 PolarHBondContact O-N 3.16Å; R79-R82 VanDerWaalsContact O-N 3.17Å; R79-L83 HydrophobicContact CG-CD1 4.12Å; R79-L83 WeakPolarHBondContact O-CG 3.44Å; R79-L83 PolarHBondContact O-N 2.91Å; R79-A177 PolarHBondContact NE-O 2.92Å; R79-A177 PolarHBondContact NH2-O 2.74Å; R79-R178 VanDerWaalsContact NH2-CA 3.31Å
80	E	71.8	Confident	77.1	Confident	4 Å²	4	65.3 Å²	65.3	2%	0.019	32%	0.321	C	S	.	.	H	α-helix	trans	-56.9	-46.3	179	-170.6	175	175.2	0	0	110.3	K62 I76 A77 R82 L83 L84 L107	K62-E80 IonicContact NZ-OE1 2.72Å; K62-E80 PolarHBondContact NZ-OE1 2.86Å; K62-E80 IonicContact NZ-OE2 2.87Å; K62-E80 PolarHBondContact NZ-OE2 2.78Å; I76-E80 PolarHBondContact O-N 3.29Å; A77-E80 PolarHBondContact O-N 2.76Å; E80-R82 PolarHBondContact O-N 3.05Å; E80-L83 PolarHBondContact O-N 3.33Å; E80-L84 HydrophobicContact CG-CD1 3.68Å; E80-L84 HydrophobicContact CG-CG 4.47Å; E80-L84 WeakPolarHBondContact O-CB 3.35Å; E80-L84 WeakPolarHBondContact O-CD1 3.39Å; E80-L84 VanDerWaalsContact O-CG 3.23Å; E80-L84 WeakPolarHBondContact O-CG 3.48Å; E80-L84 PolarHBondContact O-N 2.96Å; E80-L107 HydrophobicContact CG-CD2 4.45Å
81	I	76.9	Confident	78.3	Confident	16 Å²	16	62.6 Å²	62.6	8%	0.082	31%	0.307	C	S	.	.	H	α-helix	trans	-61.1	-45.2	176.2	-69.1	165.2	0	0	0	112.2	A77 R79 K85 L95 V98 L105 L107	A77-I81 WeakPolarHBondContact O-CB 3.35Å; A77-I81 WeakPolarHBondContact O-CD1 3.02Å; A77-I81 VanDerWaalsContact O-CG1 3.25Å; A77-I81 WeakPolarHBondContact O-CG1 3.28Å; A77-I81 PolarHBondContact O-N 3.48Å; R79-I81 VanDerWaalsContact C-N 3.31Å; R79-I81 PolarHBondContact O-N 3.03Å; I81-K85 HydrophobicContact CG2-CD 4.07Å; I81-K85 HydrophobicContact CG2-CG 4.36Å; I81-K85 WeakPolarHBondContact O-CB 3.46Å; I81-K85 VanDerWaalsContact O-CG 3.31Å; I81-K85 WeakPolarHBondContact O-CG 3.36Å; I81-K85 PolarHBondContact O-N 3.18Å; I81-L95 HydrophobicContact CG2-CD2 4.47Å; I81-V98 HydrophobicContact CD1-CG1 3.81Å; I81-V98 HydrophobicContact CD1-CG2 4.19Å; I81-V98 HydrophobicContact CG1-CG2 4.09Å; I81-V98 HydrophobicContact CG2-CG2 4.38Å; I81-L105 HydrophobicContact CD1-CD2 3.88Å; I81-L107 HydrophobicContact CD1-CD1 4.32Å; I81-L107 HydrophobicContact CG1-CD1 4.43Å; I81-L107 HydrophobicContact CG1-CD2 4.18Å; I81-L107 HydrophobicContact CG1-CG 4.33Å
82	R	76.8	Confident	79.4	Confident	138 Å²	138	57.8 Å²	57.8	52%	0.521	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-44.4	-179.3	-77	170.6	-173.2	176.7	1.3	111.4	L78 R79 E80 N86	L78-R82 WeakPolarHBondContact O-CB 3.35Å; L78-R82 WeakPolarHBondContact O-CG 3.48Å; L78-R82 PolarHBondContact O-N 2.93Å; R79-R82 PolarHBondContact O-N 3.16Å; R79-R82 VanDerWaalsContact O-N 3.17Å; E80-R82 PolarHBondContact O-N 3.05Å; R82-N86 PolarHBondContact O-N 2.98Å; R82-N86 PolarHBondContact O-ND2 2.91Å
83	L	74.9	Confident	80.5	Confident	15 Å²	15	55.4 Å²	55.4	8%	0.079	26%	0.255	C	S	.	.	H	α-helix	trans	-62.1	-52.9	176.5	-71.2	174.8	0	0	0	110.7	R79 E80 K85 N86 L87 A177 M179	R79-L83 HydrophobicContact CG-CD1 4.12Å; R79-L83 WeakPolarHBondContact O-CG 3.44Å; R79-L83 PolarHBondContact O-N 2.91Å; E80-L83 PolarHBondContact O-N 3.33Å; L83-K85 VanDerWaalsContact C-N 3.27Å; L83-K85 PolarHBondContact O-N 2.85Å; L83-N86 PolarHBondContact O-N 3.07Å; L83-L87 HydrophobicContact CB-CD1 4.34Å; L83-L87 WeakPolarHBondContact O-CB 3.38Å; L83-L87 WeakPolarHBondContact O-CG 3.41Å; L83-L87 PolarHBondContact O-N 2.98Å; L83-A177 HydrophobicContact CD1-CB 3.9Å; L83-M179 HydrophobicContact CD2-CG 4.16Å; L83-M179 HydrophobicContact CD2-SD 3.65Å
84	L	78.5	Confident	81.7	Confident	5 Å²	5	56.5 Å²	56.5	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-66.7	-23.6	-177.3	-69.8	166.9	0	0	0	114.5	E80 K88 V93 L95 F109 F174	E80-L84 HydrophobicContact CG-CD1 3.68Å; E80-L84 HydrophobicContact CG-CG 4.47Å; E80-L84 WeakPolarHBondContact O-CB 3.35Å; E80-L84 WeakPolarHBondContact O-CD1 3.39Å; E80-L84 VanDerWaalsContact O-CG 3.23Å; E80-L84 WeakPolarHBondContact O-CG 3.48Å; E80-L84 PolarHBondContact O-N 2.96Å; L84-K88 PolarHBondContact O-NZ 3.37Å; L84-V93 HydrophobicContact CD2-CG1 4.46Å; L84-L95 HydrophobicContact CB-CB 3.86Å; L84-L95 HydrophobicContact CB-CD2 3.89Å; L84-L95 HydrophobicContact CD1-CB 4.34Å; L84-L95 HydrophobicContact CD1-CD2 4.33Å; L84-F109 HydrophobicContact CD1-CE1 3.54Å; L84-F109 HydrophobicContact CD1-CZ 3.75Å; L84-F109 HydrophobicContact CD2-CE1 4.34Å; L84-F174 HydrophobicContact CD2-CD2 3.77Å; L84-F174 HydrophobicContact CD2-CE2 4.24Å; L84-F174 HydrophobicContact CD2-CG 4.44Å
85	K	80.3	Confident	82.7	Confident	110 Å²	110	52.2 Å²	52.2	48%	0.478	25%	0.249	S	C	.	.	H	α-helix	trans	-72.2	-35.4	171.7	-82.2	-173.5	174.2	-170.2	0	112.2	I81 L83 K88 L95	I81-K85 HydrophobicContact CG2-CD 4.07Å; I81-K85 HydrophobicContact CG2-CG 4.36Å; I81-K85 WeakPolarHBondContact O-CB 3.46Å; I81-K85 VanDerWaalsContact O-CG 3.31Å; I81-K85 WeakPolarHBondContact O-CG 3.36Å; I81-K85 PolarHBondContact O-N 3.18Å; L83-K85 VanDerWaalsContact C-N 3.27Å; L83-K85 PolarHBondContact O-N 2.85Å; K85-K88 VanDerWaalsContact O-CE 3.3Å; K85-K88 WeakPolarHBondContact O-CE 3.27Å; K85-L95 HydrophobicContact CG-CD2 4.43Å
86	N	82.1	Confident	83.6	Confident	127 Å²	127	49.1 Å²	49.1	68%	0.679	24%	0.24	S	C	*	.	H	α-helix	trans	-94.1	-27.9	-174.8	-65.9	-18.4	0	0	0	113.2	R82 L83 K88	R82-N86 PolarHBondContact O-N 2.98Å; R82-N86 PolarHBondContact O-ND2 2.91Å; L83-N86 PolarHBondContact O-N 3.07Å; N86-K88 PolarHBondContact O-N 2.98Å
87	L	85.2	Confident	84.5	Confident	12 Å²	12	49 Å²	49	6%	0.063	24%	0.238	C	C	.	.			trans	-86.6	107.4	177.5	-62.2	178.7	0	0	0	109.7	L83 L92 Y145 Q149 C151 F174	L83-L87 HydrophobicContact CB-CD1 4.34Å; L83-L87 WeakPolarHBondContact O-CB 3.38Å; L83-L87 WeakPolarHBondContact O-CG 3.41Å; L83-L87 PolarHBondContact O-N 2.98Å; L87-L92 HydrophobicContact CB-CD1 3.88Å; L87-Y145 HydrophobicContact CB-CE1 4.16Å; L87-Y145 HydrophobicContact CD2-CE1 3.87Å; L87-Q149 HydrophobicContact CD2-CB 3.68Å; L87-Q149 HydrophobicContact CD2-CG 3.75Å; L87-C151 HydrophobicContact CD1-CB 4.47Å; L87-F174 HydrophobicContact CD1-CD1 4.12Å; L87-F174 HydrophobicContact CD1-CE1 3.78Å; L87-F174 HydrophobicContact CD1-CZ 4.42Å
88	K	91.1	Very high	85.5	Confident	107 Å²	107	50 Å²	50	47%	0.465	24%	0.244	S	C	.	.			trans	-126.9	110.1	178.7	-61.3	-60	-179.5	-157.6	0	109.5	L84 K85 N86 Y145	L84-K88 PolarHBondContact O-NZ 3.37Å; K85-K88 VanDerWaalsContact O-CE 3.3Å; K85-K88 WeakPolarHBondContact O-CE 3.27Å; N86-K88 PolarHBondContact O-N 2.98Å; K88-Y145 PolarHBondContact N-OH 2.88Å; K88-Y145 PolarHBondContact O-OH 2.82Å
89	H	95.7	Very high	86.1	Confident	47 Å²	47	49.3 Å²	49.3	22%	0.218	24%	0.239	C	C	.	.			trans	-154.9	146	-178.9	-179.5	-93.1	0	0	0	109.8	N91 L92 Y145	H89-N91 PolarHBondContact CE1-OD1 3.03Å; H89-N91 VanDerWaalsContact CE1-OD1 3.29Å; H89-N91 PolarHBondContact ND1-N 3.01Å; H89-N91 PolarHBondContact O-N 2.79Å; H89-N91 VanDerWaalsContact O-N 3.09Å; H89-L92 HydrophobicContact CB-CB 4.46Å; H89-L92 HydrophobicContact CB-CD1 4.04Å; H89-L92 HydrophobicContact CB-CG 3.93Å; H89-L92 PolarHBondContact O-N 3.21Å; H89-Y145 HydrophobicContact CB-CD1 3.65Å; H89-Y145 HydrophobicContact CB-CD2 4.23Å; H89-Y145 HydrophobicContact CB-CE1 3.86Å; H89-Y145 HydrophobicContact CB-CE2 4.41Å; H89-Y145 HydrophobicContact CB-CG 3.84Å; H89-Y145 AromaticContact CD2-CD2 3.86Å; H89-Y145 AromaticContact CD2-CG 3.75Å; H89-Y145 AromaticContact CG-CG 3.86Å
90	P	96.4	Very high	86.7	Confident	78 Å²	78	50.8 Å²	50.8	51%	0.506	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-32.3	-178.4	-28.6	36.2	0	0	0	114	Q168 K170	P90-Q168 PolarHBondContact O-NE2 2.66Å; P90-K170 VanDerWaalsContact O-CD 3.29Å; P90-K170 WeakPolarHBondContact O-CD 3.18Å; P90-K170 VanDerWaalsContact O-CE 3.25Å; P90-K170 WeakPolarHBondContact O-CE 3.35Å; P90-K170 PolarHBondContact O-NZ 3.08Å; P90-K170 VanDerWaalsContact O-NZ 3.12Å
91	N	97.8	Very high	87.2	Confident	8 Å²	8	56.1 Å²	56.1	4%	0.043	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	13.8	179.7	-56	115.8	0	0	0	115.6	H89 Q138 V169 L171	H89-N91 PolarHBondContact CE1-OD1 3.03Å; H89-N91 VanDerWaalsContact CE1-OD1 3.29Å; H89-N91 PolarHBondContact ND1-N 3.01Å; H89-N91 PolarHBondContact O-N 2.79Å; H89-N91 VanDerWaalsContact O-N 3.09Å; N91-Q138 WeakPolarHBondContact CB-O 3.45Å; N91-Q138 PolarHBondContact ND2-OE1 3.31Å; N91-V169 WeakPolarHBondContact CA-O 3.29Å; N91-V169 PolarHBondContact ND2-O 2.98Å; N91-V169 VanDerWaalsContact ND2-O 3.08Å; N91-L171 WeakPolarHBondContact O-CG 3.46Å; N91-L171 PolarHBondContact O-N 2.75Å
92	L	95.8	Very high	87.5	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.016	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-115.3	143	172.5	-59.4	-173.3	0	0	0	109.8	L87 H89 S94 Y145 L171 F174	L87-L92 HydrophobicContact CB-CD1 3.88Å; H89-L92 HydrophobicContact CB-CB 4.46Å; H89-L92 HydrophobicContact CB-CD1 4.04Å; H89-L92 HydrophobicContact CB-CG 3.93Å; H89-L92 PolarHBondContact O-N 3.21Å; L92-S94 PolarHBondContact O-N 3.15Å; L92-Y145 HydrophobicContact CD1-CD1 3.77Å; L92-Y145 HydrophobicContact CD1-CE1 3.89Å; L92-L171 HydrophobicContact CD2-CB 3.77Å; L92-L171 HydrophobicContact CD2-CD1 3.87Å; L92-L171 HydrophobicContact CD2-CG 4.17Å; L92-F174 HydrophobicContact CD1-CZ 4.08Å; L92-F174 HydrophobicContact CD2-CE2 4.31Å; L92-F174 HydrophobicContact CD2-CZ 3.69Å; L92-F174 HydrophobicContact CG-CZ 4.36Å
93	V	93.8	Very high	87.7	Confident	9 Å²	9	64.2 Å²	64.2	6%	0.055	30%	0.299	C	S	.	.			trans	-64.9	130.3	175.8	72.8	0	0	0	0	110.6	L84 F109 E110 L162 K170 L171 C172	L84-V93 HydrophobicContact CD2-CG1 4.46Å; V93-F109 HydrophobicContact CG1-CD1 4Å; V93-F109 HydrophobicContact CG1-CE1 4.18Å; V93-F109 HydrophobicContact CG2-CB 4.04Å; V93-F109 HydrophobicContact CG2-CD1 4Å; V93-F109 HydrophobicContact CG2-CG 4.39Å; V93-E110 HydrophobicContact CG2-CG 3.84Å; V93-L162 HydrophobicContact CG2-CD1 4.38Å; V93-K170 HydrophobicContact CB-CB 4.43Å; V93-L171 WeakPolarHBondContact CB-O 3.11Å; V93-L171 WeakPolarHBondContact CG1-O 3.39Å; V93-L171 PolarHBondContact N-O 3.32Å; V93-C172 HydrophobicContact CB-CB 4.15Å; V93-C172 HydrophobicContact CG1-CB 3.69Å
94	S	92.1	Very high	88	Confident	39 Å²	39	67.8 Å²	67.8	27%	0.273	31%	0.311	S	S	.	.			trans	-84.6	118.9	-177.8	-58.1	0	0	0	0	111.3	L92 L96 F109 E110	L92-S94 PolarHBondContact O-N 3.15Å; S94-L96 PolarHBondContact O-N 3.19Å; S94-F109 VanDerWaalsContact O-CA 3.28Å; S94-F109 WeakPolarHBondContact O-CA 3.39Å; S94-E110 WeakPolarHBondContact CB-OE1 3.24Å; S94-E110 PolarHBondContact N-OE1 3.07Å; S94-E110 PolarHBondContact O-N 3.36Å; S94-E110 VanDerWaalsContact O-N 3.12Å; S94-E110 PolarHBondContact OG-OE1 2.69Å
95	L	91.8	Very high	88.3	Confident	17 Å²	17	67.6 Å²	67.6	9%	0.089	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	114.9	163.9	-179.3	69.3	0	0	0	109.4	I81 L84 K85 V98 L107 F109	I81-L95 HydrophobicContact CG2-CD2 4.47Å; L84-L95 HydrophobicContact CB-CB 3.86Å; L84-L95 HydrophobicContact CB-CD2 3.89Å; L84-L95 HydrophobicContact CD1-CB 4.34Å; L84-L95 HydrophobicContact CD1-CD2 4.33Å; K85-L95 HydrophobicContact CG-CD2 4.43Å; L95-V98 HydrophobicContact CD1-CG2 4.05Å; L95-V98 HydrophobicContact CD2-CG2 3.82Å; L95-V98 HydrophobicContact CG-CG2 4.23Å; L95-L107 HydrophobicContact CD1-CB 3.82Å; L95-L107 HydrophobicContact CD1-CD2 4.39Å; L95-L107 HydrophobicContact CD1-CG 3.98Å; L95-F109 HydrophobicContact CB-CD1 4.28Å; L95-F109 HydrophobicContact CB-CE1 4.11Å; L95-F109 HydrophobicContact CD1-CD1 4.24Å; L95-F109 HydrophobicContact CD1-CE1 3.9Å; L95-F109 HydrophobicContact CD1-CE2 4.38Å; L95-F109 HydrophobicContact CD1-CZ 3.97Å
96	L	91.5	Very high	88.7	Confident	101 Å²	101	63.2 Å²	63.2	53%	0.529	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-49.1	-176.5	-55.1	179.9	0	0	0	111.7	V59 S94 V108	V59-L96 HydrophobicContact CG1-CD1 4.06Å; S94-L96 PolarHBondContact O-N 3.19Å; L96-V108 HydrophobicContact CB-CG1 4.44Å; L96-V108 WeakPolarHBondContact CB-O 3.27Å; L96-V108 HydrophobicContact CD1-CG1 4.5Å; L96-V108 PolarHBondContact N-O 3.17Å
97	E	89.3	Confident	89	Confident	43 Å²	43	57.1 Å²	57.1	20%	0.201	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	152.7	-176.6	-176.1	167.7	172.1	0	0	111.1	K29 Y33 V108	K29-E97 IonicContact NZ-OE1 3.69Å; K29-E97 PolarHBondContact NZ-OE1 3.32Å; K29-E97 IonicContact NZ-OE2 3.85Å; K29-E97 PolarHBondContact NZ-OE2 3.37Å; Y33-E97 PolarHBondContact OH-OE2 2.85Å; E97-V108 HydrophobicContact CB-CB 4.1Å; E97-V108 HydrophobicContact CB-CG2 4.13Å; E97-V108 PolarHBondContact N-O 3.01Å; E97-V108 PolarHBondContact O-N 3.43Å
98	V	88.8	Confident	89.4	Confident	23 Å²	23	56.6 Å²	56.6	14%	0.139	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	128.7	169.5	-179.3	0	0	0	0	108.2	L20 I81 L95 L105 H106 L107	L20-V98 HydrophobicContact CD1-CG1 4.46Å; I81-V98 HydrophobicContact CD1-CG1 3.81Å; I81-V98 HydrophobicContact CD1-CG2 4.19Å; I81-V98 HydrophobicContact CG1-CG2 4.09Å; I81-V98 HydrophobicContact CG2-CG2 4.38Å; L95-V98 HydrophobicContact CD1-CG2 4.05Å; L95-V98 HydrophobicContact CD2-CG2 3.82Å; L95-V98 HydrophobicContact CG-CG2 4.23Å; V98-L105 HydrophobicContact CG1-CD1 3.46Å; V98-L105 VanDerWaalsContact CG1-CD1 3.46Å; V98-L105 HydrophobicContact CG1-CG 4.35Å; V98-H106 WeakPolarHBondContact CA-O 3.44Å; V98-L107 HydrophobicContact CG1-CD1 4.29Å; V98-L107 HydrophobicContact CG2-CG 4.32Å
99	F	87.5	Confident	89.5	Confident	50 Å²	50	52.4 Å²	52.4	22%	0.219	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	166.6	176.4	69.5	-92.3	0	0	0	112.2	Y33 V61 R101 H106 V108	Y33-F99 AromaticContact CD2-CE1 3.7Å; Y33-F99 HydrophobicContact CD2-CE1 3.7Å; Y33-F99 HydrophobicContact CD2-CZ 4.03Å; Y33-F99 HydrophobicContact CE2-CD1 4.22Å; Y33-F99 AromaticContact CE2-CE1 3.69Å; Y33-F99 HydrophobicContact CE2-CE1 3.69Å; Y33-F99 HydrophobicContact CE2-CZ 4.46Å; V61-F99 HydrophobicContact CG1-CZ 4.47Å; F99-R101 HydrophobicContact CD2-CB 4.44Å; F99-R101 HydrophobicContact CE2-CB 4.21Å; F99-H106 HydrophobicContact CD1-CB 4.11Å; F99-H106 HydrophobicContact CD2-CB 3.97Å; F99-H106 HydrophobicContact CE1-CB 3.73Å; F99-H106 HydrophobicContact CE2-CB 3.57Å; F99-H106 AromaticContact CE2-CG 3.61Å; F99-H106 HydrophobicContact CG-CB 4.22Å; F99-H106 HydrophobicContact CZ-CB 3.44Å; F99-H106 VanDerWaalsContact CZ-CB 3.44Å; F99-H106 AromaticContact CZ-CG 3.8Å; F99-H106 PolarHBondContact N-O 2.74Å; F99-H106 PolarHBondContact O-N 3.24Å; F99-V108 HydrophobicContact CD1-CG2 3.87Å; F99-V108 HydrophobicContact CE1-CG2 3.48Å; F99-V108 VanDerWaalsContact CE1-CG2 3.48Å
100	R	83.1	Confident	89.4	Confident	115 Å²	115	52 Å²	52	43%	0.434	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	133.2	-179.6	-175.3	172.9	152.9	102.8	-3.1	110.3	E68 R103 R104	E68-R100 IonicContact OE2-CZ 3.87Å; E68-R100 IonicContact OE2-NH1 2.68Å; E68-R100 PolarHBondContact OE2-NH1 3.48Å; R100-R103 VanDerWaalsContact CZ-CA 3.47Å; R100-R103 PolarHBondContact NH1-O 3.06Å; R100-R104 WeakPolarHBondContact CA-O 3.46Å
101	R	82.2	Confident	89.4	Confident	116 Å²	116	49.5 Å²	49.5	44%	0.438	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	131.3	175.6	-177	-177	-177.8	110.1	-4.8	109.5	M30 F99 R103 R104	M30-R101 PolarHBondContact O-NH1 3.38Å; F99-R101 HydrophobicContact CD2-CB 4.44Å; F99-R101 HydrophobicContact CE2-CB 4.21Å; R101-R103 VanDerWaalsContact C-N 3.3Å; R101-R103 PolarHBondContact O-N 3.4Å; R101-R104 PolarHBondContact N-O 3.03Å; R101-R104 PolarHBondContact O-N 3.29Å
102	K	83.2	Confident	89.3	Confident	178 Å²	178	49.8 Å²	49.8	77%	0.774	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.1	47.9	179.5	-62.9	-178	177.8	-171.3	0	113	R104	K102-R104 PolarHBondContact O-N 3.07Å; K102-R104 VanDerWaalsContact O-N 3.16Å
103	R	80.6	Confident	89.2	Confident	145 Å²	145	53.7 Å²	53.7	55%	0.547	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	13.9	-175.9	-50	-179.7	72.9	120.6	-0.6	116.8	S67 D69 R100 R101	S67-R103 PolarHBondContact OG-O 2.99Å; D69-R103 VanDerWaalsContact CG-NH2 3.26Å; D69-R103 IonicContact OD1-NH2 3.29Å; D69-R103 PolarHBondContact OD1-NH2 3.31Å; D69-R103 IonicContact OD2-CZ 3.22Å; D69-R103 IonicContact OD2-NE 3.06Å; D69-R103 PolarHBondContact OD2-NE 3.41Å; D69-R103 IonicContact OD2-NH2 2.63Å; D69-R103 PolarHBondContact OD2-NH2 2.8Å; R100-R103 VanDerWaalsContact CZ-CA 3.47Å; R100-R103 PolarHBondContact NH1-O 3.06Å; R101-R103 VanDerWaalsContact C-N 3.3Å; R101-R103 PolarHBondContact O-N 3.4Å
104	R	81.8	Confident	89.2	Confident	90 Å²	90	55.1 Å²	55.1	34%	0.34	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.8	178.3	-64.1	179.2	-175.5	-165.4	0.3	111	F64 V65 R100 R101 K102 H106	F64-R104 WeakPolarHBondContact O-CD 3.23Å; V65-R104 PolarHBondContact O-NE 2.98Å; R100-R104 WeakPolarHBondContact CA-O 3.46Å; R101-R104 PolarHBondContact N-O 3.03Å; R101-R104 PolarHBondContact O-N 3.29Å; K102-R104 PolarHBondContact O-N 3.07Å; K102-R104 VanDerWaalsContact O-N 3.16Å; R104-H106 PolarHBondContact O-CE1 2.87Å; R104-H106 PolarHBondContact O-ND1 2.78Å
105	L	84.8	Confident	89.3	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	140.3	177.5	-171.2	64.4	0	0	0	110.6	F64 E68 A77 I81 V98 L107	F64-L105 HydrophobicContact CB-CB 4.47Å; F64-L105 HydrophobicContact CD2-CB 4.22Å; F64-L105 HydrophobicContact CD2-CD2 4.36Å; F64-L105 HydrophobicContact CD2-CG 4.47Å; F64-L105 HydrophobicContact CE2-CD2 4.42Å; F64-L105 HydrophobicContact CG-CB 4.49Å; F64-L105 PolarHBondContact N-O 2.95Å; E68-L105 HydrophobicContact CG-CB 4.14Å; E68-L105 WeakPolarHBondContact OE1-CD1 3.44Å; A77-L105 HydrophobicContact CB-CD2 3.53Å; I81-L105 HydrophobicContact CD1-CD2 3.88Å; V98-L105 HydrophobicContact CG1-CD1 3.46Å; V98-L105 VanDerWaalsContact CG1-CD1 3.46Å; V98-L105 HydrophobicContact CG1-CG 4.35Å; L105-L107 HydrophobicContact CD1-CD1 4.35Å; L105-L107 HydrophobicContact CD2-CD1 3.68Å; L105-L107 HydrophobicContact CG-CD1 3.58Å
106	H	88.1	Confident	89.6	Confident	18 Å²	18	53.5 Å²	53.5	8%	0.083	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	124.9	178.2	-61.4	66.2	0	0	0	108.6	V61 K62 R63 V98 F99 R104	V61-H106 HydrophobicContact CG1-CB 4.1Å; K62-H106 WeakPolarHBondContact O-CA 3.43Å; R63-H106 WeakPolarHBondContact CG-NE2 3.41Å; V98-H106 WeakPolarHBondContact CA-O 3.44Å; F99-H106 HydrophobicContact CD1-CB 4.11Å; F99-H106 HydrophobicContact CD2-CB 3.97Å; F99-H106 HydrophobicContact CE1-CB 3.73Å; F99-H106 HydrophobicContact CE2-CB 3.57Å; F99-H106 AromaticContact CE2-CG 3.61Å; F99-H106 HydrophobicContact CG-CB 4.22Å; F99-H106 HydrophobicContact CZ-CB 3.44Å; F99-H106 VanDerWaalsContact CZ-CB 3.44Å; F99-H106 AromaticContact CZ-CG 3.8Å; F99-H106 PolarHBondContact N-O 2.74Å; F99-H106 PolarHBondContact O-N 3.24Å; R104-H106 PolarHBondContact O-CE1 2.87Å; R104-H106 PolarHBondContact O-ND1 2.78Å
107	L	89.1	Confident	89.7	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	127	175.6	-78.6	55.7	0	0	0	107.6	V61 K62 F64 E80 I81 L95 V98 L105 F109	V61-L107 CarbonylContact C-O 3.59Å; V61-L107 WeakPolarHBondContact CA-O 3.47Å; K62-L107 HydrophobicContact CB-CB 4.46Å; K62-L107 PolarHBondContact N-O 3Å; K62-L107 PolarHBondContact O-N 3.45Å; F64-L107 HydrophobicContact CD2-CD1 4.2Å; F64-L107 HydrophobicContact CE2-CD1 3.68Å; F64-L107 HydrophobicContact CE2-CD2 4.08Å; F64-L107 HydrophobicContact CE2-CG 4.44Å; E80-L107 HydrophobicContact CG-CD2 4.45Å; I81-L107 HydrophobicContact CD1-CD1 4.32Å; I81-L107 HydrophobicContact CG1-CD1 4.43Å; I81-L107 HydrophobicContact CG1-CD2 4.18Å; I81-L107 HydrophobicContact CG1-CG 4.33Å; L95-L107 HydrophobicContact CD1-CB 3.82Å; L95-L107 HydrophobicContact CD1-CD2 4.39Å; L95-L107 HydrophobicContact CD1-CG 3.98Å; V98-L107 HydrophobicContact CG1-CD1 4.29Å; V98-L107 HydrophobicContact CG2-CG 4.32Å; L105-L107 HydrophobicContact CD1-CD1 4.35Å; L105-L107 HydrophobicContact CD2-CD1 3.68Å; L105-L107 HydrophobicContact CG-CD1 3.58Å; L107-F109 HydrophobicContact CB-CD2 4.23Å; L107-F109 HydrophobicContact CB-CE2 3.42Å; L107-F109 VanDerWaalsContact CB-CE2 3.42Å; L107-F109 HydrophobicContact CB-CZ 3.89Å; L107-F109 HydrophobicContact CD2-CE2 4.23Å; L107-F109 HydrophobicContact CD2-CZ 3.93Å; L107-F109 HydrophobicContact CG-CE2 4.45Å; L107-F109 HydrophobicContact CG-CZ 4.49Å
108	V	92.3	Very high	89.9	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	123.8	179.5	-171.8	0	0	0	0	108.7	Y33 V59 A60 V61 L96 E97 F99	Y33-V108 HydrophobicContact CD2-CG2 4.43Å; Y33-V108 HydrophobicContact CE1-CG1 3.94Å; Y33-V108 HydrophobicContact CE2-CG2 3.8Å; V59-V108 HydrophobicContact CB-CG1 3.8Å; V59-V108 HydrophobicContact CG1-CG1 4.1Å; V59-V108 HydrophobicContact CG2-CG1 3.9Å; A60-V108 WeakPolarHBondContact O-CA 3.4Å; V61-V108 HydrophobicContact CG2-CG1 4.41Å; V61-V108 HydrophobicContact CG2-CG2 4.29Å; L96-V108 HydrophobicContact CB-CG1 4.44Å; L96-V108 WeakPolarHBondContact CB-O 3.27Å; L96-V108 HydrophobicContact CD1-CG1 4.5Å; L96-V108 PolarHBondContact N-O 3.17Å; E97-V108 HydrophobicContact CB-CB 4.1Å; E97-V108 HydrophobicContact CB-CG2 4.13Å; E97-V108 PolarHBondContact N-O 3.01Å; E97-V108 PolarHBondContact O-N 3.43Å; F99-V108 HydrophobicContact CD1-CG2 3.87Å; F99-V108 HydrophobicContact CE1-CG2 3.48Å; F99-V108 VanDerWaalsContact CE1-CG2 3.48Å
109	F	93.6	Very high	90.3	Very high	19 Å²	19	53 Å²	53	8%	0.083	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	160.9	-179	-63	-88.9	0	0	0	111.1	V59 A60 K62 L84 V93 S94 L95 L107	V59-F109 WeakPolarHBondContact CA-O 3.48Å; V59-F109 WeakPolarHBondContact CB-O 3.4Å; A60-F109 HydrophobicContact CB-CB 4.32Å; A60-F109 PolarHBondContact N-O 3.21Å; A60-F109 PolarHBondContact O-N 3.31Å; K62-F109 HydrophobicContact CB-CE2 4.01Å; L84-F109 HydrophobicContact CD1-CE1 3.54Å; L84-F109 HydrophobicContact CD1-CZ 3.75Å; L84-F109 HydrophobicContact CD2-CE1 4.34Å; V93-F109 HydrophobicContact CG1-CD1 4Å; V93-F109 HydrophobicContact CG1-CE1 4.18Å; V93-F109 HydrophobicContact CG2-CB 4.04Å; V93-F109 HydrophobicContact CG2-CD1 4Å; V93-F109 HydrophobicContact CG2-CG 4.39Å; S94-F109 VanDerWaalsContact O-CA 3.28Å; S94-F109 WeakPolarHBondContact O-CA 3.39Å; L95-F109 HydrophobicContact CB-CD1 4.28Å; L95-F109 HydrophobicContact CB-CE1 4.11Å; L95-F109 HydrophobicContact CD1-CD1 4.24Å; L95-F109 HydrophobicContact CD1-CE1 3.9Å; L95-F109 HydrophobicContact CD1-CE2 4.38Å; L95-F109 HydrophobicContact CD1-CZ 3.97Å; L107-F109 HydrophobicContact CB-CD2 4.23Å; L107-F109 HydrophobicContact CB-CE2 3.42Å; L107-F109 VanDerWaalsContact CB-CE2 3.42Å; L107-F109 HydrophobicContact CB-CZ 3.89Å; L107-F109 HydrophobicContact CD2-CE2 4.23Å; L107-F109 HydrophobicContact CD2-CZ 3.93Å; L107-F109 HydrophobicContact CG-CE2 4.45Å; L107-F109 HydrophobicContact CG-CZ 4.49Å
110	E	94.3	Very high	90.7	Very high	38 Å²	38	51 Å²	51	18%	0.178	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	142.8	161.3	66.2	-177.1	122.8	0	0	110.4	V93 S94 K170	V93-E110 HydrophobicContact CG2-CG 3.84Å; S94-E110 WeakPolarHBondContact CB-OE1 3.24Å; S94-E110 PolarHBondContact N-OE1 3.07Å; S94-E110 PolarHBondContact O-N 3.36Å; S94-E110 VanDerWaalsContact O-N 3.12Å; S94-E110 PolarHBondContact OG-OE1 2.69Å; E110-K170 VanDerWaalsContact CD-NZ 3.31Å; E110-K170 IonicContact OE1-NZ 3.66Å; E110-K170 PolarHBondContact OE1-NZ 3.46Å; E110-K170 WeakPolarHBondContact OE2-CE 3.41Å; E110-K170 IonicContact OE2-NZ 3.53Å; E110-K170 PolarHBondContact OE2-NZ 3.02Å
111	F	95.8	Very high	91.2	Very high	26 Å²	26	51.7 Å²	51.7	11%	0.114	23%	0.229	C	C	.	.			trans	-85.3	140.2	176	177.4	-103.3	0	0	0	110.1	L39 K49 L58 E113	L39-F111 HydrophobicContact CD1-CD2 4.14Å; L39-F111 HydrophobicContact CD1-CE2 3.87Å; L39-F111 HydrophobicContact CD2-CE2 4.06Å; K49-F111 HydrophobicContact CB-CE2 4.35Å; K49-F111 HydrophobicContact CD-CD2 4.47Å; K49-F111 HydrophobicContact CD-CE2 3.77Å; K49-F111 HydrophobicContact CD-CZ 3.86Å; K49-F111 HydrophobicContact CG-CD2 4.1Å; K49-F111 HydrophobicContact CG-CE2 3.82Å; K49-F111 HydrophobicContact CG-CZ 4.37Å; L58-F111 HydrophobicContact CB-CB 3.95Å; L58-F111 HydrophobicContact CB-CD1 3.9Å; L58-F111 HydrophobicContact CB-CG 3.99Å; L58-F111 HydrophobicContact CD1-CD1 4.11Å; L58-F111 HydrophobicContact CD1-CE1 4.22Å; L58-F111 WeakPolarHBondContact O-CB 3.41Å; F111-E113 HydrophobicContact CE1-CG 4.18Å
112	C	95.9	Very high	91.8	Very high	15 Å²	15	53 Å²	53	10%	0.101	23%	0.234	C	C	.	.			trans	-125	139.9	171.1	-57.7	0	0	0	0	108.5	L162 L163	C112-L162 HydrophobicContact CB-CB 3.6Å; C112-L162 HydrophobicContact CB-CD1 4.12Å; C112-L162 HydrophobicContact CB-CG 4.45Å; C112-L163 WeakPolarHBondContact CB-O 3.2Å
113	E	93.9	Very high	92.4	Very high	85 Å²	85	47 Å²	47	40%	0.397	21%	0.208	S	C	.	.	S	Bend	trans	-70.3	-39.1	-171.3	-77.3	64.1	-154.6	0	0	112.6	F111 L163 T164 A165	F111-E113 HydrophobicContact CE1-CG 4.18Å; E113-L163 PolarHBondContact N-O 2.94Å; E113-T164 VanDerWaalsContact OE2-C 3.24Å; E113-T164 VanDerWaalsContact OE2-CA 3.27Å; E113-T164 WeakPolarHBondContact OE2-CA 3.24Å; E113-A165 HydrophobicContact CG-CB 3.97Å; E113-A165 PolarHBondContact OE2-N 3.01Å
114	L	93.6	Very high	93.1	Very high	39 Å²	39	44.1 Å²	44.1	20%	0.204	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	168.8	-170.9	-59.8	172.6	0	0	0	111.2	H118 E119 R122 L162 L163	L114-H118 HydrophobicContact CB-CB 4.36Å; L114-H118 HydrophobicContact CD2-CB 4.11Å; L114-E119 WeakPolarHBondContact CD1-OE1 3.32Å; L114-R122 VanDerWaalsContact CD1-NH1 3.25Å; L114-L162 CarbonylContact O-C 3.46Å; L114-L162 WeakPolarHBondContact O-CA 3.35Å; L114-L163 HydrophobicContact CB-CB 4.31Å; L114-L163 PolarHBondContact N-O 2.89Å; L114-L163 VanDerWaalsContact N-O 3.15Å; L114-L163 PolarHBondContact O-N 2.79Å
115	T	94.9	Very high	93.7	Very high	22 Å²	22	47.2 Å²	47.2	14%	0.135	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	165.1	163.7	69.6	0	0	0	0	108.9	L117 H118 E119 I161 L162	T115-L117 PolarHBondContact O-N 3.32Å; T115-L117 WeakPolarHBondContact OG1-CB 3.28Å; T115-L117 PolarHBondContact OG1-N 2.88Å; T115-H118 PolarHBondContact N-ND1 3.07Å; T115-H118 WeakPolarHBondContact O-CB 3.46Å; T115-H118 PolarHBondContact O-N 3.21Å; T115-H118 VanDerWaalsContact O-N 3.08Å; T115-H118 PolarHBondContact OG1-N 3.29Å; T115-H118 PolarHBondContact OG1-ND1 3.29Å; T115-E119 PolarHBondContact O-N 3.25Å; T115-I161 CarbonylContact C-O 3.57Å; T115-I161 VanDerWaalsContact CA-O 3.32Å; T115-I161 WeakPolarHBondContact CA-O 3.39Å; T115-L162 HydrophobicContact CG2-CD2 3.65Å
116	V	97	Very high	94.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.5	-29.3	172.8	173	0	0	0	0	111.5	H118 E119 L120 I135 P158 I161 L163 L219 L223	V116-H118 VanDerWaalsContact C-N 3.29Å; V116-H118 PolarHBondContact O-N 3.12Å; V116-E119 WeakPolarHBondContact O-CB 3.5Å; V116-E119 PolarHBondContact O-N 3.26Å; V116-L120 HydrophobicContact CG1-CD1 4.32Å; V116-L120 HydrophobicContact CG1-CG 4.45Å; V116-L120 PolarHBondContact O-N 2.87Å; V116-I135 HydrophobicContact CG1-CD1 4.35Å; V116-I135 HydrophobicContact CG1-CG2 4.39Å; V116-I135 HydrophobicContact CG2-CD1 4.05Å; V116-I135 HydrophobicContact CG2-CG1 4.34Å; V116-I135 HydrophobicContact CG2-CG2 3.63Å; V116-P158 HydrophobicContact CB-CB 4.2Å; V116-P158 HydrophobicContact CG1-CB 4.1Å; V116-P158 PolarHBondContact N-O 2.84Å; V116-I161 HydrophobicContact CB-CB 4.22Å; V116-I161 HydrophobicContact CG2-CB 3.63Å; V116-I161 HydrophobicContact CG2-CG2 3.44Å; V116-I161 VanDerWaalsContact CG2-CG2 3.44Å; V116-I161 PolarHBondContact N-O 2.75Å; V116-L163 HydrophobicContact CG2-CD1 4.33Å; V116-L163 HydrophobicContact CG2-CG 4.38Å; V116-L219 HydrophobicContact CG1-CD1 4.13Å; V116-L223 HydrophobicContact CG1-CD2 3.68Å
117	L	93.7	Very high	94.6	Very high	58 Å²	58	47.2 Å²	47.2	30%	0.304	23%	0.231	S	C	.	.	H	α-helix	trans	-56.6	-43.3	172.2	-179.8	63.6	0	0	0	111.8	T115 E119 L120 E121 P158 E159	T115-L117 PolarHBondContact O-N 3.32Å; T115-L117 WeakPolarHBondContact OG1-CB 3.28Å; T115-L117 PolarHBondContact OG1-N 2.88Å; L117-E119 PolarHBondContact O-N 2.84Å; L117-L120 PolarHBondContact O-N 2.77Å; L117-L120 VanDerWaalsContact O-N 3.15Å; L117-E121 WeakPolarHBondContact O-CG 3.15Å; L117-E121 PolarHBondContact O-N 3.4Å; L117-P158 HydrophobicContact CB-CB 4.02Å; L117-P158 PolarHBondContact N-O 2.98Å; L117-E159 HydrophobicContact CB-CG 4.43Å; L117-E159 HydrophobicContact CD2-CG 3.85Å
118	H	94.5	Very high	95	Very high	80 Å²	80	50.4 Å²	50.4	37%	0.37	25%	0.251	S	S	.	.	H	α-helix	trans	-62.5	-33.2	176.7	-66.1	86.9	0	0	0	112.2	L114 T115 V116 R122	L114-H118 HydrophobicContact CB-CB 4.36Å; L114-H118 HydrophobicContact CD2-CB 4.11Å; T115-H118 PolarHBondContact N-ND1 3.07Å; T115-H118 WeakPolarHBondContact O-CB 3.46Å; T115-H118 PolarHBondContact O-N 3.21Å; T115-H118 VanDerWaalsContact O-N 3.08Å; T115-H118 PolarHBondContact OG1-N 3.29Å; T115-H118 PolarHBondContact OG1-ND1 3.29Å; V116-H118 VanDerWaalsContact C-N 3.29Å; V116-H118 PolarHBondContact O-N 3.12Å; H118-R122 VanDerWaalsContact O-CG 3.29Å; H118-R122 WeakPolarHBondContact O-CG 3.49Å; H118-R122 PolarHBondContact O-N 3.31Å
119	E	96.6	Very high	95.1	Very high	19 Å²	19	55.1 Å²	55.1	9%	0.089	27%	0.274	C	S	.	.	H	α-helix	trans	-72.1	-36.9	175.3	-71.2	-57.4	142.4	0	0	112.1	L114 T115 V116 L117 R122 H123 L131 L163	L114-E119 WeakPolarHBondContact CD1-OE1 3.32Å; T115-E119 PolarHBondContact O-N 3.25Å; V116-E119 WeakPolarHBondContact O-CB 3.5Å; V116-E119 PolarHBondContact O-N 3.26Å; L117-E119 PolarHBondContact O-N 2.84Å; E119-R122 PolarHBondContact O-N 3.05Å; E119-R122 IonicContact OE1-CZ 3.38Å; E119-R122 IonicContact OE1-NH1 3.21Å; E119-R122 PolarHBondContact OE1-NH1 3.37Å; E119-H123 WeakPolarHBondContact O-CB 3.39Å; E119-H123 PolarHBondContact O-N 3.08Å; E119-H123 PolarHBondContact O-ND1 3.48Å; E119-H123 IonicContact OE2-CE1 2.88Å; E119-H123 PolarHBondContact OE2-CE1 3.36Å; E119-H123 VanDerWaalsContact OE2-CE1 3.24Å; E119-H123 IonicContact OE2-ND1 3.14Å; E119-L131 HydrophobicContact CB-CD2 4.27Å; E119-L131 HydrophobicContact CG-CD2 4.15Å; E119-L131 WeakPolarHBondContact OE2-CD2 3.39Å; E119-L163 HydrophobicContact CG-CD1 3.59Å
120	L	95.1	Very high	95.1	Very high	8 Å²	8	58.1 Å²	58.1	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-65.9	-40.4	173.7	-71.2	167.5	0	0	0	111.9	V116 L117 R122 H123 P158 E222 L223	V116-L120 HydrophobicContact CG1-CD1 4.32Å; V116-L120 HydrophobicContact CG1-CG 4.45Å; V116-L120 PolarHBondContact O-N 2.87Å; L117-L120 PolarHBondContact O-N 2.77Å; L117-L120 VanDerWaalsContact O-N 3.15Å; L120-R122 VanDerWaalsContact C-N 3.27Å; L120-R122 PolarHBondContact O-N 3.47Å; L120-H123 CarbonylContact O-C 3.57Å; L120-H123 PolarHBondContact O-N 2.88Å; L120-H123 VanDerWaalsContact O-N 3.08Å; L120-P158 HydrophobicContact CD1-CB 3.78Å; L120-P158 HydrophobicContact CD1-CG 3.61Å; L120-E222 HydrophobicContact CD1-CG 3.67Å; L120-E222 HydrophobicContact CD2-CG 3.89Å; L120-E222 WeakPolarHBondContact CD2-O 3.5Å; L120-E222 HydrophobicContact CG-CG 4.44Å; L120-L223 HydrophobicContact CD2-CD2 4.22Å
121	E	93.4	Very high	95.3	Very high	128 Å²	128	57.7 Å²	57.7	60%	0.598	29%	0.286	S	S	*	.	H	α-helix	trans	-61.5	-35.4	174.4	-72	172.6	171.6	0	0	112.2	L117 H123	L117-E121 WeakPolarHBondContact O-CG 3.15Å; L117-E121 PolarHBondContact O-N 3.4Å; E121-H123 VanDerWaalsContact C-N 3.34Å
122	R	96.3	Very high	95.4	Very high	143 Å²	143	56.5 Å²	56.5	54%	0.54	28%	0.281	S	S	.	.	H	α-helix	trans	-74.1	-25.4	174.3	-72.4	171	-175.3	177.7	-0.4	113.2	L114 H118 E119 L120 P124	L114-R122 VanDerWaalsContact CD1-NH1 3.25Å; H118-R122 VanDerWaalsContact O-CG 3.29Å; H118-R122 WeakPolarHBondContact O-CG 3.49Å; H118-R122 PolarHBondContact O-N 3.31Å; E119-R122 PolarHBondContact O-N 3.05Å; E119-R122 IonicContact OE1-CZ 3.38Å; E119-R122 IonicContact OE1-NH1 3.21Å; E119-R122 PolarHBondContact OE1-NH1 3.37Å; L120-R122 VanDerWaalsContact C-N 3.27Å; L120-R122 PolarHBondContact O-N 3.47Å; R122-P124 VanDerWaalsContact C-CD 3.42Å; R122-P124 WeakPolarHBondContact O-CD 3.42Å
123	H	96.2	Very high	95.4	Very high	53 Å²	53	56.2 Å²	56.2	25%	0.245	28%	0.278	C	S	.	.			trans	-124.7	67.6	-175.1	-55.8	100.5	0	0	0	111.2	E119 L120 E121 Q125 G126	E119-H123 WeakPolarHBondContact O-CB 3.39Å; E119-H123 PolarHBondContact O-N 3.08Å; E119-H123 PolarHBondContact O-ND1 3.48Å; E119-H123 IonicContact OE2-CE1 2.88Å; E119-H123 PolarHBondContact OE2-CE1 3.36Å; E119-H123 VanDerWaalsContact OE2-CE1 3.24Å; E119-H123 IonicContact OE2-ND1 3.14Å; L120-H123 CarbonylContact O-C 3.57Å; L120-H123 PolarHBondContact O-N 2.88Å; L120-H123 VanDerWaalsContact O-N 3.08Å; E121-H123 VanDerWaalsContact C-N 3.34Å; H123-Q125 PolarHBondContact O-N 2.92Å; H123-G126 PolarHBondContact O-N 3.15Å
124	P	93.3	Very high	95.6	Very high	84 Å²	84	53.4 Å²	53.4	55%	0.545	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-8.2	-175.7	27.4	-36.6	0	0	0	114.2	R122	R122-P124 VanDerWaalsContact C-CD 3.42Å; R122-P124 WeakPolarHBondContact O-CD 3.42Å
125	Q	94.8	Very high	95.9	Very high	155 Å²	155	51.6 Å²	51.6	72%	0.724	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	18.8	176	-59	-61.1	-36.4	0	0	112.3	H123 R225	H123-Q125 PolarHBondContact O-N 2.92Å; Q125-R225 CarbonylContact C-O 3.55Å
126	G	95.8	Very high	96	Very high	12 Å²	12	50.5 Å²	50.5	12%	0.124	25%	0.249	C	C	.	.			trans	95.2	143	-176.5	0	0	0	0	0	113.5	H123 L223 V224 R225	H123-G126 PolarHBondContact O-N 3.15Å; G126-L223 CarbonylContact C-O 3.12Å; G126-L223 WeakPolarHBondContact CA-O 3.37Å; G126-V224 WeakPolarHBondContact CA-O 3.37Å; G126-R225 PolarHBondContact N-O 3.37Å
127	C	97.3	Very high	96.1	Very high	7 Å²	7	52.7 Å²	52.7	5%	0.047	26%	0.258	C	S	.	.			trans	-64.8	152.8	177.5	-68.2	0	0	0	0	111.9	L131 T132 L223	C127-L131 HydrophobicContact CB-CD2 4.19Å; C127-L131 HydrophobicContact CB-CG 4.48Å; C127-T132 WeakPolarHBondContact CB-OG1 3.46Å; C127-L223 HydrophobicContact CB-CD2 4.41Å; C127-L223 WeakPolarHBondContact CB-O 3.49Å; C127-L223 PolarHBondContact N-O 2.87Å
128	P	96.1	Very high	96.3	Very high	67 Å²	67	51.1 Å²	51.1	44%	0.435	25%	0.249	S	C	.	.			trans	-55.7	144.3	170.2	-24.6	34.2	0	0	0	111.8	H130 L131 T132	P128-H130 VanDerWaalsContact C-N 3.28Å; P128-H130 PolarHBondContact O-N 3.29Å; P128-L131 HydrophobicContact CB-CB 4.49Å; P128-L131 WeakPolarHBondContact O-CB 3.35Å; P128-L131 PolarHBondContact O-N 2.97Å; P128-T132 PolarHBondContact O-N 3.33Å; P128-T132 PolarHBondContact O-OG1 2.99Å
129	E	94.4	Very high	96.5	Very high	100 Å²	100	47.3 Å²	47.3	47%	0.467	23%	0.231	S	C	.	.	H	α-helix	trans	-55.3	-41.5	-174.2	-177.6	173.9	-175.4	0	0	113	L131 T132 K133	E129-L131 VanDerWaalsContact C-N 3.35Å; E129-L131 PolarHBondContact O-N 3.12Å; E129-T132 PolarHBondContact O-N 3.29Å; E129-K133 HydrophobicContact CG-CD 4.27Å; E129-K133 HydrophobicContact CG-CG 4.49Å; E129-K133 WeakPolarHBondContact O-CB 3.45Å; E129-K133 WeakPolarHBondContact O-CG 3.46Å; E129-K133 PolarHBondContact O-N 2.91Å; E129-K133 WeakPolarHBondContact OE1-CE 3.33Å; E129-K133 IonicContact OE1-NZ 3.44Å; E129-K133 PolarHBondContact OE1-NZ 2.79Å
130	H	95.3	Very high	96.6	Very high	82 Å²	82	46.4 Å²	46.4	38%	0.38	23%	0.227	S	C	.	.	H	α-helix	trans	-58.7	-45.3	175.6	176.4	-87.5	0	0	0	112.3	P128 K133 Q134	P128-H130 VanDerWaalsContact C-N 3.28Å; P128-H130 PolarHBondContact O-N 3.29Å; H130-K133 PolarHBondContact O-N 2.96Å; H130-Q134 PolarHBondContact CE1-OE1 3.11Å; H130-Q134 VanDerWaalsContact O-CB 3.23Å; H130-Q134 WeakPolarHBondContact O-CB 3.4Å; H130-Q134 PolarHBondContact O-N 3.24Å
131	L	96.8	Very high	96.8	Very high	28 Å²	28	48.6 Å²	48.6	15%	0.147	24%	0.238	C	C	.	.	H	α-helix	trans	-67.1	-42.1	179.4	-178.5	60.4	0	0	0	110.8	E119 C127 P128 E129 Q134 I135	E119-L131 HydrophobicContact CB-CD2 4.27Å; E119-L131 HydrophobicContact CG-CD2 4.15Å; E119-L131 WeakPolarHBondContact OE2-CD2 3.39Å; C127-L131 HydrophobicContact CB-CD2 4.19Å; C127-L131 HydrophobicContact CB-CG 4.48Å; P128-L131 HydrophobicContact CB-CB 4.49Å; P128-L131 WeakPolarHBondContact O-CB 3.35Å; P128-L131 PolarHBondContact O-N 2.97Å; E129-L131 VanDerWaalsContact C-N 3.35Å; E129-L131 PolarHBondContact O-N 3.12Å; L131-Q134 PolarHBondContact O-N 2.83Å; L131-I135 HydrophobicContact CD1-CD1 3.71Å; L131-I135 HydrophobicContact CD1-CG1 4.02Å; L131-I135 HydrophobicContact CD2-CD1 4.43Å; L131-I135 HydrophobicContact CG-CD1 3.71Å; L131-I135 HydrophobicContact CG-CG1 4.4Å; L131-I135 WeakPolarHBondContact O-CB 3.43Å; L131-I135 VanDerWaalsContact O-CG1 3.3Å; L131-I135 WeakPolarHBondContact O-CG1 3.44Å; L131-I135 PolarHBondContact O-N 3.27Å
132	T	97.6	Very high	97	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-58.6	-48.6	174.5	-62.4	0	0	0	0	111.6	C127 P128 E129 C136 F220 L223 V224	C127-T132 WeakPolarHBondContact CB-OG1 3.46Å; P128-T132 PolarHBondContact O-N 3.33Å; P128-T132 PolarHBondContact O-OG1 2.99Å; E129-T132 PolarHBondContact O-N 3.29Å; T132-C136 WeakPolarHBondContact O-CB 3.43Å; T132-C136 PolarHBondContact O-N 2.94Å; T132-F220 HydrophobicContact CG2-CD2 3.95Å; T132-F220 HydrophobicContact CG2-CE2 3.73Å; T132-L223 HydrophobicContact CG2-CB 3.88Å; T132-L223 HydrophobicContact CG2-CD1 4.45Å; T132-V224 HydrophobicContact CG2-CG2 3.84Å
133	K	97.7	Very high	97.1	Very high	9 Å²	9	35.7 Å²	35.7	4%	0.039	18%	0.184	C	C	.	.	H	α-helix	trans	-61	-47	176.1	-75.4	-177.7	-173	178	0	111.2	E129 H130 Y137 Y317 F318 D320 Y321	E129-K133 HydrophobicContact CG-CD 4.27Å; E129-K133 HydrophobicContact CG-CG 4.49Å; E129-K133 WeakPolarHBondContact O-CB 3.45Å; E129-K133 WeakPolarHBondContact O-CG 3.46Å; E129-K133 PolarHBondContact O-N 2.91Å; E129-K133 WeakPolarHBondContact OE1-CE 3.33Å; E129-K133 IonicContact OE1-NZ 3.44Å; E129-K133 PolarHBondContact OE1-NZ 2.79Å; H130-K133 PolarHBondContact O-N 2.96Å; K133-Y137 WeakPolarHBondContact O-CB 3.34Å; K133-Y137 PolarHBondContact O-N 3Å; K133-Y317 HydrophobicContact CD-CE1 4.29Å; K133-Y317 WeakPolarHBondContact CE-O 3.38Å; K133-Y317 HydrophobicContact CG-CD1 4.33Å; K133-Y317 HydrophobicContact CG-CE1 3.52Å; K133-Y317 PolarHBondContact NZ-O 3.08Å; K133-F318 HydrophobicContact CB-CD1 4.3Å; K133-F318 HydrophobicContact CB-CE1 4.46Å; K133-F318 HydrophobicContact CG-CD1 4.27Å; K133-F318 HydrophobicContact CG-CE1 4.48Å; K133-D320 IonicContact NZ-OD1 2.86Å; K133-D320 PolarHBondContact NZ-OD1 3.04Å; K133-D320 IonicContact NZ-OD2 3.03Å; K133-D320 PolarHBondContact NZ-OD2 2.81Å; K133-Y321 HydrophobicContact CB-CD2 3.95Å; K133-Y321 HydrophobicContact CB-CG 3.98Å
134	Q	97.8	Very high	97.2	Very high	26 Å²	26	34.1 Å²	34.1	12%	0.121	18%	0.181	C	C	.	.	H	α-helix	trans	-58.1	-50.5	179	179.9	179.9	-37.7	0	0	112.5	H130 L131 Q138 G167 Y321	H130-Q134 PolarHBondContact CE1-OE1 3.11Å; H130-Q134 VanDerWaalsContact O-CB 3.23Å; H130-Q134 WeakPolarHBondContact O-CB 3.4Å; H130-Q134 PolarHBondContact O-N 3.24Å; L131-Q134 PolarHBondContact O-N 2.83Å; Q134-Q138 WeakPolarHBondContact O-CB 3.37Å; Q134-Q138 WeakPolarHBondContact O-CG 3.32Å; Q134-Q138 PolarHBondContact O-N 2.89Å; Q134-Q138 VanDerWaalsContact O-N 3.16Å; Q134-G167 PolarHBondContact NE2-O 2.89Å; Q134-Y321 HydrophobicContact CB-CE2 3.82Å; Q134-Y321 HydrophobicContact CG-CE2 4.44Å
135	I	98.6	Very high	97.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.2	-51.1	-179.4	-67.9	167.4	0	0	0	110.3	V116 L131 T139 I161 L163 V169 L223	V116-I135 HydrophobicContact CG1-CD1 4.35Å; V116-I135 HydrophobicContact CG1-CG2 4.39Å; V116-I135 HydrophobicContact CG2-CD1 4.05Å; V116-I135 HydrophobicContact CG2-CG1 4.34Å; V116-I135 HydrophobicContact CG2-CG2 3.63Å; L131-I135 HydrophobicContact CD1-CD1 3.71Å; L131-I135 HydrophobicContact CD1-CG1 4.02Å; L131-I135 HydrophobicContact CD2-CD1 4.43Å; L131-I135 HydrophobicContact CG-CD1 3.71Å; L131-I135 HydrophobicContact CG-CG1 4.4Å; L131-I135 WeakPolarHBondContact O-CB 3.43Å; L131-I135 VanDerWaalsContact O-CG1 3.3Å; L131-I135 WeakPolarHBondContact O-CG1 3.44Å; L131-I135 PolarHBondContact O-N 3.27Å; I135-T139 VanDerWaalsContact O-CB 3.26Å; I135-T139 WeakPolarHBondContact O-CB 3.17Å; I135-T139 PolarHBondContact O-N 3.46Å; I135-T139 PolarHBondContact O-OG1 2.95Å; I135-I161 HydrophobicContact CG2-CG2 4.48Å; I135-L163 HydrophobicContact CD1-CD1 4.37Å; I135-L163 HydrophobicContact CG1-CD2 4.21Å; I135-V169 HydrophobicContact CB-CG2 4.5Å; I135-L223 HydrophobicContact CB-CD1 4.05Å; I135-L223 HydrophobicContact CD1-CD2 3.88Å; I135-L223 HydrophobicContact CG2-CD1 3.75Å
136	C	98.6	Very high	97.4	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.6	-44	-175.3	-169.9	0	0	0	0	111.6	T132 T139 L140 F220 F318	T132-C136 WeakPolarHBondContact O-CB 3.43Å; T132-C136 PolarHBondContact O-N 2.94Å; C136-T139 PolarHBondContact O-N 3.01Å; C136-L140 WeakPolarHBondContact O-CG 3.47Å; C136-L140 PolarHBondContact O-N 3.43Å; C136-F220 HydrophobicContact CB-CD2 4.09Å; C136-F318 HydrophobicContact CB-CE1 4.22Å; C136-F318 HydrophobicContact CB-CZ 4.17Å
137	Y	98.6	Very high	97.4	Very high	46 Å²	46	25.8 Å²	25.8	18%	0.18	13%	0.129	C	C	.	.	H	α-helix	trans	-64	-47.8	-179.9	-174.7	-99.9	0	0	0	111.9	K133 T139 L140 L141 T313 F318 Y321 I322	K133-Y137 WeakPolarHBondContact O-CB 3.34Å; K133-Y137 PolarHBondContact O-N 3Å; Y137-T139 VanDerWaalsContact C-N 3.32Å; Y137-T139 PolarHBondContact O-N 3.42Å; Y137-L140 WeakPolarHBondContact O-CB 3.35Å; Y137-L140 PolarHBondContact O-N 3.34Å; Y137-L141 HydrophobicContact CD1-CD1 3.93Å; Y137-L141 HydrophobicContact CD1-CG 4.31Å; Y137-L141 HydrophobicContact CE1-CD1 3.59Å; Y137-L141 HydrophobicContact CE1-CD2 4.4Å; Y137-L141 HydrophobicContact CE1-CG 4.07Å; Y137-L141 WeakPolarHBondContact O-CG 3.46Å; Y137-L141 PolarHBondContact O-N 3.5Å; Y137-T313 WeakPolarHBondContact CE2-O 3.41Å; Y137-F318 HydrophobicContact CD2-CB 4.04Å; Y137-F318 AromaticContact CD2-CD1 3.94Å; Y137-F318 HydrophobicContact CD2-CD1 3.94Å; Y137-F318 HydrophobicContact CD2-CD2 4.08Å; Y137-F318 HydrophobicContact CD2-CE1 4.41Å; Y137-F318 AromaticContact CD2-CG 3.76Å; Y137-F318 HydrophobicContact CD2-CG 3.76Å; Y137-F318 HydrophobicContact CE2-CB 4.41Å; Y137-F318 HydrophobicContact CG-CD1 4.34Å; Y137-Y321 HydrophobicContact CD1-CD1 4.24Å; Y137-Y321 AromaticContact CD1-CE1 3.63Å; Y137-Y321 HydrophobicContact CD1-CE1 3.63Å; Y137-Y321 HydrophobicContact CE1-CE1 4.3Å; Y137-Y321 HydrophobicContact CG-CD1 4.16Å; Y137-Y321 AromaticContact CG-CE1 3.91Å; Y137-Y321 HydrophobicContact CG-CE1 3.91Å; Y137-I322 HydrophobicContact CE2-CD1 3.65Å; Y137-I322 HydrophobicContact CE2-CG1 3.82Å
138	Q	98.6	Very high	97.3	Very high	24 Å²	24	34 Å²	34	11%	0.112	16%	0.164	C	C	.	.	H	α-helix	trans	-68.4	-31.9	178.6	-71.1	-175.4	63.4	0	0	112.7	N91 Q134 L141 G142 V169	N91-Q138 WeakPolarHBondContact CB-O 3.45Å; N91-Q138 PolarHBondContact ND2-OE1 3.31Å; Q134-Q138 WeakPolarHBondContact O-CB 3.37Å; Q134-Q138 WeakPolarHBondContact O-CG 3.32Å; Q134-Q138 PolarHBondContact O-N 2.89Å; Q134-Q138 VanDerWaalsContact O-N 3.16Å; Q138-L141 PolarHBondContact O-N 3.39Å; Q138-G142 PolarHBondContact O-N 2.95Å; Q138-V169 HydrophobicContact CB-CB 3.64Å; Q138-V169 HydrophobicContact CB-CG1 4.39Å; Q138-V169 HydrophobicContact CB-CG2 3.74Å
139	T	98.8	Very high	97	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.2	-46.9	170.5	-61.4	0	0	0	0	110.7	I135 C136 Y137 L141 G142 V143 I156 I161 L171 I216 L219	I135-T139 VanDerWaalsContact O-CB 3.26Å; I135-T139 WeakPolarHBondContact O-CB 3.17Å; I135-T139 PolarHBondContact O-N 3.46Å; I135-T139 PolarHBondContact O-OG1 2.95Å; C136-T139 PolarHBondContact O-N 3.01Å; Y137-T139 VanDerWaalsContact C-N 3.32Å; Y137-T139 PolarHBondContact O-N 3.42Å; T139-L141 VanDerWaalsContact C-N 3.33Å; T139-L141 PolarHBondContact O-N 3.42Å; T139-G142 PolarHBondContact O-N 2.92Å; T139-V143 HydrophobicContact CG2-CG2 4.36Å; T139-V143 WeakPolarHBondContact O-CG2 3.15Å; T139-V143 PolarHBondContact O-N 2.95Å; T139-I156 HydrophobicContact CG2-CG2 4.47Å; T139-I161 HydrophobicContact CG2-CD1 4.22Å; T139-L171 HydrophobicContact CG2-CD2 4.08Å; T139-I216 HydrophobicContact CG2-CD1 4.25Å; T139-I216 HydrophobicContact CG2-CG1 4.02Å; T139-L219 HydrophobicContact CG2-CD2 4.12Å
140	L	98.7	Very high	96.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-57.6	-43.3	175.1	-77.5	166.6	0	0	0	112.1	C136 Y137 V143 A144 I216 F294 C309 L312 T313 F318	C136-L140 WeakPolarHBondContact O-CG 3.47Å; C136-L140 PolarHBondContact O-N 3.43Å; Y137-L140 WeakPolarHBondContact O-CB 3.35Å; Y137-L140 PolarHBondContact O-N 3.34Å; L140-V143 PolarHBondContact O-N 3.19Å; L140-A144 WeakPolarHBondContact O-CB 3.25Å; L140-A144 PolarHBondContact O-N 2.93Å; L140-I216 HydrophobicContact CD2-CD1 3.9Å; L140-I216 HydrophobicContact CD2-CG2 4.06Å; L140-I216 HydrophobicContact CG-CG2 4.25Å; L140-F294 HydrophobicContact CD1-CE2 4.15Å; L140-F294 HydrophobicContact CD1-CZ 4.03Å; L140-C309 HydrophobicContact CD2-CB 4.04Å; L140-L312 HydrophobicContact CD1-CB 4.02Å; L140-L312 HydrophobicContact CD2-CB 3.69Å; L140-L312 HydrophobicContact CD2-CD1 3.96Å; L140-L312 HydrophobicContact CD2-CG 4.5Å; L140-T313 HydrophobicContact CB-CG2 3.71Å; L140-F318 HydrophobicContact CD1-CE2 3.65Å; L140-F318 HydrophobicContact CD1-CZ 3.83Å
141	L	98.5	Very high	96.5	Very high	54 Å²	54	27.2 Å²	27.2	28%	0.283	13%	0.132	S	C	.	.	H	α-helix	trans	-60.5	-47.9	176.4	-68.9	176.8	0	0	0	111.9	Y137 Q138 T139 A144 Y145 T313	Y137-L141 HydrophobicContact CD1-CD1 3.93Å; Y137-L141 HydrophobicContact CD1-CG 4.31Å; Y137-L141 HydrophobicContact CE1-CD1 3.59Å; Y137-L141 HydrophobicContact CE1-CD2 4.4Å; Y137-L141 HydrophobicContact CE1-CG 4.07Å; Y137-L141 WeakPolarHBondContact O-CG 3.46Å; Y137-L141 PolarHBondContact O-N 3.5Å; Q138-L141 PolarHBondContact O-N 3.39Å; T139-L141 VanDerWaalsContact C-N 3.33Å; T139-L141 PolarHBondContact O-N 3.42Å; L141-A144 PolarHBondContact O-N 3.36Å; L141-Y145 PolarHBondContact O-N 2.95Å; L141-T313 HydrophobicContact CD2-CG2 4Å
142	G	98	Very high	96.2	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.1	-46.2	178	0	0	0	0	0	112.8	Q138 T139 Y145 C146	Q138-G142 PolarHBondContact O-N 2.95Å; T139-G142 PolarHBondContact O-N 2.92Å; G142-Y145 PolarHBondContact O-N 2.97Å; G142-C146 PolarHBondContact O-N 3.38Å; G142-C146 VanDerWaalsContact O-N 3.11Å; G142-C146 PolarHBondContact O-SG 2.93Å; G142-C146 VanDerWaalsContact O-SG 3.34Å
143	V	97.9	Very high	95.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-70.8	-39.3	179.9	177.5	0	0	0	0	111.7	T139 L140 Y145 C146 H147 I156 L171 D212 I216 C309	T139-V143 HydrophobicContact CG2-CG2 4.36Å; T139-V143 WeakPolarHBondContact O-CG2 3.15Å; T139-V143 PolarHBondContact O-N 2.95Å; L140-V143 PolarHBondContact O-N 3.19Å; V143-Y145 VanDerWaalsContact C-N 3.29Å; V143-Y145 PolarHBondContact O-N 3.47Å; V143-C146 WeakPolarHBondContact O-CB 3.32Å; V143-C146 PolarHBondContact O-N 3.04Å; V143-C146 VanDerWaalsContact O-N 3.13Å; V143-H147 VanDerWaalsContact CG1-CE1 3.41Å; V143-H147 WeakPolarHBondContact CG1-CE1 3.5Å; V143-H147 VanDerWaalsContact CG1-NE2 3.32Å; V143-H147 WeakPolarHBondContact CG1-NE2 3.23Å; V143-H147 PolarHBondContact O-CD2 2.96Å; V143-H147 PolarHBondContact O-N 3.43Å; V143-I156 HydrophobicContact CG2-CD1 3.7Å; V143-I156 HydrophobicContact CG2-CG1 4.26Å; V143-L171 HydrophobicContact CG2-CD1 3.63Å; V143-D212 HydrophobicContact CG1-CB 3.81Å; V143-I216 HydrophobicContact CB-CD1 4.11Å; V143-I216 HydrophobicContact CG1-CD1 4.22Å; V143-I216 HydrophobicContact CG2-CD1 4.05Å; V143-C309 VanDerWaalsContact CG1-SG 3.52Å
144	A	98.2	Very high	95.4	Very high	21 Å²	21	26.6 Å²	26.6	17%	0.174	13%	0.128	C	C	.	.	H	α-helix	trans	-59.4	-41.1	174.4	0	0	0	0	0	111.7	L140 L141 H147 K148 C309	L140-A144 WeakPolarHBondContact O-CB 3.25Å; L140-A144 PolarHBondContact O-N 2.93Å; L141-A144 PolarHBondContact O-N 3.36Å; A144-H147 PolarHBondContact O-N 3.46Å; A144-K148 PolarHBondContact O-N 2.96Å; A144-C309 HydrophobicContact CB-CB 3.75Å
145	Y	97.3	Very high	95	Very high	48 Å²	48	25.7 Å²	25.7	19%	0.188	12%	0.124	C	C	.	.	H	α-helix	trans	-60.6	-47.5	172.7	172.4	-93.2	0	0	0	111.6	L87 K88 H89 L92 L141 G142 V143 H147 K148 Q149	L87-Y145 HydrophobicContact CB-CE1 4.16Å; L87-Y145 HydrophobicContact CD2-CE1 3.87Å; K88-Y145 PolarHBondContact N-OH 2.88Å; K88-Y145 PolarHBondContact O-OH 2.82Å; H89-Y145 HydrophobicContact CB-CD1 3.65Å; H89-Y145 HydrophobicContact CB-CD2 4.23Å; H89-Y145 HydrophobicContact CB-CE1 3.86Å; H89-Y145 HydrophobicContact CB-CE2 4.41Å; H89-Y145 HydrophobicContact CB-CG 3.84Å; H89-Y145 AromaticContact CD2-CD2 3.86Å; H89-Y145 AromaticContact CD2-CG 3.75Å; H89-Y145 AromaticContact CG-CG 3.86Å; L92-Y145 HydrophobicContact CD1-CD1 3.77Å; L92-Y145 HydrophobicContact CD1-CE1 3.89Å; L141-Y145 PolarHBondContact O-N 2.95Å; G142-Y145 PolarHBondContact O-N 2.97Å; V143-Y145 VanDerWaalsContact C-N 3.29Å; V143-Y145 PolarHBondContact O-N 3.47Å; Y145-H147 VanDerWaalsContact C-N 3.34Å; Y145-H147 PolarHBondContact O-N 2.77Å; Y145-K148 PolarHBondContact O-N 3.1Å; Y145-Q149 HydrophobicContact CD1-CG 4.5Å; Y145-Q149 HydrophobicContact CE1-CG 4.06Å; Y145-Q149 HydrophobicContact CE2-CG 4.25Å; Y145-Q149 WeakPolarHBondContact O-CG 3.33Å; Y145-Q149 PolarHBondContact O-N 3.12Å; Y145-Q149 VanDerWaalsContact O-N 3.12Å
146	C	94.6	Very high	94.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-56.5	-47.4	175.9	-68.2	0	0	0	0	111.9	G142 V143 K148 Q149 G150 C151	G142-C146 PolarHBondContact O-N 3.38Å; G142-C146 VanDerWaalsContact O-N 3.11Å; G142-C146 PolarHBondContact O-SG 2.93Å; G142-C146 VanDerWaalsContact O-SG 3.34Å; V143-C146 WeakPolarHBondContact O-CB 3.32Å; V143-C146 PolarHBondContact O-N 3.04Å; V143-C146 VanDerWaalsContact O-N 3.13Å; C146-K148 VanDerWaalsContact C-N 3.32Å; C146-K148 PolarHBondContact O-N 2.98Å; C146-Q149 CarbonylContact O-C 3.43Å; C146-Q149 WeakPolarHBondContact O-CA 3.27Å; C146-Q149 PolarHBondContact O-N 3.4Å; C146-G150 PolarHBondContact O-N 3.42Å; C146-C151 CarbonylContact C-O 3.54Å; C146-C151 HydrophobicContact CB-CB 4.36Å; C146-C151 WeakPolarHBondContact CB-O 3.31Å; C146-C151 WeakPolarHBondContact O-CB 3.46Å; C146-C151 PolarHBondContact O-N 3.28Å; C146-C151 VanDerWaalsContact O-O 3.13Å
147	H	95.5	Very high	94.5	Very high	27 Å²	27	26.8 Å²	26.8	13%	0.125	13%	0.128	C	C	.	.	H	α-helix	trans	-59.8	-41.1	178.9	-68.9	179.2	0	0	0	111.9	V143 A144 Y145 Q149 G150 C151 T209 D212	V143-H147 VanDerWaalsContact CG1-CE1 3.41Å; V143-H147 WeakPolarHBondContact CG1-CE1 3.5Å; V143-H147 VanDerWaalsContact CG1-NE2 3.32Å; V143-H147 WeakPolarHBondContact CG1-NE2 3.23Å; V143-H147 PolarHBondContact O-CD2 2.96Å; V143-H147 PolarHBondContact O-N 3.43Å; A144-H147 PolarHBondContact O-N 3.46Å; Y145-H147 VanDerWaalsContact C-N 3.34Å; Y145-H147 PolarHBondContact O-N 2.77Å; H147-Q149 VanDerWaalsContact C-N 3.26Å; H147-Q149 PolarHBondContact O-N 2.94Å; H147-G150 WeakPolarHBondContact O-CA 3.42Å; H147-G150 PolarHBondContact O-N 3.17Å; H147-C151 PolarHBondContact N-O 2.78Å; H147-T209 HydrophobicContact CB-CG2 4Å; H147-T209 PolarHBondContact CE1-O 3.34Å; H147-D212 IonicContact CD2-OD2 3.61Å; H147-D212 IonicContact CE1-OD2 2.84Å; H147-D212 IonicContact NE2-OD2 3.68Å; H147-D212 PolarHBondContact NE2-OD2 3.4Å
148	K	95.3	Very high	94.4	Very high	179 Å²	179	24.7 Å²	24.7	78%	0.778	12%	0.12	S	C	*	.	H	α-helix	trans	-63.5	-30.6	175.3	-174.3	175	-179.6	176.3	0	112.9	A144 Y145 C146 G150	A144-K148 PolarHBondContact O-N 2.96Å; Y145-K148 PolarHBondContact O-N 3.1Å; C146-K148 VanDerWaalsContact C-N 3.32Å; C146-K148 PolarHBondContact O-N 2.98Å; K148-G150 PolarHBondContact O-N 3.01Å
149	Q	91.1	Very high	94	Very high	88 Å²	88	26.7 Å²	26.7	41%	0.411	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	8.6	173.1	-59.3	-55.4	-43.6	0	0	112.9	L87 Y145 C146 H147 C151 M179	L87-Q149 HydrophobicContact CD2-CB 3.68Å; L87-Q149 HydrophobicContact CD2-CG 3.75Å; Y145-Q149 HydrophobicContact CD1-CG 4.5Å; Y145-Q149 HydrophobicContact CE1-CG 4.06Å; Y145-Q149 HydrophobicContact CE2-CG 4.25Å; Y145-Q149 WeakPolarHBondContact O-CG 3.33Å; Y145-Q149 PolarHBondContact O-N 3.12Å; Y145-Q149 VanDerWaalsContact O-N 3.12Å; C146-Q149 CarbonylContact O-C 3.43Å; C146-Q149 WeakPolarHBondContact O-CA 3.27Å; C146-Q149 PolarHBondContact O-N 3.4Å; H147-Q149 VanDerWaalsContact C-N 3.26Å; H147-Q149 PolarHBondContact O-N 2.94Å; Q149-C151 VanDerWaalsContact C-N 3.28Å; Q149-C151 PolarHBondContact O-N 3.02Å; Q149-M179 VanDerWaalsContact O-CE 3.25Å; Q149-M179 WeakPolarHBondContact O-CE 3.34Å
150	G	89.1	Confident	93.7	Very high	20 Å²	20	27.3 Å²	27.3	21%	0.206	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	23.4	-177.7	0	0	0	0	0	113.4	C146 H147 K148 M179 L180	C146-G150 PolarHBondContact O-N 3.42Å; H147-G150 WeakPolarHBondContact O-CA 3.42Å; H147-G150 PolarHBondContact O-N 3.17Å; K148-G150 PolarHBondContact O-N 3.01Å; G150-M179 CarbonylContact O-C 3.53Å; G150-M179 VanDerWaalsContact O-CA 3.25Å; G150-M179 WeakPolarHBondContact O-CA 3.47Å; G150-L180 PolarHBondContact O-N 3.3Å
151	C	89.1	Confident	93.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	124.7	-177.6	-174.5	0	0	0	0	111.2	L87 C146 H147 Q149 R178 M179	L87-C151 HydrophobicContact CD1-CB 4.47Å; C146-C151 CarbonylContact C-O 3.54Å; C146-C151 HydrophobicContact CB-CB 4.36Å; C146-C151 WeakPolarHBondContact CB-O 3.31Å; C146-C151 WeakPolarHBondContact O-CB 3.46Å; C146-C151 PolarHBondContact O-N 3.28Å; C146-C151 VanDerWaalsContact O-O 3.13Å; H147-C151 PolarHBondContact N-O 2.78Å; Q149-C151 VanDerWaalsContact C-N 3.28Å; Q149-C151 PolarHBondContact O-N 3.02Å; C151-R178 CarbonylContact C-O 3.5Å; C151-R178 WeakPolarHBondContact CA-O 3.45Å; C151-M179 HydrophobicContact CB-SD 4.15Å
152	L	90.2	Very high	93.6	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	142.8	167.5	-50	84.8	0	0	0	109.6	R154 A177 R178 L180 Y207 G208 V211	L152-R154 HydrophobicContact CB-CG 3.98Å; L152-A177 CarbonylContact O-C 3.47Å; L152-A177 WeakPolarHBondContact O-CA 3.47Å; L152-A177 VanDerWaalsContact O-CB 3.27Å; L152-A177 WeakPolarHBondContact O-CB 3.35Å; L152-R178 HydrophobicContact CD1-CB 4.44Å; L152-R178 WeakPolarHBondContact CD1-O 3.33Å; L152-R178 PolarHBondContact N-O 3.39Å; L152-R178 PolarHBondContact O-N 2.89Å; L152-R178 VanDerWaalsContact O-N 3.11Å; L152-L180 HydrophobicContact CD1-CD2 3.49Å; L152-L180 VanDerWaalsContact CD1-CD2 3.49Å; L152-L180 HydrophobicContact CD1-CG 3.57Å; L152-L180 HydrophobicContact CD2-CD2 4.4Å; L152-L180 HydrophobicContact CG-CD2 4.2Å; L152-L180 HydrophobicContact CG-CG 4.41Å; L152-Y207 HydrophobicContact CD2-CD2 4.27Å; L152-Y207 HydrophobicContact CD2-CE2 4.48Å; L152-G208 WeakPolarHBondContact CD2-O 3.45Å; L152-V211 HydrophobicContact CD2-CG2 4.23Å
153	H	90.5	Very high	93.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.129	C	C	.	.			trans	-81.3	-48.7	176.9	-168.6	-81.1	0	0	0	112.1	D155 I156 C172 F174 D212	H153-D155 PolarHBondContact CE1-O 2.9Å; H153-D155 PolarHBondContact ND1-N 3.07Å; H153-D155 PolarHBondContact O-N 3.14Å; H153-D155 VanDerWaalsContact O-N 3.08Å; H153-I156 HydrophobicContact CB-CD1 3.9Å; H153-I156 HydrophobicContact CB-CG1 4.01Å; H153-I156 VanDerWaalsContact CG-CD1 3.45Å; H153-I156 WeakPolarHBondContact ND1-CD1 3.49Å; H153-I156 PolarHBondContact ND1-N 3.18Å; H153-C172 PolarHBondContact CE1-O 3.24Å; H153-C172 PolarHBondContact NE2-O 2.76Å; H153-C172 VanDerWaalsContact NE2-O 3.08Å; H153-F174 AromaticContact CD2-CE1 3.86Å; H153-F174 AromaticContact CD2-CZ 3.97Å; H153-D212 PolarHBondContact N-OD1 3.08Å; H153-D212 PolarHBondContact N-OD2 3.21Å
154	R	89.2	Confident	93.5	Very high	25 Å²	25	27.3 Å²	27.3	9%	0.094	13%	0.134	C	C	.	.			trans	66.1	-11.5	178.8	-63.3	177.7	48.5	171.6	-0.7	118.2	L152 F176 R178 T187 Y207 D212	L152-R154 HydrophobicContact CB-CG 3.98Å; R154-F176 HydrophobicContact CB-CB 4.49Å; R154-F176 WeakPolarHBondContact CD-O 3.25Å; R154-R178 VanDerWaalsContact NH1-CD 3.27Å; R154-T187 PolarHBondContact NH2-O 3.21Å; R154-Y207 PolarHBondContact NH1-OH 2.76Å; R154-Y207 PolarHBondContact NH2-OH 2.72Å; R154-D212 WeakPolarHBondContact CA-OD1 3.45Å; R154-D212 PolarHBondContact N-OD1 2.69Å
155	D	88.4	Confident	93.2	Very high	7 Å²	7	29.6 Å²	29.6	4%	0.037	15%	0.152	C	C	.	.			trans	-129.7	45.4	178.7	-157.5	40.2	0	0	0	112	H153 K157 N160 F176 Y189	H153-D155 PolarHBondContact CE1-O 2.9Å; H153-D155 PolarHBondContact ND1-N 3.07Å; H153-D155 PolarHBondContact O-N 3.14Å; H153-D155 VanDerWaalsContact O-N 3.08Å; D155-K157 VanDerWaalsContact CG-NZ 3.32Å; D155-K157 PolarHBondContact O-N 3.36Å; D155-K157 IonicContact OD1-NZ 2.76Å; D155-K157 PolarHBondContact OD1-NZ 3.25Å; D155-K157 VanDerWaalsContact OD1-NZ 3.14Å; D155-K157 IonicContact OD2-NZ 3.18Å; D155-K157 PolarHBondContact OD2-NZ 2.79Å; D155-N160 VanDerWaalsContact CG-ND2 3.28Å; D155-N160 PolarHBondContact O-ND2 3.36Å; D155-N160 PolarHBondContact OD2-ND2 3.08Å; D155-F176 HydrophobicContact CB-CD2 3.98Å; D155-Y189 PolarHBondContact OD1-OH 3.42Å; D155-Y189 PolarHBondContact OD2-OH 3.47Å
156	I	94.8	Very high	92.9	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	18%	0.178	C	C	.	.			trans	-74.1	116.4	173.3	-61.4	-66.1	0	0	0	108.4	T139 V143 H153 I161 L171 Y195 A215 I216	T139-I156 HydrophobicContact CG2-CG2 4.47Å; V143-I156 HydrophobicContact CG2-CD1 3.7Å; V143-I156 HydrophobicContact CG2-CG1 4.26Å; H153-I156 HydrophobicContact CB-CD1 3.9Å; H153-I156 HydrophobicContact CB-CG1 4.01Å; H153-I156 VanDerWaalsContact CG-CD1 3.45Å; H153-I156 WeakPolarHBondContact ND1-CD1 3.49Å; H153-I156 PolarHBondContact ND1-N 3.18Å; I156-I161 HydrophobicContact CG2-CD1 4.22Å; I156-L171 HydrophobicContact CD1-CD1 4.34Å; I156-L171 HydrophobicContact CD1-CD2 4.27Å; I156-Y195 WeakPolarHBondContact O-CB 3.29Å; I156-A215 HydrophobicContact CB-CB 3.79Å; I156-A215 HydrophobicContact CG2-CB 4.2Å; I156-I216 HydrophobicContact CG2-CG1 4.17Å
157	K	93.1	Very high	92.8	Very high	21 Å²	21	35.6 Å²	35.6	9%	0.091	19%	0.187	C	C	.	.	S	Bend	trans	-162.2	159	178.4	61	-177.2	-172.5	-136.4	0	110	D155 E159 N160 I161 Y195	D155-K157 VanDerWaalsContact CG-NZ 3.32Å; D155-K157 PolarHBondContact O-N 3.36Å; D155-K157 IonicContact OD1-NZ 2.76Å; D155-K157 PolarHBondContact OD1-NZ 3.25Å; D155-K157 VanDerWaalsContact OD1-NZ 3.14Å; D155-K157 IonicContact OD2-NZ 3.18Å; D155-K157 PolarHBondContact OD2-NZ 2.79Å; K157-E159 WeakPolarHBondContact CB-OE2 3.19Å; K157-E159 WeakPolarHBondContact CD-OE2 3.03Å; K157-E159 WeakPolarHBondContact CG-OE2 3.23Å; K157-E159 PolarHBondContact O-N 2.98Å; K157-E159 VanDerWaalsContact O-N 3.07Å; K157-N160 WeakPolarHBondContact CE-ND2 3.3Å; K157-N160 HydrophobicContact CG-CB 4.22Å; K157-N160 PolarHBondContact O-N 3.48Å; K157-I161 WeakPolarHBondContact O-CG1 3.45Å; K157-I161 PolarHBondContact O-N 2.91Å; K157-Y195 HydrophobicContact CB-CD2 3.57Å; K157-Y195 HydrophobicContact CB-CE2 3.62Å; K157-Y195 HydrophobicContact CB-CG 4.11Å
158	P	95.3	Very high	92.8	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-51.9	-32.7	-175.1	-30	36.6	0	0	0	115.7	V116 L117 L120 N160 Y195 L219 E222	V116-P158 HydrophobicContact CB-CB 4.2Å; V116-P158 HydrophobicContact CG1-CB 4.1Å; V116-P158 PolarHBondContact N-O 2.84Å; L117-P158 HydrophobicContact CB-CB 4.02Å; L117-P158 PolarHBondContact N-O 2.98Å; L120-P158 HydrophobicContact CD1-CB 3.78Å; L120-P158 HydrophobicContact CD1-CG 3.61Å; P158-N160 VanDerWaalsContact C-N 3.32Å; P158-N160 PolarHBondContact O-N 3.43Å; P158-Y195 WeakPolarHBondContact CD-OH 3.42Å; P158-Y195 HydrophobicContact CG-CE1 4.36Å; P158-Y195 WeakPolarHBondContact CG-OH 3.39Å; P158-L219 HydrophobicContact CG-CD1 4.07Å; P158-E222 WeakPolarHBondContact CG-OE2 3.21Å
159	E	90.6	Very high	93	Very high	66 Å²	66	29 Å²	29	31%	0.308	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-69.2	-29.8	179.8	-54.3	96.8	131.4	0	0	112.9	L117 K157	L117-E159 HydrophobicContact CB-CG 4.43Å; L117-E159 HydrophobicContact CD2-CG 3.85Å; K157-E159 WeakPolarHBondContact CB-OE2 3.19Å; K157-E159 WeakPolarHBondContact CD-OE2 3.03Å; K157-E159 WeakPolarHBondContact CG-OE2 3.23Å; K157-E159 PolarHBondContact O-N 2.98Å; K157-E159 VanDerWaalsContact O-N 3.07Å
160	N	92.9	Very high	93.3	Very high	14 Å²	14	25.4 Å²	25.4	8%	0.075	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-96.5	1	-176.2	-70.6	-8.8	0	0	0	113.4	D155 K157 P158 C172	D155-N160 VanDerWaalsContact CG-ND2 3.28Å; D155-N160 PolarHBondContact O-ND2 3.36Å; D155-N160 PolarHBondContact OD2-ND2 3.08Å; K157-N160 WeakPolarHBondContact CE-ND2 3.3Å; K157-N160 HydrophobicContact CG-CB 4.22Å; K157-N160 PolarHBondContact O-N 3.48Å; P158-N160 VanDerWaalsContact C-N 3.32Å; P158-N160 PolarHBondContact O-N 3.43Å; N160-C172 PolarHBondContact O-N 3.08Å; N160-C172 PolarHBondContact O-SG 2.72Å
161	I	96.9	Very high	93.6	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	103.2	175.9	-54.6	174.1	0	0	0	107.2	T115 V116 I135 T139 I156 K157 V169 L171 L219	T115-I161 CarbonylContact C-O 3.57Å; T115-I161 VanDerWaalsContact CA-O 3.32Å; T115-I161 WeakPolarHBondContact CA-O 3.39Å; V116-I161 HydrophobicContact CB-CB 4.22Å; V116-I161 HydrophobicContact CG2-CB 3.63Å; V116-I161 HydrophobicContact CG2-CG2 3.44Å; V116-I161 VanDerWaalsContact CG2-CG2 3.44Å; V116-I161 PolarHBondContact N-O 2.75Å; I135-I161 HydrophobicContact CG2-CG2 4.48Å; T139-I161 HydrophobicContact CG2-CD1 4.22Å; I156-I161 HydrophobicContact CG2-CD1 4.22Å; K157-I161 WeakPolarHBondContact O-CG1 3.45Å; K157-I161 PolarHBondContact O-N 2.91Å; I161-V169 HydrophobicContact CG2-CG1 3.59Å; I161-V169 HydrophobicContact CG2-CG2 4.41Å; I161-L171 HydrophobicContact CB-CD2 4.42Å; I161-L171 HydrophobicContact CG1-CD2 3.81Å; I161-L171 HydrophobicContact CG2-CD2 4.17Å; I161-L219 HydrophobicContact CD1-CD1 3.81Å; I161-L219 HydrophobicContact CD1-CD2 3.29Å; I161-L219 HydrophobicContact CD1-CG 4.17Å
162	L	97.2	Very high	93.6	Very high	31 Å²	31	25.5 Å²	25.5	16%	0.162	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	156	-179.1	-43.3	176.8	0	0	0	110.6	V93 C112 L114 T115 V169 K170 C172	V93-L162 HydrophobicContact CG2-CD1 4.38Å; C112-L162 HydrophobicContact CB-CB 3.6Å; C112-L162 HydrophobicContact CB-CD1 4.12Å; C112-L162 HydrophobicContact CB-CG 4.45Å; L114-L162 CarbonylContact O-C 3.46Å; L114-L162 WeakPolarHBondContact O-CA 3.35Å; T115-L162 HydrophobicContact CG2-CD2 3.65Å; L162-V169 CarbonylContact O-C 3.14Å; L162-V169 WeakPolarHBondContact O-CA 3.17Å; L162-K170 HydrophobicContact CB-CB 4.18Å; L162-K170 WeakPolarHBondContact CB-O 3.19Å; L162-K170 PolarHBondContact N-O 3.48Å; L162-K170 PolarHBondContact O-N 3.12Å; L162-C172 HydrophobicContact CD1-CB 3.85Å; L162-C172 HydrophobicContact CG-CB 4.13Å
163	L	97.4	Very high	93.1	Very high	8 Å²	8	27.3 Å²	27.3	4%	0.042	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	127.2	176.5	-64.2	172.6	0	0	0	109.6	C112 E113 L114 V116 E119 I135 Q168 V169	C112-L163 WeakPolarHBondContact CB-O 3.2Å; E113-L163 PolarHBondContact N-O 2.94Å; L114-L163 HydrophobicContact CB-CB 4.31Å; L114-L163 PolarHBondContact N-O 2.89Å; L114-L163 VanDerWaalsContact N-O 3.15Å; L114-L163 PolarHBondContact O-N 2.79Å; V116-L163 HydrophobicContact CG2-CD1 4.33Å; V116-L163 HydrophobicContact CG2-CG 4.38Å; E119-L163 HydrophobicContact CG-CD1 3.59Å; I135-L163 HydrophobicContact CD1-CD1 4.37Å; I135-L163 HydrophobicContact CG1-CD2 4.21Å; L163-Q168 WeakPolarHBondContact CA-O 3.4Å; L163-V169 HydrophobicContact CD2-CG2 3.74Å
164	T	96.1	Very high	92.1	Very high	15 Å²	15	27.4 Å²	27.4	9%	0.092	15%	0.149	C	C	.	.			trans	-72.5	168.2	168.6	73.6	0	0	0	0	110.7	E113 Q166 G167 Q168 K170	E113-T164 VanDerWaalsContact OE2-C 3.24Å; E113-T164 VanDerWaalsContact OE2-CA 3.27Å; E113-T164 WeakPolarHBondContact OE2-CA 3.24Å; T164-Q166 PolarHBondContact O-N 3.47Å; T164-Q166 VanDerWaalsContact O-N 3.11Å; T164-Q166 PolarHBondContact OG1-N 2.52Å; T164-Q166 PolarHBondContact OG1-OE1 3.25Å; T164-G167 WeakPolarHBondContact O-CA 3.38Å; T164-G167 PolarHBondContact O-N 2.85Å; T164-Q168 HydrophobicContact CG2-CB 4.06Å; T164-Q168 PolarHBondContact N-O 3.42Å; T164-Q168 WeakPolarHBondContact OG1-CB 3.49Å; T164-Q168 PolarHBondContact OG1-N 2.86Å; T164-Q168 VanDerWaalsContact OG1-N 3.12Å; T164-K170 HydrophobicContact CG2-CG 4.08Å
165	A	92.9	Very high	90.6	Very high	68 Å²	68	26.7 Å²	26.7	56%	0.562	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-26.5	174.3	0	0	0	0	0	113	E113 G167	E113-A165 HydrophobicContact CG-CB 3.97Å; E113-A165 PolarHBondContact OE2-N 3.01Å; A165-G167 VanDerWaalsContact C-N 3.3Å
166	Q	91.4	Very high	89.1	Confident	158 Å²	158	27.9 Å²	27.9	74%	0.738	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.5	4.2	176.6	-59.2	74.7	25.7	0	0	112.6	T164 Q168	T164-Q166 PolarHBondContact O-N 3.47Å; T164-Q166 VanDerWaalsContact O-N 3.11Å; T164-Q166 PolarHBondContact OG1-N 2.52Å; T164-Q166 PolarHBondContact OG1-OE1 3.25Å; Q166-Q168 VanDerWaalsContact C-N 3.33Å
167	G	91.8	Very high	87.2	Confident	17 Å²	17	27.8 Å²	27.8	18%	0.175	15%	0.154	C	C	.	.			trans	77	14.6	-178.8	0	0	0	0	0	114.4	Q134 T164 A165 V169	Q134-G167 PolarHBondContact NE2-O 2.89Å; T164-G167 WeakPolarHBondContact O-CA 3.38Å; T164-G167 PolarHBondContact O-N 2.85Å; A165-G167 VanDerWaalsContact C-N 3.3Å; G167-V169 PolarHBondContact O-N 2.84Å
168	Q	96.6	Very high	85.4	Confident	66 Å²	66	28.4 Å²	28.4	31%	0.308	16%	0.156	S	C	.	.			trans	-74	129.5	176.1	-173.1	173.6	-5.7	0	0	110	P90 L163 T164 Q166	P90-Q168 PolarHBondContact O-NE2 2.66Å; L163-Q168 WeakPolarHBondContact CA-O 3.4Å; T164-Q168 HydrophobicContact CG2-CB 4.06Å; T164-Q168 PolarHBondContact N-O 3.42Å; T164-Q168 WeakPolarHBondContact OG1-CB 3.49Å; T164-Q168 PolarHBondContact OG1-N 2.86Å; T164-Q168 VanDerWaalsContact OG1-N 3.12Å; Q166-Q168 VanDerWaalsContact C-N 3.33Å
169	V	98.2	Very high	83.8	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	136.7	176	167.6	0	0	0	0	110	N91 I135 Q138 I161 L162 L163 G167 L171	N91-V169 WeakPolarHBondContact CA-O 3.29Å; N91-V169 PolarHBondContact ND2-O 2.98Å; N91-V169 VanDerWaalsContact ND2-O 3.08Å; I135-V169 HydrophobicContact CB-CG2 4.5Å; Q138-V169 HydrophobicContact CB-CB 3.64Å; Q138-V169 HydrophobicContact CB-CG1 4.39Å; Q138-V169 HydrophobicContact CB-CG2 3.74Å; I161-V169 HydrophobicContact CG2-CG1 3.59Å; I161-V169 HydrophobicContact CG2-CG2 4.41Å; L162-V169 CarbonylContact O-C 3.14Å; L162-V169 WeakPolarHBondContact O-CA 3.17Å; L163-V169 HydrophobicContact CD2-CG2 3.74Å; G167-V169 PolarHBondContact O-N 2.84Å; V169-L171 HydrophobicContact CG1-CD2 4.18Å
170	K	97.6	Very high	81.9	Confident	14 Å²	14	32.7 Å²	32.7	6%	0.061	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	108.2	171.5	-59.3	-72.1	-175.9	155	0	109.5	P90 V93 E110 L162 T164	P90-K170 VanDerWaalsContact O-CD 3.29Å; P90-K170 WeakPolarHBondContact O-CD 3.18Å; P90-K170 VanDerWaalsContact O-CE 3.25Å; P90-K170 WeakPolarHBondContact O-CE 3.35Å; P90-K170 PolarHBondContact O-NZ 3.08Å; P90-K170 VanDerWaalsContact O-NZ 3.12Å; V93-K170 HydrophobicContact CB-CB 4.43Å; E110-K170 VanDerWaalsContact CD-NZ 3.31Å; E110-K170 IonicContact OE1-NZ 3.66Å; E110-K170 PolarHBondContact OE1-NZ 3.46Å; E110-K170 WeakPolarHBondContact OE2-CE 3.41Å; E110-K170 IonicContact OE2-NZ 3.53Å; E110-K170 PolarHBondContact OE2-NZ 3.02Å; L162-K170 HydrophobicContact CB-CB 4.18Å; L162-K170 WeakPolarHBondContact CB-O 3.19Å; L162-K170 PolarHBondContact N-O 3.48Å; L162-K170 PolarHBondContact O-N 3.12Å; T164-K170 HydrophobicContact CG2-CG 4.08Å
171	L	95.8	Very high	79.6	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	133.7	173.5	-55.4	177.5	0	0	0	109.9	N91 L92 V93 T139 V143 I156 I161 V169	N91-L171 WeakPolarHBondContact O-CG 3.46Å; N91-L171 PolarHBondContact O-N 2.75Å; L92-L171 HydrophobicContact CD2-CB 3.77Å; L92-L171 HydrophobicContact CD2-CD1 3.87Å; L92-L171 HydrophobicContact CD2-CG 4.17Å; V93-L171 WeakPolarHBondContact CB-O 3.11Å; V93-L171 WeakPolarHBondContact CG1-O 3.39Å; V93-L171 PolarHBondContact N-O 3.32Å; T139-L171 HydrophobicContact CG2-CD2 4.08Å; V143-L171 HydrophobicContact CG2-CD1 3.63Å; I156-L171 HydrophobicContact CD1-CD1 4.34Å; I156-L171 HydrophobicContact CD1-CD2 4.27Å; I161-L171 HydrophobicContact CB-CD2 4.42Å; I161-L171 HydrophobicContact CG1-CD2 3.81Å; I161-L171 HydrophobicContact CG2-CD2 4.17Å; V169-L171 HydrophobicContact CG1-CD2 4.18Å
172	C	89.6	Confident	76.6	Confident	20 Å²	20	41 Å²	41	14%	0.135	23%	0.234	C	C	.	.			trans	-130.9	178.9	179.2	75.2	0	0	0	0	112	V93 H153 N160 L162	V93-C172 HydrophobicContact CB-CB 4.15Å; V93-C172 HydrophobicContact CG1-CB 3.69Å; H153-C172 PolarHBondContact CE1-O 3.24Å; H153-C172 PolarHBondContact NE2-O 2.76Å; H153-C172 VanDerWaalsContact NE2-O 3.08Å; N160-C172 PolarHBondContact O-N 3.08Å; N160-C172 PolarHBondContact O-SG 2.72Å; L162-C172 HydrophobicContact CD1-CB 3.85Å; L162-C172 HydrophobicContact CG-CB 4.13Å
173	D	77.9	Confident	73.8	Confident	40 Å²	40	43.4 Å²	43.4	21%	0.214	27%	0.267	C	S	.	.			trans	59.8	62.3	-179.9	-152.8	10.4	0	0	0	115.5	K62 G175	K62-D173 IonicContact NZ-OD1 2.7Å; D173-G175 PolarHBondContact O-N 3.14Å
174	F	69.6	Low	71	Confident	1 Å²	1	47.9 Å²	47.9	0%	0.004	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-72.9	13.9	169.4	-71	-97.1	0	0	0	113.2	L84 L87 L92 H153 F176 A177	L84-F174 HydrophobicContact CD2-CD2 3.77Å; L84-F174 HydrophobicContact CD2-CE2 4.24Å; L84-F174 HydrophobicContact CD2-CG 4.44Å; L87-F174 HydrophobicContact CD1-CD1 4.12Å; L87-F174 HydrophobicContact CD1-CE1 3.78Å; L87-F174 HydrophobicContact CD1-CZ 4.42Å; L92-F174 HydrophobicContact CD1-CZ 4.08Å; L92-F174 HydrophobicContact CD2-CE2 4.31Å; L92-F174 HydrophobicContact CD2-CZ 3.69Å; L92-F174 HydrophobicContact CG-CZ 4.36Å; H153-F174 AromaticContact CD2-CE1 3.86Å; H153-F174 AromaticContact CD2-CZ 3.97Å; F174-F176 PolarHBondContact O-N 3.28Å; F174-F176 VanDerWaalsContact O-N 3.1Å; F174-A177 HydrophobicContact CB-CB 3.8Å; F174-A177 HydrophobicContact CD1-CB 3.59Å; F174-A177 HydrophobicContact CG-CB 4.17Å; F174-A177 VanDerWaalsContact O-CB 3.27Å; F174-A177 WeakPolarHBondContact O-CB 3.32Å; F174-A177 PolarHBondContact O-N 3.43Å
175	G	59	Low	68.2	Low	11 Å²	11	53.3 Å²	53.3	11%	0.113	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-57.4	-25.5	179.5	0	0	0	0	0	113.2	D173	D173-G175 PolarHBondContact O-N 3.14Å
176	F	55.6	Low	66	Low	31 Å²	31	51.2 Å²	51.2	14%	0.136	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-106	-1.9	177.2	-55.4	-65.3	0	0	0	114.1	Y44 R154 D155 F174 Y189	Y44-F176 HydrophobicContact CE2-CE1 4.16Å; Y44-F176 AromaticContact CE2-CZ 3.85Å; Y44-F176 HydrophobicContact CE2-CZ 3.85Å; Y44-F176 WeakPolarHBondContact OH-CE1 3.29Å; R154-F176 HydrophobicContact CB-CB 4.49Å; R154-F176 WeakPolarHBondContact CD-O 3.25Å; D155-F176 HydrophobicContact CB-CD2 3.98Å; F174-F176 PolarHBondContact O-N 3.28Å; F174-F176 VanDerWaalsContact O-N 3.1Å; F176-Y189 HydrophobicContact CB-CE2 4.28Å; F176-Y189 AromaticContact CD1-CD2 3.99Å; F176-Y189 HydrophobicContact CD1-CD2 3.99Å; F176-Y189 AromaticContact CD1-CE2 3.3Å; F176-Y189 HydrophobicContact CD1-CE2 3.3Å; F176-Y189 AromaticContact CD2-CE2 3.71Å; F176-Y189 HydrophobicContact CD2-CE2 3.71Å; F176-Y189 AromaticContact CD2-CZ 3.78Å; F176-Y189 WeakPolarHBondContact CD2-OH 3.4Å; F176-Y189 HydrophobicContact CE1-CD2 4.11Å; F176-Y189 AromaticContact CE1-CE2 3.38Å; F176-Y189 HydrophobicContact CE1-CE2 3.38Å; F176-Y189 AromaticContact CE2-CE2 3.77Å; F176-Y189 HydrophobicContact CE2-CE2 3.77Å; F176-Y189 AromaticContact CE2-CZ 3.94Å; F176-Y189 WeakPolarHBondContact CE2-OH 3.29Å; F176-Y189 HydrophobicContact CG-CD2 4.43Å; F176-Y189 AromaticContact CG-CE2 3.45Å; F176-Y189 HydrophobicContact CG-CE2 3.45Å; F176-Y189 VanDerWaalsContact CG-CE2 3.45Å; F176-Y189 AromaticContact CG-CZ 3.89Å; F176-Y189 AromaticContact CZ-CE2 3.6Å; F176-Y189 HydrophobicContact CZ-CE2 3.6Å
177	A	55.3	Low	63.7	Low	0 Å²	0	48.1 Å²	48.1	0%	0	29%	0.286	C	S	.	.			trans	-65.6	139.3	-177.4	0	0	0	0	0	111.3	R79 L83 L152 F174	R79-A177 PolarHBondContact NE-O 2.92Å; R79-A177 PolarHBondContact NH2-O 2.74Å; L83-A177 HydrophobicContact CD1-CB 3.9Å; L152-A177 CarbonylContact O-C 3.47Å; L152-A177 WeakPolarHBondContact O-CA 3.47Å; L152-A177 VanDerWaalsContact O-CB 3.27Å; L152-A177 WeakPolarHBondContact O-CB 3.35Å; F174-A177 HydrophobicContact CB-CB 3.8Å; F174-A177 HydrophobicContact CD1-CB 3.59Å; F174-A177 HydrophobicContact CG-CB 4.17Å; F174-A177 VanDerWaalsContact O-CB 3.27Å; F174-A177 WeakPolarHBondContact O-CB 3.32Å; F174-A177 PolarHBondContact O-N 3.43Å
178	R	56.2	Low	61.2	Low	34 Å²	34	52.5 Å²	52.5	13%	0.128	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141.3	180	-59.3	-155.3	178.4	-168.9	11.9	112.5	R79 C151 L152 R154 Y186 T187	R79-R178 VanDerWaalsContact NH2-CA 3.31Å; C151-R178 CarbonylContact C-O 3.5Å; C151-R178 WeakPolarHBondContact CA-O 3.45Å; L152-R178 HydrophobicContact CD1-CB 4.44Å; L152-R178 WeakPolarHBondContact CD1-O 3.33Å; L152-R178 PolarHBondContact N-O 3.39Å; L152-R178 PolarHBondContact O-N 2.89Å; L152-R178 VanDerWaalsContact O-N 3.11Å; R154-R178 VanDerWaalsContact NH1-CD 3.27Å; R178-Y186 HydrophobicContact CB-CE1 4.34Å; R178-T187 PolarHBondContact NH2-OG1 2.92Å
179	M	61.1	Low	58.9	Low	83 Å²	83	51 Å²	51	41%	0.409	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	131.9	166.2	-63.4	-61.3	-64.3	0	0	107.7	L83 Q149 G150 C151 S181	L83-M179 HydrophobicContact CD2-CG 4.16Å; L83-M179 HydrophobicContact CD2-SD 3.65Å; Q149-M179 VanDerWaalsContact O-CE 3.25Å; Q149-M179 WeakPolarHBondContact O-CE 3.34Å; G150-M179 CarbonylContact O-C 3.53Å; G150-M179 VanDerWaalsContact O-CA 3.25Å; G150-M179 WeakPolarHBondContact O-CA 3.47Å; C151-M179 HydrophobicContact CB-SD 4.15Å; M179-S181 PolarHBondContact O-N 3.03Å
180	L	51.4	Low	56.3	Low	74 Å²	74	58 Å²	58	39%	0.387	34%	0.339	S	S	.	.			trans	-61.1	115.6	170.7	-73.1	165.6	0	0	0	108.2	G150 L152 T209	G150-L180 PolarHBondContact O-N 3.3Å; L152-L180 HydrophobicContact CD1-CD2 3.49Å; L152-L180 VanDerWaalsContact CD1-CD2 3.49Å; L152-L180 HydrophobicContact CD1-CG 3.57Å; L152-L180 HydrophobicContact CD2-CD2 4.4Å; L152-L180 HydrophobicContact CG-CD2 4.2Å; L152-L180 HydrophobicContact CG-CG 4.41Å; L180-T209 HydrophobicContact CD1-CG2 4.02Å
181	S	43.2	Very low	54.4	Low	49 Å²	49	58.4 Å²	58.4	34%	0.343	35%	0.345	S	S	.	.			trans	-126.9	126.6	171.9	-62.2	0	0	0	0	108.6	M179 G183	M179-S181 PolarHBondContact O-N 3.03Å; S181-G183 PolarHBondContact O-N 2.93Å
182	P	35.5	Very low	53.3	Low	139 Å²	139	60.5 Å²	60.5	90%	0.903	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	123.2	176.7	-21.1	31.7	0	0	0	110.7
183	G	38.6	Very low	53.2	Low	83 Å²	83	62.9 Å²	62.9	86%	0.856	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.1	6.2	172.8	0	0	0	0	0	117.1	S181	S181-G183 PolarHBondContact O-N 2.93Å
184	E	38	Very low	54	Low	102 Å²	102	65.4 Å²	65.4	48%	0.477	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-84.9	126.8	172.4	-80.8	-163.1	156	0	0	112.3	Y186	E184-Y186 HydrophobicContact CB-CE1 4.28Å
185	N	36.1	Very low	55.3	Low	128 Å²	128	66 Å²	66	68%	0.684	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-73.2	130.3	167.4	-72.2	-32.3	0	0	0	110.1	T205	N185-T205 PolarHBondContact OD1-OG1 3.36Å
186	Y	48.2	Very low	57	Low	25 Å²	25	66.3 Å²	66.3	10%	0.098	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-101.9	146.9	179.9	-51.7	-69.1	0	0	0	112.4	R178 E184 T205 Y207	R178-Y186 HydrophobicContact CB-CE1 4.34Å; E184-Y186 HydrophobicContact CB-CE1 4.28Å; Y186-T205 WeakPolarHBondContact CD2-O 3.48Å; Y186-Y207 WeakPolarHBondContact CB-OH 3.38Å; Y186-Y207 HydrophobicContact CD2-CD1 4.18Å; Y186-Y207 HydrophobicContact CD2-CD2 4.31Å; Y186-Y207 AromaticContact CD2-CE1 3.68Å; Y186-Y207 HydrophobicContact CD2-CE1 3.68Å; Y186-Y207 AromaticContact CD2-CE2 3.79Å; Y186-Y207 HydrophobicContact CD2-CE2 3.79Å; Y186-Y207 AromaticContact CD2-CZ 3.49Å; Y186-Y207 VanDerWaalsContact CD2-CZ 3.49Å; Y186-Y207 HydrophobicContact CE2-CE2 4.37Å; Y186-Y207 HydrophobicContact CG-CE1 4.06Å; Y186-Y207 HydrophobicContact CG-CE2 4.14Å; Y186-Y207 AromaticContact CG-CZ 3.62Å
187	T	42.2	Very low	59	Low	93 Å²	93	64.9 Å²	64.9	57%	0.571	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-89.8	152.5	-169.8	61.9	0	0	0	0	114	R154 R178	R154-T187 PolarHBondContact NH2-O 3.21Å; R178-T187 PolarHBondContact NH2-OG1 2.92Å
188	D	39.5	Very low	61	Low	109 Å²	109	64.9 Å²	64.9	58%	0.583	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-67.2	154.3	174.9	-106	-29.1	0	0	0	114.1
189	Y	48	Very low	62.9	Low	35 Å²	35	63.4 Å²	63.4	14%	0.137	36%	0.36	C	S	.	.			trans	-130.2	139.6	-152.5	-169.7	-130.1	0	0	0	114.5	D155 F176 A191 R196	D155-Y189 PolarHBondContact OD1-OH 3.42Å; D155-Y189 PolarHBondContact OD2-OH 3.47Å; F176-Y189 HydrophobicContact CB-CE2 4.28Å; F176-Y189 AromaticContact CD1-CD2 3.99Å; F176-Y189 HydrophobicContact CD1-CD2 3.99Å; F176-Y189 AromaticContact CD1-CE2 3.3Å; F176-Y189 HydrophobicContact CD1-CE2 3.3Å; F176-Y189 AromaticContact CD2-CE2 3.71Å; F176-Y189 HydrophobicContact CD2-CE2 3.71Å; F176-Y189 AromaticContact CD2-CZ 3.78Å; F176-Y189 WeakPolarHBondContact CD2-OH 3.4Å; F176-Y189 HydrophobicContact CE1-CD2 4.11Å; F176-Y189 AromaticContact CE1-CE2 3.38Å; F176-Y189 HydrophobicContact CE1-CE2 3.38Å; F176-Y189 AromaticContact CE2-CE2 3.77Å; F176-Y189 HydrophobicContact CE2-CE2 3.77Å; F176-Y189 AromaticContact CE2-CZ 3.94Å; F176-Y189 WeakPolarHBondContact CE2-OH 3.29Å; F176-Y189 HydrophobicContact CG-CD2 4.43Å; F176-Y189 AromaticContact CG-CE2 3.45Å; F176-Y189 HydrophobicContact CG-CE2 3.45Å; F176-Y189 VanDerWaalsContact CG-CE2 3.45Å; F176-Y189 AromaticContact CG-CZ 3.89Å; F176-Y189 AromaticContact CZ-CE2 3.6Å; F176-Y189 HydrophobicContact CZ-CE2 3.6Å; Y189-A191 HydrophobicContact CD1-CB 4.21Å; Y189-A191 HydrophobicContact CE1-CB 3.4Å; Y189-A191 HydrophobicContact CE2-CB 4.09Å; Y189-A191 VanDerWaalsContact OH-CB 3.23Å; Y189-A191 WeakPolarHBondContact OH-CB 3.47Å; Y189-R196 VanDerWaalsContact C-NH2 3.26Å; Y189-R196 VanDerWaalsContact O-CZ 3.3Å; Y189-R196 PolarHBondContact O-NH1 3.29Å; Y189-R196 PolarHBondContact O-NH2 2.97Å
190	V	44.3	Very low	64.4	Low	145 Å²	145	60.7 Å²	60.7	88%	0.879	35%	0.347	S	S	*	.			trans	-120	65.6	179	-168.4	0	0	0	0	111.7
191	A	57.6	Low	66.4	Low	23 Å²	23	57.3 Å²	57.3	19%	0.19	33%	0.329	C	S	.	.	S	Bend	trans	-136.4	178	166.2	0	0	0	0	0	111.8	Y189 R193 R196	Y189-A191 HydrophobicContact CD1-CB 4.21Å; Y189-A191 HydrophobicContact CE1-CB 3.4Å; Y189-A191 HydrophobicContact CE2-CB 4.09Å; Y189-A191 VanDerWaalsContact OH-CB 3.23Å; Y189-A191 WeakPolarHBondContact OH-CB 3.47Å; A191-R193 PolarHBondContact O-N 3.39Å; A191-R193 VanDerWaalsContact O-N 3.08Å; A191-R196 PolarHBondContact O-NH2 3.35Å
192	T	71.9	Confident	68.8	Low	46 Å²	46	55 Å²	55	28%	0.282	31%	0.313	S	S	.	.			trans	-44.6	113.9	177.4	-47.5	0	0	0	0	111.4	W194 Y195	T192-W194 VanDerWaalsContact C-N 3.34Å; T192-W194 HydrophobicContact CG2-CB 4.24Å; T192-W194 HydrophobicContact CG2-CD2 3.77Å; T192-W194 HydrophobicContact CG2-CE3 3.95Å; T192-W194 HydrophobicContact CG2-CG 3.89Å; T192-Y195 HydrophobicContact CG2-CD2 4.42Å; T192-Y195 HydrophobicContact CG2-CE2 4.12Å
193	R	88.1	Confident	71.5	Confident	69 Å²	69	49.3 Å²	49.3	26%	0.26	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-81.7	-11.1	-171.5	67.7	-176.6	62.8	77.2	1	114.6	A191 Y195 R196 L201 G232 R233 S234 D235 Q238	A191-R193 PolarHBondContact O-N 3.39Å; A191-R193 VanDerWaalsContact O-N 3.08Å; R193-Y195 PolarHBondContact O-N 3.49Å; R193-Y195 VanDerWaalsContact O-N 3.11Å; R193-R196 WeakPolarHBondContact O-CB 3.39Å; R193-R196 PolarHBondContact O-N 2.9Å; R193-L201 HydrophobicContact CB-CD2 4.38Å; R193-G232 WeakPolarHBondContact CD-O 3.48Å; R193-G232 PolarHBondContact NH1-O 2.94Å; R193-R233 PolarHBondContact NH1-O 3.39Å; R193-S234 WeakPolarHBondContact CD-O 3.3Å; R193-D235 WeakPolarHBondContact CD-OD1 3.46Å; R193-D235 IonicContact NE-OD1 2.71Å; R193-D235 PolarHBondContact NE-OD1 2.75Å; R193-Q238 HydrophobicContact CG-CB 4.3Å; R193-Q238 HydrophobicContact CG-CG 4.32Å
194	W	94.9	Very high	74	Confident	93 Å²	93	45.9 Å²	45.9	35%	0.352	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-60.4	-26	-170.7	-55.2	-16.4	0	0	0	113.9	T192 A228 P231 G232 Q238	T192-W194 VanDerWaalsContact C-N 3.34Å; T192-W194 HydrophobicContact CG2-CB 4.24Å; T192-W194 HydrophobicContact CG2-CD2 3.77Å; T192-W194 HydrophobicContact CG2-CE3 3.95Å; T192-W194 HydrophobicContact CG2-CG 3.89Å; W194-A228 HydrophobicContact CD2-CB 4.23Å; W194-A228 HydrophobicContact CE3-CB 3.58Å; W194-A228 HydrophobicContact CZ3-CB 4.03Å; W194-P231 HydrophobicContact CD2-CB 4.25Å; W194-P231 HydrophobicContact CH2-CB 4.49Å; W194-P231 HydrophobicContact CZ2-CB 4.03Å; W194-G232 PolarHBondContact NE1-O 3.44Å; W194-Q238 PolarHBondContact O-NE2 2.89Å
195	Y	96.3	Very high	76.3	Confident	15 Å²	15	43.4 Å²	43.4	6%	0.059	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-102.6	3.2	-179.5	-48.6	-87.6	0	0	0	113.3	I156 K157 P158 T192 R193 A215 C218 E222	I156-Y195 WeakPolarHBondContact O-CB 3.29Å; K157-Y195 HydrophobicContact CB-CD2 3.57Å; K157-Y195 HydrophobicContact CB-CE2 3.62Å; K157-Y195 HydrophobicContact CB-CG 4.11Å; P158-Y195 WeakPolarHBondContact CD-OH 3.42Å; P158-Y195 HydrophobicContact CG-CE1 4.36Å; P158-Y195 WeakPolarHBondContact CG-OH 3.39Å; T192-Y195 HydrophobicContact CG2-CD2 4.42Å; T192-Y195 HydrophobicContact CG2-CE2 4.12Å; R193-Y195 PolarHBondContact O-N 3.49Å; R193-Y195 VanDerWaalsContact O-N 3.11Å; Y195-A215 WeakPolarHBondContact O-CB 3.49Å; Y195-C218 HydrophobicContact CD1-CB 3.68Å; Y195-C218 HydrophobicContact CE1-CB 4.36Å; Y195-E222 WeakPolarHBondContact CE1-OE2 3.32Å; Y195-E222 VanDerWaalsContact CZ-OE2 3.23Å; Y195-E222 VanDerWaalsContact OH-CD 3.25Å; Y195-E222 PolarHBondContact OH-OE1 2.89Å; Y195-E222 PolarHBondContact OH-OE2 2.79Å
196	R	94.8	Very high	78.7	Confident	17 Å²	17	44.2 Å²	44.2	6%	0.064	23%	0.233	C	C	.	.			trans	-78.4	136	-178.9	-64.9	-178.6	-167	-169.9	4.3	110.8	Y189 A191 R193 L200 L201 W214	Y189-R196 VanDerWaalsContact C-NH2 3.26Å; Y189-R196 VanDerWaalsContact O-CZ 3.3Å; Y189-R196 PolarHBondContact O-NH1 3.29Å; Y189-R196 PolarHBondContact O-NH2 2.97Å; A191-R196 PolarHBondContact O-NH2 3.35Å; R193-R196 WeakPolarHBondContact O-CB 3.39Å; R193-R196 PolarHBondContact O-N 2.9Å; R196-L200 HydrophobicContact CB-CB 4.43Å; R196-L201 HydrophobicContact CB-CD1 4.41Å; R196-L201 HydrophobicContact CB-CD2 3.94Å; R196-L201 HydrophobicContact CB-CG 3.89Å; R196-W214 PolarHBondContact O-NE1 2.75Å
197	A	97.1	Very high	80.7	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.232	C	C	.	.			trans	-69.4	155.4	173.9	0	0	0	0	0	111.8	E199 L200 L201 V211 W214	A197-E199 VanDerWaalsContact C-N 3.27Å; A197-E199 VanDerWaalsContact CB-CD 3.43Å; A197-E199 HydrophobicContact CB-CG 4.27Å; A197-E199 WeakPolarHBondContact CB-OE1 3.29Å; A197-E199 WeakPolarHBondContact CB-OE2 3.29Å; A197-E199 PolarHBondContact O-N 3.49Å; A197-L200 WeakPolarHBondContact O-CB 3.47Å; A197-L200 PolarHBondContact O-N 3.4Å; A197-L201 PolarHBondContact O-N 2.95Å; A197-L201 VanDerWaalsContact O-N 3.13Å; A197-V211 HydrophobicContact CB-CB 4.33Å; A197-V211 HydrophobicContact CB-CG1 4.29Å; A197-W214 VanDerWaalsContact CA-CD1 3.45Å; A197-W214 HydrophobicContact CB-CB 3.77Å; A197-W214 HydrophobicContact CB-CD2 4.09Å; A197-W214 HydrophobicContact CB-CG 3.63Å
198	P	97.3	Very high	83.1	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-54.8	-40.7	-179.5	-25.7	34.4	0	0	0	113.6	L200 L201 V202 W214 L239 I242 L249	P198-L200 VanDerWaalsContact C-N 3.27Å; P198-L200 PolarHBondContact O-N 3.12Å; P198-L201 PolarHBondContact O-N 2.75Å; P198-L201 VanDerWaalsContact O-N 3.15Å; P198-V202 WeakPolarHBondContact O-CG2 3.29Å; P198-V202 PolarHBondContact O-N 3.4Å; P198-W214 HydrophobicContact CG-CH2 3.67Å; P198-W214 HydrophobicContact CG-CZ2 4.01Å; P198-W214 HydrophobicContact CG-CZ3 3.98Å; P198-L239 HydrophobicContact CB-CD2 4.46Å; P198-I242 HydrophobicContact CG-CD1 4.4Å; P198-I242 HydrophobicContact CG-CG2 4.15Å; P198-L249 HydrophobicContact CB-CD2 4.02Å
199	E	96.2	Very high	85.8	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.019	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-32.4	178.1	61.1	-89.2	-153.4	0	0	112.9	A197 V202 D204 V211 R306	A197-E199 VanDerWaalsContact C-N 3.27Å; A197-E199 VanDerWaalsContact CB-CD 3.43Å; A197-E199 HydrophobicContact CB-CG 4.27Å; A197-E199 WeakPolarHBondContact CB-OE1 3.29Å; A197-E199 WeakPolarHBondContact CB-OE2 3.29Å; A197-E199 PolarHBondContact O-N 3.49Å; E199-V202 WeakPolarHBondContact O-CG2 3.31Å; E199-D204 HydrophobicContact CB-CB 4.24Å; E199-D204 WeakPolarHBondContact O-CB 3.42Å; E199-D204 PolarHBondContact O-N 3.01Å; E199-V211 HydrophobicContact CG-CG1 4.03Å; E199-V211 WeakPolarHBondContact OE1-CG1 3.11Å; E199-R306 IonicContact OE1-CZ 3.68Å; E199-R306 IonicContact OE1-NH1 3.14Å; E199-R306 PolarHBondContact OE1-NH1 3.32Å; E199-R306 IonicContact OE1-NH2 2.63Å; E199-R306 PolarHBondContact OE1-NH2 3.24Å; E199-R306 IonicContact OE2-CZ 2.68Å; E199-R306 IonicContact OE2-NH1 3.19Å; E199-R306 IonicContact OE2-NH2 3.28Å; E199-R306 PolarHBondContact OE2-NH2 2.93Å
200	L	93.3	Very high	88.2	Confident	26 Å²	26	37.1 Å²	37.1	14%	0.136	20%	0.202	C	C	.	.	H	α-helix	trans	-75.1	-37.5	174.5	-67.8	178.5	0	0	0	111.4	R196 A197 P198 G203 Y207 V211	R196-L200 HydrophobicContact CB-CB 4.43Å; A197-L200 WeakPolarHBondContact O-CB 3.47Å; A197-L200 PolarHBondContact O-N 3.4Å; P198-L200 VanDerWaalsContact C-N 3.27Å; P198-L200 PolarHBondContact O-N 3.12Å; L200-G203 PolarHBondContact O-N 3.36Å; L200-Y207 HydrophobicContact CD2-CD1 3.67Å; L200-Y207 HydrophobicContact CD2-CD2 3.88Å; L200-Y207 HydrophobicContact CD2-CE1 3.64Å; L200-Y207 HydrophobicContact CD2-CE2 3.86Å; L200-Y207 HydrophobicContact CD2-CG 3.73Å; L200-V211 HydrophobicContact CD1-CB 3.87Å; L200-V211 HydrophobicContact CD1-CG1 4Å; L200-V211 HydrophobicContact CD1-CG2 4.35Å; L200-V211 HydrophobicContact CD2-CG1 4.19Å; L200-V211 HydrophobicContact CG-CB 4.32Å; L200-V211 HydrophobicContact CG-CG1 3.88Å
201	L	93.9	Very high	90.7	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.016	16%	0.161	C	C	.	.	H	α-helix	trans	-71.1	-31.5	-177.5	-70.9	165.2	0	0	0	112.9	R193 R196 A197 P198 G203 D235 Q238 L239 I242 F263	R193-L201 HydrophobicContact CB-CD2 4.38Å; R196-L201 HydrophobicContact CB-CD1 4.41Å; R196-L201 HydrophobicContact CB-CD2 3.94Å; R196-L201 HydrophobicContact CB-CG 3.89Å; A197-L201 PolarHBondContact O-N 2.95Å; A197-L201 VanDerWaalsContact O-N 3.13Å; P198-L201 PolarHBondContact O-N 2.75Å; P198-L201 VanDerWaalsContact O-N 3.15Å; L201-G203 VanDerWaalsContact C-N 3.3Å; L201-D235 HydrophobicContact CD2-CB 4.13Å; L201-Q238 HydrophobicContact CD1-CB 4.1Å; L201-Q238 HydrophobicContact CD1-CG 3.45Å; L201-Q238 VanDerWaalsContact CD1-CG 3.45Å; L201-Q238 HydrophobicContact CD2-CB 4.18Å; L201-Q238 HydrophobicContact CD2-CG 3.96Å; L201-Q238 HydrophobicContact CG-CG 4.37Å; L201-L239 HydrophobicContact CB-CD1 4.21Å; L201-L239 HydrophobicContact CB-CD2 3.61Å; L201-L239 HydrophobicContact CB-CG 3.81Å; L201-L239 HydrophobicContact CD1-CD2 3.91Å; L201-L239 HydrophobicContact CD1-CG 4.21Å; L201-L239 HydrophobicContact CG-CD2 4.43Å; L201-I242 HydrophobicContact CD1-CD1 3.62Å; L201-F263 VanDerWaalsContact O-CZ 3.31Å; L201-F263 WeakPolarHBondContact O-CZ 3.44Å
202	V	94.2	Very high	92.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-12.1	174.5	-58.5	0	0	0	0	113	P198 E199 D204 L239 L249 H253 I256 F257 N260	P198-V202 WeakPolarHBondContact O-CG2 3.29Å; P198-V202 PolarHBondContact O-N 3.4Å; E199-V202 WeakPolarHBondContact O-CG2 3.31Å; V202-D204 HydrophobicContact CG2-CB 4.34Å; V202-L239 HydrophobicContact CG1-CD1 3.91Å; V202-L239 HydrophobicContact CG1-CD2 4.07Å; V202-L249 HydrophobicContact CG1-CD1 4.12Å; V202-H253 HydrophobicContact CG1-CB 4.21Å; V202-H253 HydrophobicContact CG2-CB 4.09Å; V202-I256 HydrophobicContact CB-CG2 4.45Å; V202-I256 HydrophobicContact CG2-CB 4.39Å; V202-I256 HydrophobicContact CG2-CG2 4.11Å; V202-I256 WeakPolarHBondContact O-CG2 3.5Å; V202-F257 HydrophobicContact CB-CB 4.16Å; V202-F257 HydrophobicContact CG1-CB 4.07Å; V202-F257 HydrophobicContact CG1-CD2 4.25Å; V202-N260 PolarHBondContact O-ND2 3.42Å
203	G	90.3	Very high	93.9	Very high	19 Å²	19	27.2 Å²	27.2	20%	0.196	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	28.4	-176.8	0	0	0	0	0	114.2	L200 L201 T205	L200-G203 PolarHBondContact O-N 3.36Å; L201-G203 VanDerWaalsContact C-N 3.3Å; G203-T205 PolarHBondContact O-N 2.92Å
204	D	91.6	Very high	94.4	Very high	11 Å²	11	24 Å²	24	6%	0.059	13%	0.127	C	C	.	.			trans	-62.8	131.7	169.5	-164.3	-19	0	0	0	108	E199 V202 Q206 Y207 R252 I256	E199-D204 HydrophobicContact CB-CB 4.24Å; E199-D204 WeakPolarHBondContact O-CB 3.42Å; E199-D204 PolarHBondContact O-N 3.01Å; V202-D204 HydrophobicContact CG2-CB 4.34Å; D204-Q206 WeakPolarHBondContact OD1-CB 3.33Å; D204-Q206 PolarHBondContact OD1-N 3.11Å; D204-Y207 WeakPolarHBondContact O-CD1 3.47Å; D204-Y207 WeakPolarHBondContact O-CE1 3.41Å; D204-R252 IonicContact OD1-NH2 3.55Å; D204-R252 PolarHBondContact OD1-NH2 3.38Å; D204-R252 IonicContact OD2-CZ 3.36Å; D204-R252 IonicContact OD2-NE 2.68Å; D204-R252 PolarHBondContact OD2-NE 3.27Å; D204-R252 IonicContact OD2-NH2 3.29Å; D204-R252 PolarHBondContact OD2-NH2 3.02Å; D204-I256 HydrophobicContact CB-CD1 3.66Å; D204-I256 VanDerWaalsContact OD2-CD1 3.23Å; D204-I256 WeakPolarHBondContact OD2-CD1 3.46Å
205	T	86.6	Confident	94.6	Very high	50 Å²	50	19.8 Å²	19.8	31%	0.307	11%	0.112	S	C	.	.	S	Bend	trans	-90.5	-11.9	176.3	60.4	0	0	0	0	112.2	N185 Y186 G203 Y207	N185-T205 PolarHBondContact OD1-OG1 3.36Å; Y186-T205 WeakPolarHBondContact CD2-O 3.48Å; G203-T205 PolarHBondContact O-N 2.92Å; T205-Y207 PolarHBondContact O-N 2.78Å
206	Q	87.5	Confident	94.7	Very high	145 Å²	145	19 Å²	19	68%	0.678	11%	0.109	S	C	*	.			trans	-98	59.8	-179	-59.2	179.9	14.1	0	0	111.4	D204	D204-Q206 WeakPolarHBondContact OD1-CB 3.33Å; D204-Q206 PolarHBondContact OD1-N 3.11Å
207	Y	89.6	Confident	94.9	Very high	22 Å²	22	18.2 Å²	18.2	9%	0.086	11%	0.106	C	C	.	.			trans	-107.8	164.5	174.9	59.9	-94.8	0	0	0	112.4	L152 R154 Y186 L200 D204 T205 V211	L152-Y207 HydrophobicContact CD2-CD2 4.27Å; L152-Y207 HydrophobicContact CD2-CE2 4.48Å; R154-Y207 PolarHBondContact NH1-OH 2.76Å; R154-Y207 PolarHBondContact NH2-OH 2.72Å; Y186-Y207 WeakPolarHBondContact CB-OH 3.38Å; Y186-Y207 HydrophobicContact CD2-CD1 4.18Å; Y186-Y207 HydrophobicContact CD2-CD2 4.31Å; Y186-Y207 AromaticContact CD2-CE1 3.68Å; Y186-Y207 HydrophobicContact CD2-CE1 3.68Å; Y186-Y207 AromaticContact CD2-CE2 3.79Å; Y186-Y207 HydrophobicContact CD2-CE2 3.79Å; Y186-Y207 AromaticContact CD2-CZ 3.49Å; Y186-Y207 VanDerWaalsContact CD2-CZ 3.49Å; Y186-Y207 HydrophobicContact CE2-CE2 4.37Å; Y186-Y207 HydrophobicContact CG-CE1 4.06Å; Y186-Y207 HydrophobicContact CG-CE2 4.14Å; Y186-Y207 AromaticContact CG-CZ 3.62Å; L200-Y207 HydrophobicContact CD2-CD1 3.67Å; L200-Y207 HydrophobicContact CD2-CD2 3.88Å; L200-Y207 HydrophobicContact CD2-CE1 3.64Å; L200-Y207 HydrophobicContact CD2-CE2 3.86Å; L200-Y207 HydrophobicContact CD2-CG 3.73Å; D204-Y207 WeakPolarHBondContact O-CD1 3.47Å; D204-Y207 WeakPolarHBondContact O-CE1 3.41Å; T205-Y207 PolarHBondContact O-N 2.78Å; Y207-V211 HydrophobicContact CD2-CG1 4.17Å; Y207-V211 HydrophobicContact CG-CG1 4.32Å
208	G	93.2	Very high	95	Very high	20 Å²	20	18.3 Å²	18.3	21%	0.206	11%	0.107	C	C	.	.			trans	-143.7	-159.1	-176.1	0	0	0	0	0	113	L152 P210 V211	L152-G208 WeakPolarHBondContact CD2-O 3.45Å; G208-P210 VanDerWaalsContact C-N 3.25Å; G208-P210 WeakPolarHBondContact O-CD 3.32Å; G208-P210 VanDerWaalsContact O-N 3.12Å; G208-V211 VanDerWaalsContact O-CG2 3.31Å; G208-V211 WeakPolarHBondContact O-CG2 3.39Å; G208-V211 PolarHBondContact O-N 3.37Å
209	T	96.2	Very high	95	Very high	42 Å²	42	18.3 Å²	18.3	26%	0.258	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-26.8	178.7	56.7	0	0	0	0	116.2	H147 L180 V211 D212	H147-T209 HydrophobicContact CB-CG2 4Å; H147-T209 PolarHBondContact CE1-O 3.34Å; L180-T209 HydrophobicContact CD1-CG2 4.02Å; T209-V211 PolarHBondContact O-N 3.29Å; T209-V211 VanDerWaalsContact O-N 3.1Å; T209-D212 PolarHBondContact O-N 3.39Å
210	P	97.9	Very high	95.2	Very high	29 Å²	29	18.1 Å²	18.1	19%	0.188	11%	0.106	C	C	.	.	H	α-helix	trans	-62.4	-15.3	177.8	-26.2	37.3	0	0	0	115.6	G208 D212 V213 W214 P303 R306	G208-P210 VanDerWaalsContact C-N 3.25Å; G208-P210 WeakPolarHBondContact O-CD 3.32Å; G208-P210 VanDerWaalsContact O-N 3.12Å; P210-D212 VanDerWaalsContact C-N 3.35Å; P210-V213 WeakPolarHBondContact O-CB 3.27Å; P210-V213 PolarHBondContact O-N 2.94Å; P210-W214 PolarHBondContact O-N 3.45Å; P210-W214 VanDerWaalsContact O-N 3.11Å; P210-P303 HydrophobicContact CB-CB 3.84Å; P210-P303 WeakPolarHBondContact CB-O 3.42Å; P210-P303 HydrophobicContact CG-CB 4.27Å; P210-P303 WeakPolarHBondContact CG-O 3.49Å; P210-R306 HydrophobicContact CB-CB 4.45Å; P210-R306 PolarHBondContact O-NH1 2.85Å
211	V	97.2	Very high	95.4	Very high	3 Å²	3	16.9 Å²	16.9	2%	0.018	10%	0.1	C	C	.	.	H	α-helix	trans	-68	-35.8	175.4	-56.1	0	0	0	0	112	L152 A197 E199 L200 Y207 G208 T209 V213 W214 A215	L152-V211 HydrophobicContact CD2-CG2 4.23Å; A197-V211 HydrophobicContact CB-CB 4.33Å; A197-V211 HydrophobicContact CB-CG1 4.29Å; E199-V211 HydrophobicContact CG-CG1 4.03Å; E199-V211 WeakPolarHBondContact OE1-CG1 3.11Å; L200-V211 HydrophobicContact CD1-CB 3.87Å; L200-V211 HydrophobicContact CD1-CG1 4Å; L200-V211 HydrophobicContact CD1-CG2 4.35Å; L200-V211 HydrophobicContact CD2-CG1 4.19Å; L200-V211 HydrophobicContact CG-CB 4.32Å; L200-V211 HydrophobicContact CG-CG1 3.88Å; Y207-V211 HydrophobicContact CD2-CG1 4.17Å; Y207-V211 HydrophobicContact CG-CG1 4.32Å; G208-V211 VanDerWaalsContact O-CG2 3.31Å; G208-V211 WeakPolarHBondContact O-CG2 3.39Å; G208-V211 PolarHBondContact O-N 3.37Å; T209-V211 PolarHBondContact O-N 3.29Å; T209-V211 VanDerWaalsContact O-N 3.1Å; V211-V213 VanDerWaalsContact C-N 3.34Å; V211-W214 PolarHBondContact O-N 2.83Å; V211-A215 PolarHBondContact O-N 3.04Å
212	D	97.9	Very high	95.6	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-71.5	-34.3	176.4	-66.7	-31.9	0	0	0	110.5	V143 H147 H153 R154 T209 P210 W214 A215 I216	V143-D212 HydrophobicContact CG1-CB 3.81Å; H147-D212 IonicContact CD2-OD2 3.61Å; H147-D212 IonicContact CE1-OD2 2.84Å; H147-D212 IonicContact NE2-OD2 3.68Å; H147-D212 PolarHBondContact NE2-OD2 3.4Å; H153-D212 PolarHBondContact N-OD1 3.08Å; H153-D212 PolarHBondContact N-OD2 3.21Å; R154-D212 WeakPolarHBondContact CA-OD1 3.45Å; R154-D212 PolarHBondContact N-OD1 2.69Å; T209-D212 PolarHBondContact O-N 3.39Å; P210-D212 VanDerWaalsContact C-N 3.35Å; D212-W214 VanDerWaalsContact C-N 3.34Å; D212-A215 PolarHBondContact O-N 3.46Å; D212-I216 VanDerWaalsContact O-CG1 3.31Å; D212-I216 WeakPolarHBondContact O-CG1 3.36Å; D212-I216 PolarHBondContact O-N 2.91Å
213	V	98.8	Very high	95.8	Very high	3 Å²	3	17.4 Å²	17.4	2%	0.018	10%	0.102	C	C	.	.	H	α-helix	trans	-62.1	-43.3	175.2	173.9	0	0	0	0	111	P210 V211 A215 I216 G217 C298 R306 W307 L312	P210-V213 WeakPolarHBondContact O-CB 3.27Å; P210-V213 PolarHBondContact O-N 2.94Å; V211-V213 VanDerWaalsContact C-N 3.34Å; V213-A215 VanDerWaalsContact C-N 3.34Å; V213-A215 PolarHBondContact O-N 2.92Å; V213-I216 PolarHBondContact O-N 2.98Å; V213-G217 PolarHBondContact O-N 2.89Å; V213-C298 HydrophobicContact CG1-CB 4.19Å; V213-R306 HydrophobicContact CG1-CB 4.09Å; V213-W307 WeakPolarHBondContact CG1-O 3.42Å; V213-W307 WeakPolarHBondContact CG2-O 3.46Å; V213-L312 HydrophobicContact CG1-CD1 3.72Å
214	W	98.8	Very high	96.2	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.9	-46.9	174.7	176.4	-81.9	0	0	0	111.8	R196 A197 P198 P210 V211 D212 I216 G217 C218 W230 I242 L246 L299	R196-W214 PolarHBondContact O-NE1 2.75Å; A197-W214 VanDerWaalsContact CA-CD1 3.45Å; A197-W214 HydrophobicContact CB-CB 3.77Å; A197-W214 HydrophobicContact CB-CD2 4.09Å; A197-W214 HydrophobicContact CB-CG 3.63Å; P198-W214 HydrophobicContact CG-CH2 3.67Å; P198-W214 HydrophobicContact CG-CZ2 4.01Å; P198-W214 HydrophobicContact CG-CZ3 3.98Å; P210-W214 PolarHBondContact O-N 3.45Å; P210-W214 VanDerWaalsContact O-N 3.11Å; V211-W214 PolarHBondContact O-N 2.83Å; D212-W214 VanDerWaalsContact C-N 3.34Å; W214-I216 VanDerWaalsContact C-N 3.31Å; W214-I216 PolarHBondContact O-N 3.08Å; W214-G217 WeakPolarHBondContact O-CA 3.47Å; W214-G217 PolarHBondContact O-N 3.31Å; W214-G217 VanDerWaalsContact O-N 3.1Å; W214-C218 PolarHBondContact NE1-SG 2.82Å; W214-C218 PolarHBondContact O-N 3.48Å; W214-C218 PolarHBondContact O-SG 3.48Å; W214-C218 VanDerWaalsContact O-SG 3.33Å; W214-W230 AromaticContact CE2-CZ3 3.81Å; W214-W230 AromaticContact CH2-CH2 3.8Å; W214-W230 HydrophobicContact CH2-CH2 3.8Å; W214-W230 AromaticContact CH2-CZ3 3.78Å; W214-W230 HydrophobicContact CH2-CZ3 3.78Å; W214-W230 AromaticContact CZ2-CE3 3.97Å; W214-W230 HydrophobicContact CZ2-CE3 3.97Å; W214-W230 AromaticContact CZ2-CH2 3.73Å; W214-W230 HydrophobicContact CZ2-CH2 3.73Å; W214-W230 AromaticContact CZ2-CZ3 3.2Å; W214-W230 HydrophobicContact CZ2-CZ3 3.2Å; W214-I242 HydrophobicContact CH2-CD1 4.43Å; W214-I242 HydrophobicContact CH2-CG1 4.46Å; W214-I242 HydrophobicContact CH2-CG2 3.8Å; W214-I242 HydrophobicContact CZ2-CD1 3.73Å; W214-I242 HydrophobicContact CZ2-CG1 3.95Å; W214-I242 HydrophobicContact CZ2-CG2 4.14Å; W214-L246 HydrophobicContact CH2-CD1 3.5Å; W214-L246 HydrophobicContact CZ3-CD1 3.81Å; W214-L299 HydrophobicContact CD2-CD2 3.76Å; W214-L299 HydrophobicContact CE3-CB 4.45Å; W214-L299 HydrophobicContact CE3-CD2 3.87Å; W214-L299 HydrophobicContact CG-CD2 4.17Å; W214-L299 HydrophobicContact CZ2-CD2 4.47Å; W214-L299 HydrophobicContact CZ3-CB 4.29Å; W214-L299 HydrophobicContact CZ3-CD2 4.28Å; W214-L299 WeakPolarHBondContact O-CD2 3.47Å
215	A	98.3	Very high	96.4	Very high	5 Å²	5	17.2 Å²	17.2	4%	0.041	10%	0.096	C	C	.	.	H	α-helix	trans	-61.7	-38.5	178.4	0	0	0	0	0	112.1	I156 Y195 V211 D212 V213 C218 L219	I156-A215 HydrophobicContact CB-CB 3.79Å; I156-A215 HydrophobicContact CG2-CB 4.2Å; Y195-A215 WeakPolarHBondContact O-CB 3.49Å; V211-A215 PolarHBondContact O-N 3.04Å; D212-A215 PolarHBondContact O-N 3.46Å; V213-A215 VanDerWaalsContact C-N 3.34Å; V213-A215 PolarHBondContact O-N 2.92Å; A215-C218 WeakPolarHBondContact O-CB 3.41Å; A215-C218 PolarHBondContact O-N 3.21Å; A215-L219 WeakPolarHBondContact O-CB 3.48Å; A215-L219 PolarHBondContact O-N 3.22Å
216	I	98.8	Very high	96.8	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-64.6	-38.9	173	-67.5	169	0	0	0	111.4	T139 L140 V143 I156 D212 V213 W214 C218 L219 F220	T139-I216 HydrophobicContact CG2-CD1 4.25Å; T139-I216 HydrophobicContact CG2-CG1 4.02Å; L140-I216 HydrophobicContact CD2-CD1 3.9Å; L140-I216 HydrophobicContact CD2-CG2 4.06Å; L140-I216 HydrophobicContact CG-CG2 4.25Å; V143-I216 HydrophobicContact CB-CD1 4.11Å; V143-I216 HydrophobicContact CG1-CD1 4.22Å; V143-I216 HydrophobicContact CG2-CD1 4.05Å; I156-I216 HydrophobicContact CG2-CG1 4.17Å; D212-I216 VanDerWaalsContact O-CG1 3.31Å; D212-I216 WeakPolarHBondContact O-CG1 3.36Å; D212-I216 PolarHBondContact O-N 2.91Å; V213-I216 PolarHBondContact O-N 2.98Å; W214-I216 VanDerWaalsContact C-N 3.31Å; W214-I216 PolarHBondContact O-N 3.08Å; I216-C218 VanDerWaalsContact C-N 3.33Å; I216-C218 PolarHBondContact O-N 3.01Å; I216-L219 PolarHBondContact O-N 3.07Å; I216-F220 VanDerWaalsContact O-CB 3.31Å; I216-F220 WeakPolarHBondContact O-CB 3.26Å; I216-F220 PolarHBondContact O-N 2.62Å
217	G	98.8	Very high	97.1	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-60.8	-41.9	173.1	0	0	0	0	0	112.5	V213 W214 F220 A221 L295	V213-G217 PolarHBondContact O-N 2.89Å; W214-G217 WeakPolarHBondContact O-CA 3.47Å; W214-G217 PolarHBondContact O-N 3.31Å; W214-G217 VanDerWaalsContact O-N 3.1Å; G217-F220 PolarHBondContact O-N 3.35Å; G217-A221 PolarHBondContact O-N 2.88Å; G217-L295 WeakPolarHBondContact O-CD2 3.2Å
218	C	98.7	Very high	97.4	Very high	2 Å²	2	14.6 Å²	14.6	1%	0.014	9%	0.087	C	C	.	.	H	α-helix	trans	-65	-45.7	175.3	-63.5	0	0	0	0	111.8	Y195 W214 A215 I216 F220 A221 E222	Y195-C218 HydrophobicContact CD1-CB 3.68Å; Y195-C218 HydrophobicContact CE1-CB 4.36Å; W214-C218 PolarHBondContact NE1-SG 2.82Å; W214-C218 PolarHBondContact O-N 3.48Å; W214-C218 PolarHBondContact O-SG 3.48Å; W214-C218 VanDerWaalsContact O-SG 3.33Å; A215-C218 WeakPolarHBondContact O-CB 3.41Å; A215-C218 PolarHBondContact O-N 3.21Å; I216-C218 VanDerWaalsContact C-N 3.33Å; I216-C218 PolarHBondContact O-N 3.01Å; C218-F220 VanDerWaalsContact C-N 3.35Å; C218-F220 PolarHBondContact O-N 3.11Å; C218-A221 PolarHBondContact O-N 3.37Å; C218-E222 WeakPolarHBondContact O-CB 3.42Å; C218-E222 PolarHBondContact O-N 3.28Å
219	L	98.6	Very high	97.6	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-57.5	-46.7	174.1	172.3	73	0	0	0	111.4	V116 T139 P158 I161 A215 I216 E222 L223	V116-L219 HydrophobicContact CG1-CD1 4.13Å; T139-L219 HydrophobicContact CG2-CD2 4.12Å; P158-L219 HydrophobicContact CG-CD1 4.07Å; I161-L219 HydrophobicContact CD1-CD1 3.81Å; I161-L219 HydrophobicContact CD1-CD2 3.29Å; I161-L219 HydrophobicContact CD1-CG 4.17Å; A215-L219 WeakPolarHBondContact O-CB 3.48Å; A215-L219 PolarHBondContact O-N 3.22Å; I216-L219 PolarHBondContact O-N 3.07Å; L219-E222 PolarHBondContact O-N 2.99Å; L219-L223 HydrophobicContact CD1-CD1 4.29Å; L219-L223 HydrophobicContact CD1-CG 4.38Å; L219-L223 HydrophobicContact CG-CD1 4.02Å; L219-L223 HydrophobicContact CG-CG 4.48Å; L219-L223 WeakPolarHBondContact O-CB 3.44Å; L219-L223 WeakPolarHBondContact O-CG 3.46Å; L219-L223 PolarHBondContact O-N 3.41Å
220	F	98.7	Very high	97.7	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-63.1	-45.1	-179.7	176.3	-100.8	0	0	0	111.4	T132 C136 I216 G217 C218 E222 L223 V224 T291 F294 L295 Y317	T132-F220 HydrophobicContact CG2-CD2 3.95Å; T132-F220 HydrophobicContact CG2-CE2 3.73Å; C136-F220 HydrophobicContact CB-CD2 4.09Å; I216-F220 VanDerWaalsContact O-CB 3.31Å; I216-F220 WeakPolarHBondContact O-CB 3.26Å; I216-F220 PolarHBondContact O-N 2.62Å; G217-F220 PolarHBondContact O-N 3.35Å; C218-F220 VanDerWaalsContact C-N 3.35Å; C218-F220 PolarHBondContact O-N 3.11Å; F220-E222 VanDerWaalsContact C-N 3.35Å; F220-E222 PolarHBondContact O-N 3.06Å; F220-L223 PolarHBondContact O-N 3.41Å; F220-V224 HydrophobicContact CE1-CG2 4.23Å; F220-V224 HydrophobicContact CE2-CG2 4.18Å; F220-V224 HydrophobicContact CZ-CG2 4Å; F220-V224 VanDerWaalsContact O-CG2 3.3Å; F220-V224 WeakPolarHBondContact O-CG2 3.3Å; F220-V224 PolarHBondContact O-N 2.98Å; F220-V224 VanDerWaalsContact O-N 3.17Å; F220-T291 HydrophobicContact CE1-CG2 3.75Å; F220-T291 HydrophobicContact CZ-CG2 3.95Å; F220-F294 HydrophobicContact CB-CD1 4.49Å; F220-F294 HydrophobicContact CB-CE1 3.96Å; F220-F294 AromaticContact CD1-CD1 3.59Å; F220-F294 HydrophobicContact CD1-CD1 3.59Å; F220-F294 AromaticContact CD1-CE1 3.92Å; F220-F294 HydrophobicContact CD1-CE1 3.92Å; F220-F294 HydrophobicContact CD2-CD1 4.21Å; F220-F294 HydrophobicContact CD2-CE1 4Å; F220-F294 AromaticContact CE1-CD1 3.74Å; F220-F294 HydrophobicContact CE1-CD1 3.74Å; F220-F294 HydrophobicContact CE1-CE1 4.43Å; F220-F294 HydrophobicContact CE2-CD1 4.35Å; F220-F294 AromaticContact CG-CD1 3.82Å; F220-F294 HydrophobicContact CG-CD1 3.82Å; F220-F294 AromaticContact CG-CE1 3.67Å; F220-F294 HydrophobicContact CG-CE1 3.67Å; F220-F294 HydrophobicContact CZ-CD1 4.12Å; F220-L295 HydrophobicContact CD1-CD1 4.37Å; F220-L295 HydrophobicContact CD1-CD2 3.69Å; F220-L295 HydrophobicContact CD1-CG 3.72Å; F220-L295 HydrophobicContact CE1-CD1 4.31Å; F220-L295 HydrophobicContact CE1-CD2 4.39Å; F220-L295 HydrophobicContact CE1-CG 3.91Å; F220-Y317 HydrophobicContact CD2-CE1 4.47Å; F220-Y317 HydrophobicContact CE2-CD1 4.17Å; F220-Y317 AromaticContact CE2-CE1 3.36Å; F220-Y317 HydrophobicContact CE2-CE1 3.36Å; F220-Y317 HydrophobicContact CE2-CE2 4.33Å; F220-Y317 AromaticContact CE2-CZ 3.47Å; F220-Y317 VanDerWaalsContact CE2-CZ 3.47Å; F220-Y317 WeakPolarHBondContact CE2-OH 3.44Å; F220-Y317 HydrophobicContact CZ-CD1 4.33Å; F220-Y317 HydrophobicContact CZ-CD2 4.48Å; F220-Y317 AromaticContact CZ-CE1 3.73Å; F220-Y317 HydrophobicContact CZ-CE1 3.73Å; F220-Y317 AromaticContact CZ-CE2 3.9Å; F220-Y317 HydrophobicContact CZ-CE2 3.9Å; F220-Y317 AromaticContact CZ-CZ 3.5Å; F220-Y317 VanDerWaalsContact CZ-CZ 3.5Å
221	A	98.3	Very high	97.6	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-56	-51.9	173.3	0	0	0	0	0	110.5	G217 C218 L223 V224 R225 L229 L295	G217-A221 PolarHBondContact O-N 2.88Å; C218-A221 PolarHBondContact O-N 3.37Å; A221-L223 PolarHBondContact O-N 3.43Å; A221-V224 WeakPolarHBondContact O-CA 3.34Å; A221-V224 WeakPolarHBondContact O-CB 3.36Å; A221-V224 PolarHBondContact O-N 3.47Å; A221-R225 WeakPolarHBondContact O-CG 3.06Å; A221-R225 PolarHBondContact O-N 3.29Å; A221-L229 HydrophobicContact CB-CB 4.01Å; A221-L229 HydrophobicContact CB-CD1 4.13Å; A221-L229 HydrophobicContact CB-CD2 3.92Å; A221-L229 HydrophobicContact CB-CG 4.26Å; A221-L295 HydrophobicContact CB-CD2 3.9Å
222	E	98.3	Very high	97.4	Very high	13 Å²	13	13.9 Å²	13.9	6%	0.061	8%	0.079	C	C	.	.	H	α-helix	trans	-60.1	-42.5	-178.8	-179.7	171.3	-152.2	0	0	113.3	L120 P158 Y195 C218 L219 F220 V224 R225 G226 E227	L120-E222 HydrophobicContact CD1-CG 3.67Å; L120-E222 HydrophobicContact CD2-CG 3.89Å; L120-E222 WeakPolarHBondContact CD2-O 3.5Å; L120-E222 HydrophobicContact CG-CG 4.44Å; P158-E222 WeakPolarHBondContact CG-OE2 3.21Å; Y195-E222 WeakPolarHBondContact CE1-OE2 3.32Å; Y195-E222 VanDerWaalsContact CZ-OE2 3.23Å; Y195-E222 VanDerWaalsContact OH-CD 3.25Å; Y195-E222 PolarHBondContact OH-OE1 2.89Å; Y195-E222 PolarHBondContact OH-OE2 2.79Å; C218-E222 WeakPolarHBondContact O-CB 3.42Å; C218-E222 PolarHBondContact O-N 3.28Å; L219-E222 PolarHBondContact O-N 2.99Å; F220-E222 VanDerWaalsContact C-N 3.35Å; F220-E222 PolarHBondContact O-N 3.06Å; E222-V224 PolarHBondContact O-N 3.09Å; E222-R225 PolarHBondContact O-N 2.86Å; E222-G226 WeakPolarHBondContact O-CA 3.47Å; E222-G226 PolarHBondContact O-N 2.72Å; E222-E227 WeakPolarHBondContact CA-O 3.49Å
223	L	98.4	Very high	97.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-57.3	-34.8	172.5	-74.7	168.9	0	0	0	112.4	V116 L120 G126 C127 T132 I135 L219 F220 A221	V116-L223 HydrophobicContact CG1-CD2 3.68Å; L120-L223 HydrophobicContact CD2-CD2 4.22Å; G126-L223 CarbonylContact C-O 3.12Å; G126-L223 WeakPolarHBondContact CA-O 3.37Å; C127-L223 HydrophobicContact CB-CD2 4.41Å; C127-L223 WeakPolarHBondContact CB-O 3.49Å; C127-L223 PolarHBondContact N-O 2.87Å; T132-L223 HydrophobicContact CG2-CB 3.88Å; T132-L223 HydrophobicContact CG2-CD1 4.45Å; I135-L223 HydrophobicContact CB-CD1 4.05Å; I135-L223 HydrophobicContact CD1-CD2 3.88Å; I135-L223 HydrophobicContact CG2-CD1 3.75Å; L219-L223 HydrophobicContact CD1-CD1 4.29Å; L219-L223 HydrophobicContact CD1-CG 4.38Å; L219-L223 HydrophobicContact CG-CD1 4.02Å; L219-L223 HydrophobicContact CG-CG 4.48Å; L219-L223 WeakPolarHBondContact O-CB 3.44Å; L219-L223 WeakPolarHBondContact O-CG 3.46Å; L219-L223 PolarHBondContact O-N 3.41Å; F220-L223 PolarHBondContact O-N 3.41Å; A221-L223 PolarHBondContact O-N 3.43Å
224	V	97.6	Very high	96.7	Very high	11 Å²	11	26.8 Å²	26.8	7%	0.067	14%	0.135	C	C	.	.	H	α-helix	trans	-80.5	-34.8	-178.3	174	0	0	0	0	112.8	G126 T132 F220 A221 E222 M281 P282 S285	G126-V224 WeakPolarHBondContact CA-O 3.37Å; T132-V224 HydrophobicContact CG2-CG2 3.84Å; F220-V224 HydrophobicContact CE1-CG2 4.23Å; F220-V224 HydrophobicContact CE2-CG2 4.18Å; F220-V224 HydrophobicContact CZ-CG2 4Å; F220-V224 VanDerWaalsContact O-CG2 3.3Å; F220-V224 WeakPolarHBondContact O-CG2 3.3Å; F220-V224 PolarHBondContact O-N 2.98Å; F220-V224 VanDerWaalsContact O-N 3.17Å; A221-V224 WeakPolarHBondContact O-CA 3.34Å; A221-V224 WeakPolarHBondContact O-CB 3.36Å; A221-V224 PolarHBondContact O-N 3.47Å; E222-V224 PolarHBondContact O-N 3.09Å; V224-M281 HydrophobicContact CB-CE 3.82Å; V224-M281 HydrophobicContact CG1-CE 3.47Å; V224-M281 VanDerWaalsContact CG1-CE 3.47Å; V224-M281 HydrophobicContact CG2-CE 4.45Å; V224-P282 HydrophobicContact CG1-CG 4.48Å; V224-S285 WeakPolarHBondContact CG1-OG 3.05Å
225	R	95.6	Very high	96.3	Very high	16 Å²	16	27.7 Å²	27.7	6%	0.06	14%	0.14	C	C	.	.	H	α-helix	trans	-101.1	-21.2	-177.8	41.3	160.2	105.4	-28.4	164.2	115.9	Q125 G126 A221 E222 E227 K280 M281 P282	Q125-R225 CarbonylContact C-O 3.55Å; G126-R225 PolarHBondContact N-O 3.37Å; A221-R225 WeakPolarHBondContact O-CG 3.06Å; A221-R225 PolarHBondContact O-N 3.29Å; E222-R225 PolarHBondContact O-N 2.86Å; R225-E227 VanDerWaalsContact C-N 3.34Å; R225-E227 HydrophobicContact CB-CG 4.49Å; R225-E227 VanDerWaalsContact CD-O 3.29Å; R225-E227 WeakPolarHBondContact CD-O 3.23Å; R225-E227 HydrophobicContact CG-CG 4.3Å; R225-E227 WeakPolarHBondContact CG-O 3.04Å; R225-K280 VanDerWaalsContact CZ-C 3.4Å; R225-K280 PolarHBondContact NE-O 3Å; R225-K280 VanDerWaalsContact NH1-CB 3.27Å; R225-K280 PolarHBondContact NH1-O 3.48Å; R225-K280 VanDerWaalsContact NH1-O 3.09Å; R225-K280 PolarHBondContact NH2-O 2.82Å; R225-M281 PolarHBondContact NH1-SD 2.83Å; R225-M281 VanDerWaalsContact NH2-CA 3.25Å; R225-M281 PolarHBondContact NH2-SD 3.44Å; R225-P282 HydrophobicContact CB-CG 3.94Å
226	G	95.9	Very high	96.2	Very high	16 Å²	16	28.7 Å²	28.7	17%	0.165	15%	0.145	C	C	.	.	S	Bend	trans	87.2	-2.4	-175.6	0	0	0	0	0	114.6	E222	E222-G226 WeakPolarHBondContact O-CA 3.47Å; E222-G226 PolarHBondContact O-N 2.72Å
227	E	93.9	Very high	96	Very high	132 Å²	132	31 Å²	31	62%	0.617	16%	0.158	S	C	*	.	S	Bend	trans	-137.4	154	178.7	64.6	178	-177.6	0	0	111.8	E222 R225	E222-E227 WeakPolarHBondContact CA-O 3.49Å; R225-E227 VanDerWaalsContact C-N 3.34Å; R225-E227 HydrophobicContact CB-CG 4.49Å; R225-E227 VanDerWaalsContact CD-O 3.29Å; R225-E227 WeakPolarHBondContact CD-O 3.23Å; R225-E227 HydrophobicContact CG-CG 4.3Å; R225-E227 WeakPolarHBondContact CG-O 3.04Å
228	A	96.3	Very high	95.9	Very high	13 Å²	13	31 Å²	31	11%	0.107	16%	0.158	C	C	.	.			trans	-60.3	137.6	-179.9	0	0	0	0	0	111.8	W194 W230 P231	W194-A228 HydrophobicContact CD2-CB 4.23Å; W194-A228 HydrophobicContact CE3-CB 3.58Å; W194-A228 HydrophobicContact CZ3-CB 4.03Å; A228-W230 VanDerWaalsContact C-N 3.34Å; A228-W230 PolarHBondContact O-N 2.95Å; A228-P231 HydrophobicContact CB-CB 4.35Å
229	L	97.7	Very high	95.8	Very high	10 Å²	10	30.9 Å²	30.9	5%	0.052	16%	0.157	C	C	.	.	S	Bend	trans	-61.6	-40.2	-176.3	-179.1	60.1	0	0	0	113.2	A221 L277 K280 L299	A221-L229 HydrophobicContact CB-CB 4.01Å; A221-L229 HydrophobicContact CB-CD1 4.13Å; A221-L229 HydrophobicContact CB-CD2 3.92Å; A221-L229 HydrophobicContact CB-CG 4.26Å; L229-L277 HydrophobicContact CD1-CD1 4.06Å; L229-L277 HydrophobicContact CD2-CD1 4.08Å; L229-K280 HydrophobicContact CD1-CB 4.22Å; L229-K280 HydrophobicContact CD1-CD 4.08Å; L229-L299 HydrophobicContact CD2-CD1 3.48Å; L229-L299 VanDerWaalsContact CD2-CD1 3.48Å
230	W	97.5	Very high	95.8	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.008	17%	0.168	C	C	.	.			trans	-140.9	90.8	178.9	-62.1	-58.7	0	0	0	109.9	W214 A228 G232 Q238 L241 I242 T245 L246 L299	W214-W230 AromaticContact CE2-CZ3 3.81Å; W214-W230 AromaticContact CH2-CH2 3.8Å; W214-W230 HydrophobicContact CH2-CH2 3.8Å; W214-W230 AromaticContact CH2-CZ3 3.78Å; W214-W230 HydrophobicContact CH2-CZ3 3.78Å; W214-W230 AromaticContact CZ2-CE3 3.97Å; W214-W230 HydrophobicContact CZ2-CE3 3.97Å; W214-W230 AromaticContact CZ2-CH2 3.73Å; W214-W230 HydrophobicContact CZ2-CH2 3.73Å; W214-W230 AromaticContact CZ2-CZ3 3.2Å; W214-W230 HydrophobicContact CZ2-CZ3 3.2Å; A228-W230 VanDerWaalsContact C-N 3.34Å; A228-W230 PolarHBondContact O-N 2.95Å; W230-G232 VanDerWaalsContact C-N 3.31Å; W230-G232 PolarHBondContact O-N 2.95Å; W230-G232 VanDerWaalsContact O-N 3.08Å; W230-Q238 PolarHBondContact O-NE2 3.45Å; W230-Q238 PolarHBondContact O-OE1 2.87Å; W230-L241 HydrophobicContact CB-CB 4.11Å; W230-L241 HydrophobicContact CB-CD1 4.29Å; W230-L241 HydrophobicContact CG-CB 4.18Å; W230-L241 PolarHBondContact NE1-O 3.4Å; W230-I242 HydrophobicContact CD2-CG1 3.83Å; W230-I242 HydrophobicContact CE3-CG1 3.85Å; W230-I242 HydrophobicContact CG-CG1 4.26Å; W230-I242 HydrophobicContact CZ3-CG1 4.25Å; W230-T245 HydrophobicContact CZ2-CG2 3.89Å; W230-T245 PolarHBondContact NE1-OG1 2.91Å; W230-T245 VanDerWaalsContact NE1-OG1 3.13Å; W230-L246 HydrophobicContact CH2-CD1 3.95Å; W230-L246 HydrophobicContact CH2-CG 4.37Å; W230-L246 HydrophobicContact CZ2-CD1 4.21Å; W230-L246 HydrophobicContact CZ2-CG 4.15Å; W230-L299 HydrophobicContact CH2-CB 4.49Å; W230-L299 HydrophobicContact CH2-CD1 4.02Å; W230-L299 HydrophobicContact CH2-CD2 4.3Å; W230-L299 HydrophobicContact CZ3-CD1 4.36Å; W230-L299 HydrophobicContact CZ3-CD2 4.11Å
231	P	95.2	Very high	95.7	Very high	67 Å²	67	35.3 Å²	35.3	44%	0.435	18%	0.177	S	C	.	.			trans	-85.7	63.4	-177.6	33.9	-35.2	0	0	0	112.5	W194 A228	W194-P231 HydrophobicContact CD2-CB 4.25Å; W194-P231 HydrophobicContact CH2-CB 4.49Å; W194-P231 HydrophobicContact CZ2-CB 4.03Å; A228-P231 HydrophobicContact CB-CB 4.35Å
232	G	94.3	Very high	95.7	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.01	18%	0.177	C	C	.	.			trans	-68.2	139.2	-177	0	0	0	0	0	114.2	R193 W194 W230 D237	R193-G232 WeakPolarHBondContact CD-O 3.48Å; R193-G232 PolarHBondContact NH1-O 2.94Å; W194-G232 PolarHBondContact NE1-O 3.44Å; W230-G232 VanDerWaalsContact C-N 3.31Å; W230-G232 PolarHBondContact O-N 2.95Å; W230-G232 VanDerWaalsContact O-N 3.08Å; G232-D237 WeakPolarHBondContact CA-OD2 3.48Å
233	R	90.1	Very high	95.6	Very high	224 Å²	224	35.6 Å²	35.6	85%	0.845	18%	0.177	S	C	*	.	S	Bend	trans	-81.9	-26	-178.4	-60	-179.3	-175.9	-171.7	1.3	113.3	R193 D237	R193-R233 PolarHBondContact NH1-O 3.39Å; R233-D237 PolarHBondContact N-OD2 3.32Å
234	S	90.3	Very high	95.6	Very high	51 Å²	51	37.6 Å²	37.6	36%	0.357	19%	0.186	S	C	.	.	S	Bend	trans	-141.3	171.2	175	70.2	0	0	0	0	109.8	R193 V236 D237 Q238	R193-S234 WeakPolarHBondContact CD-O 3.3Å; S234-V236 VanDerWaalsContact C-N 3.25Å; S234-V236 PolarHBondContact O-N 3.08Å; S234-D237 PolarHBondContact O-N 3.17Å; S234-D237 WeakPolarHBondContact OG-CB 3.49Å; S234-D237 PolarHBondContact OG-N 3.16Å; S234-D237 VanDerWaalsContact OG-N 3.12Å; S234-Q238 WeakPolarHBondContact O-CB 3.45Å; S234-Q238 PolarHBondContact O-N 3.39Å
235	D	91.9	Very high	95.6	Very high	19 Å²	19	37.5 Å²	37.5	10%	0.102	19%	0.186	C	C	.	.	H	α-helix	trans	-65.4	-34	178.6	-59.7	-23.5	0	0	0	111.4	R193 L201 Q238 L239 F263	R193-D235 WeakPolarHBondContact CD-OD1 3.46Å; R193-D235 IonicContact NE-OD1 2.71Å; R193-D235 PolarHBondContact NE-OD1 2.75Å; L201-D235 HydrophobicContact CD2-CB 4.13Å; D235-Q238 PolarHBondContact O-N 2.93Å; D235-L239 WeakPolarHBondContact O-CB 3.33Å; D235-L239 VanDerWaalsContact O-CG 3.29Å; D235-L239 WeakPolarHBondContact O-CG 3.32Å; D235-L239 PolarHBondContact O-N 2.77Å; D235-F263 HydrophobicContact CB-CE1 4.29Å; D235-F263 HydrophobicContact CB-CZ 4.23Å
236	V	94.5	Very high	95.7	Very high	25 Å²	25	38.5 Å²	38.5	15%	0.152	19%	0.192	C	C	.	.	H	α-helix	trans	-66.5	-44.5	174.5	-178.7	0	0	0	0	111.1	S234 L239 Y240 F257 F263 I266 L268	S234-V236 VanDerWaalsContact C-N 3.25Å; S234-V236 PolarHBondContact O-N 3.08Å; V236-L239 PolarHBondContact O-N 3Å; V236-Y240 WeakPolarHBondContact O-CB 3.41Å; V236-Y240 PolarHBondContact O-N 2.98Å; V236-F257 HydrophobicContact CG2-CE2 4.48Å; V236-F257 HydrophobicContact CG2-CZ 4.4Å; V236-F263 HydrophobicContact CG2-CD1 4.04Å; V236-F263 HydrophobicContact CG2-CE1 3.99Å; V236-I266 HydrophobicContact CG1-CG2 4.15Å; V236-I266 HydrophobicContact CG2-CD1 4.45Å; V236-I266 HydrophobicContact CG2-CG2 3.9Å; V236-L268 HydrophobicContact CG1-CD1 4.24Å
237	D	95.1	Very high	95.7	Very high	49 Å²	49	38.3 Å²	38.3	26%	0.262	19%	0.19	S	C	.	.	H	α-helix	trans	-66.2	-39.5	176.5	-174.5	49.7	0	0	0	111.3	G232 R233 S234 L239 Y240 L241	G232-D237 WeakPolarHBondContact CA-OD2 3.48Å; R233-D237 PolarHBondContact N-OD2 3.32Å; S234-D237 PolarHBondContact O-N 3.17Å; S234-D237 WeakPolarHBondContact OG-CB 3.49Å; S234-D237 PolarHBondContact OG-N 3.16Å; S234-D237 VanDerWaalsContact OG-N 3.12Å; D237-L239 PolarHBondContact O-N 3.33Å; D237-Y240 WeakPolarHBondContact O-CB 3.34Å; D237-Y240 PolarHBondContact O-N 3.33Å; D237-L241 WeakPolarHBondContact O-CG 3.35Å; D237-L241 PolarHBondContact O-N 2.88Å
238	Q	96.9	Very high	95.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.8	-47.3	173.9	-171.2	68.7	37	0	0	111.5	R193 W194 L201 W230 S234 D235 Y240 L241 I242	R193-Q238 HydrophobicContact CG-CB 4.3Å; R193-Q238 HydrophobicContact CG-CG 4.32Å; W194-Q238 PolarHBondContact O-NE2 2.89Å; L201-Q238 HydrophobicContact CD1-CB 4.1Å; L201-Q238 HydrophobicContact CD1-CG 3.45Å; L201-Q238 VanDerWaalsContact CD1-CG 3.45Å; L201-Q238 HydrophobicContact CD2-CB 4.18Å; L201-Q238 HydrophobicContact CD2-CG 3.96Å; L201-Q238 HydrophobicContact CG-CG 4.37Å; W230-Q238 PolarHBondContact O-NE2 3.45Å; W230-Q238 PolarHBondContact O-OE1 2.87Å; S234-Q238 WeakPolarHBondContact O-CB 3.45Å; S234-Q238 PolarHBondContact O-N 3.39Å; D235-Q238 PolarHBondContact O-N 2.93Å; Q238-Y240 VanDerWaalsContact C-N 3.32Å; Q238-Y240 PolarHBondContact O-N 2.94Å; Q238-L241 PolarHBondContact O-N 3.19Å; Q238-I242 HydrophobicContact CG-CD1 4.22Å; Q238-I242 VanDerWaalsContact O-CG1 3.31Å; Q238-I242 WeakPolarHBondContact O-CG1 3.4Å; Q238-I242 PolarHBondContact O-N 3.46Å
239	L	97.1	Very high	95.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.6	-38.9	175.4	-73.9	171.2	0	0	0	111.8	P198 L201 V202 D235 V236 D237 I242 R243 L249 F257 L268	P198-L239 HydrophobicContact CB-CD2 4.46Å; L201-L239 HydrophobicContact CB-CD1 4.21Å; L201-L239 HydrophobicContact CB-CD2 3.61Å; L201-L239 HydrophobicContact CB-CG 3.81Å; L201-L239 HydrophobicContact CD1-CD2 3.91Å; L201-L239 HydrophobicContact CD1-CG 4.21Å; L201-L239 HydrophobicContact CG-CD2 4.43Å; V202-L239 HydrophobicContact CG1-CD1 3.91Å; V202-L239 HydrophobicContact CG1-CD2 4.07Å; D235-L239 WeakPolarHBondContact O-CB 3.33Å; D235-L239 VanDerWaalsContact O-CG 3.29Å; D235-L239 WeakPolarHBondContact O-CG 3.32Å; D235-L239 PolarHBondContact O-N 2.77Å; V236-L239 PolarHBondContact O-N 3Å; D237-L239 PolarHBondContact O-N 3.33Å; L239-I242 PolarHBondContact O-N 2.91Å; L239-R243 VanDerWaalsContact O-CB 3.23Å; L239-R243 WeakPolarHBondContact O-CB 3.35Å; L239-R243 PolarHBondContact O-N 3.27Å; L239-L249 HydrophobicContact CD2-CD1 3.92Å; L239-L249 HydrophobicContact CD2-CD2 4.41Å; L239-F257 HydrophobicContact CD1-CD2 3.86Å; L239-F257 HydrophobicContact CD1-CE2 3.87Å; L239-L268 HydrophobicContact CB-CD1 3.58Å; L239-L268 HydrophobicContact CB-CD2 4.43Å; L239-L268 HydrophobicContact CD1-CD1 4.25Å
240	Y	97.4	Very high	95.6	Very high	56 Å²	56	37.6 Å²	37.6	22%	0.22	19%	0.188	C	C	.	.	H	α-helix	trans	-61.2	-47.2	175.1	172.3	-100.9	0	0	0	112	V236 D237 Q238 I242 R243 K244 P269 P271	V236-Y240 WeakPolarHBondContact O-CB 3.41Å; V236-Y240 PolarHBondContact O-N 2.98Å; D237-Y240 WeakPolarHBondContact O-CB 3.34Å; D237-Y240 PolarHBondContact O-N 3.33Å; Q238-Y240 VanDerWaalsContact C-N 3.32Å; Q238-Y240 PolarHBondContact O-N 2.94Å; Y240-I242 VanDerWaalsContact C-N 3.35Å; Y240-I242 PolarHBondContact O-N 2.94Å; Y240-R243 PolarHBondContact O-N 3.18Å; Y240-K244 WeakPolarHBondContact O-CB 3.4Å; Y240-K244 PolarHBondContact O-N 3.44Å; Y240-P269 HydrophobicContact CD2-CB 3.79Å; Y240-P269 HydrophobicContact CD2-CG 4.42Å; Y240-P269 HydrophobicContact CE2-CB 4.16Å; Y240-P271 HydrophobicContact CD2-CG 3.94Å; Y240-P271 HydrophobicContact CE2-CB 3.96Å; Y240-P271 HydrophobicContact CE2-CG 3.67Å
241	L	97.7	Very high	95.6	Very high	36 Å²	36	42.7 Å²	42.7	19%	0.188	22%	0.221	C	C	.	.	H	α-helix	trans	-61.1	-43.2	177.6	-69.4	176.1	0	0	0	112	W230 D237 Q238 K244 T245	W230-L241 HydrophobicContact CB-CB 4.11Å; W230-L241 HydrophobicContact CB-CD1 4.29Å; W230-L241 HydrophobicContact CG-CB 4.18Å; W230-L241 PolarHBondContact NE1-O 3.4Å; D237-L241 WeakPolarHBondContact O-CG 3.35Å; D237-L241 PolarHBondContact O-N 2.88Å; Q238-L241 PolarHBondContact O-N 3.19Å; L241-K244 PolarHBondContact O-N 3.47Å; L241-T245 PolarHBondContact O-N 3.01Å; L241-T245 PolarHBondContact O-OG1 3.03Å
242	I	98.1	Very high	95.6	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-47	175.5	-68.3	165.2	0	0	0	110.4	P198 L201 W214 W230 Q238 L239 Y240 K244 T245 L246	P198-I242 HydrophobicContact CG-CD1 4.4Å; P198-I242 HydrophobicContact CG-CG2 4.15Å; L201-I242 HydrophobicContact CD1-CD1 3.62Å; W214-I242 HydrophobicContact CH2-CD1 4.43Å; W214-I242 HydrophobicContact CH2-CG1 4.46Å; W214-I242 HydrophobicContact CH2-CG2 3.8Å; W214-I242 HydrophobicContact CZ2-CD1 3.73Å; W214-I242 HydrophobicContact CZ2-CG1 3.95Å; W214-I242 HydrophobicContact CZ2-CG2 4.14Å; W230-I242 HydrophobicContact CD2-CG1 3.83Å; W230-I242 HydrophobicContact CE3-CG1 3.85Å; W230-I242 HydrophobicContact CG-CG1 4.26Å; W230-I242 HydrophobicContact CZ3-CG1 4.25Å; Q238-I242 HydrophobicContact CG-CD1 4.22Å; Q238-I242 VanDerWaalsContact O-CG1 3.31Å; Q238-I242 WeakPolarHBondContact O-CG1 3.4Å; Q238-I242 PolarHBondContact O-N 3.46Å; L239-I242 PolarHBondContact O-N 2.91Å; Y240-I242 VanDerWaalsContact C-N 3.35Å; Y240-I242 PolarHBondContact O-N 2.94Å; I242-K244 VanDerWaalsContact C-N 3.3Å; I242-K244 PolarHBondContact O-N 2.95Å; I242-T245 PolarHBondContact O-N 3.48Å; I242-L246 HydrophobicContact CG2-CD1 4.07Å; I242-L246 PolarHBondContact O-N 2.83Å
243	R	97.2	Very high	95.7	Very high	19 Å²	19	44.7 Å²	44.7	7%	0.072	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-38.8	179.8	-174.8	179.5	174.5	179.3	13.3	112.1	L239 Y240 T245 G247 D248 L268 P269 V270 P271	L239-R243 VanDerWaalsContact O-CB 3.23Å; L239-R243 WeakPolarHBondContact O-CB 3.35Å; L239-R243 PolarHBondContact O-N 3.27Å; Y240-R243 PolarHBondContact O-N 3.18Å; R243-T245 PolarHBondContact O-N 3.45Å; R243-G247 WeakPolarHBondContact CA-O 3.21Å; R243-G247 CarbonylContact O-C 3.53Å; R243-G247 VanDerWaalsContact O-CA 3.23Å; R243-G247 WeakPolarHBondContact O-CA 3.5Å; R243-G247 PolarHBondContact O-N 3.4Å; R243-D248 IonicContact CZ-OD1 2.66Å; R243-D248 IonicContact NE-OD1 3.39Å; R243-D248 PolarHBondContact NE-OD1 2.92Å; R243-D248 VanDerWaalsContact NH2-CG 3.27Å; R243-D248 IonicContact NH2-OD1 2.85Å; R243-D248 PolarHBondContact NH2-OD1 3.16Å; R243-D248 IonicContact NH2-OD2 3.81Å; R243-D248 PolarHBondContact NH2-OD2 2.95Å; R243-L268 PolarHBondContact NH1-O 3.48Å; R243-P269 VanDerWaalsContact NH1-C 3.29Å; R243-P269 PolarHBondContact NH1-O 3.04Å; R243-V270 VanDerWaalsContact NH1-CA 3.32Å; R243-P271 HydrophobicContact CB-CG 4.18Å; R243-P271 HydrophobicContact CG-CG 3.93Å
244	K	97.7	Very high	95.9	Very high	41 Å²	41	37.5 Å²	37.5	18%	0.178	20%	0.198	C	C	.	.	H	α-helix	trans	-60	-29.9	174.8	-166	-179.6	-166.8	-165.3	0	111.6	Y240 L241 I242 P271 L274 E275	Y240-K244 WeakPolarHBondContact O-CB 3.4Å; Y240-K244 PolarHBondContact O-N 3.44Å; L241-K244 PolarHBondContact O-N 3.47Å; I242-K244 VanDerWaalsContact C-N 3.3Å; I242-K244 PolarHBondContact O-N 2.95Å; K244-P271 HydrophobicContact CB-CB 4.01Å; K244-P271 HydrophobicContact CB-CG 3.91Å; K244-P271 HydrophobicContact CG-CB 3.99Å; K244-P271 HydrophobicContact CG-CG 4.45Å; K244-L274 CarbonylContact O-C 3.52Å; K244-L274 VanDerWaalsContact O-CA 3.27Å; K244-L274 WeakPolarHBondContact O-CA 2.88Å; K244-E275 HydrophobicContact CD-CG 4.37Å; K244-E275 VanDerWaalsContact CE-CD 3.48Å; K244-E275 WeakPolarHBondContact CE-OE1 3.31Å; K244-E275 HydrophobicContact CG-CB 4.45Å; K244-E275 HydrophobicContact CG-CG 4.43Å; K244-E275 VanDerWaalsContact NZ-CD 3.32Å; K244-E275 IonicContact NZ-OE1 3.74Å; K244-E275 PolarHBondContact NZ-OE1 3.26Å; K244-E275 IonicContact NZ-OE2 2.8Å; K244-E275 PolarHBondContact O-N 3.12Å
245	T	97.8	Very high	96.1	Very high	10 Å²	10	40.5 Å²	40.5	6%	0.061	21%	0.206	C	C	.	.	H	α-helix	trans	-94.9	-43	-178.4	-58.3	0	0	0	0	114.6	W230 L241 I242 R243 E275 L277 K280	W230-T245 HydrophobicContact CZ2-CG2 3.89Å; W230-T245 PolarHBondContact NE1-OG1 2.91Å; W230-T245 VanDerWaalsContact NE1-OG1 3.13Å; L241-T245 PolarHBondContact O-N 3.01Å; L241-T245 PolarHBondContact O-OG1 3.03Å; I242-T245 PolarHBondContact O-N 3.48Å; R243-T245 PolarHBondContact O-N 3.45Å; T245-E275 VanDerWaalsContact CA-O 3.23Å; T245-E275 WeakPolarHBondContact CA-O 3.33Å; T245-E275 WeakPolarHBondContact CG2-O 3.23Å; T245-E275 PolarHBondContact OG1-O 2.94Å; T245-L277 HydrophobicContact CG2-CB 4.04Å; T245-L277 HydrophobicContact CG2-CD1 4.18Å; T245-K280 HydrophobicContact CG2-CD 4.29Å; T245-K280 WeakPolarHBondContact OG1-CE 3.48Å
246	L	97.1	Very high	96.2	Very high	36 Å²	36	41 Å²	41	19%	0.188	21%	0.209	C	C	.	.	H	α-helix	trans	-108.5	2.9	-170.4	-55.7	-178.5	0	0	0	113.8	W214 W230 I242 L299 K301	W214-L246 HydrophobicContact CH2-CD1 3.5Å; W214-L246 HydrophobicContact CZ3-CD1 3.81Å; W230-L246 HydrophobicContact CH2-CD1 3.95Å; W230-L246 HydrophobicContact CH2-CG 4.37Å; W230-L246 HydrophobicContact CZ2-CD1 4.21Å; W230-L246 HydrophobicContact CZ2-CG 4.15Å; I242-L246 HydrophobicContact CG2-CD1 4.07Å; I242-L246 PolarHBondContact O-N 2.83Å; L246-L299 WeakPolarHBondContact CD1-O 3.34Å; L246-K301 PolarHBondContact O-NZ 3.09Å
247	G	95.8	Very high	96.2	Very high	12 Å²	12	40.3 Å²	40.3	12%	0.124	20%	0.204	C	C	.	.			trans	75.7	-169.2	-173	0	0	0	0	0	112.9	R243	R243-G247 WeakPolarHBondContact CA-O 3.21Å; R243-G247 CarbonylContact O-C 3.53Å; R243-G247 VanDerWaalsContact O-CA 3.23Å; R243-G247 WeakPolarHBondContact O-CA 3.5Å; R243-G247 PolarHBondContact O-N 3.4Å
248	D	94.8	Very high	96.1	Very high	91 Å²	91	41.2 Å²	41.2	49%	0.487	23%	0.225	S	C	.	.	S	Bend	trans	-57.8	143.8	-175.3	-79.5	7.2	0	0	0	113.3	R243 K301	R243-D248 IonicContact CZ-OD1 2.66Å; R243-D248 IonicContact NE-OD1 3.39Å; R243-D248 PolarHBondContact NE-OD1 2.92Å; R243-D248 VanDerWaalsContact NH2-CG 3.27Å; R243-D248 IonicContact NH2-OD1 2.85Å; R243-D248 PolarHBondContact NH2-OD1 3.16Å; R243-D248 IonicContact NH2-OD2 3.81Å; R243-D248 PolarHBondContact NH2-OD2 2.95Å; D248-K301 WeakPolarHBondContact O-CD 3.25Å; D248-K301 WeakPolarHBondContact O-CE 3.46Å
249	L	95.8	Very high	95.9	Very high	10 Å²	10	47.6 Å²	47.6	5%	0.052	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-63.2	162.2	174	-55.6	179.4	0	0	0	110.5	P198 V202 L239 H253 I254 L268	P198-L249 HydrophobicContact CB-CD2 4.02Å; V202-L249 HydrophobicContact CG1-CD1 4.12Å; L239-L249 HydrophobicContact CD2-CD1 3.92Å; L239-L249 HydrophobicContact CD2-CD2 4.41Å; L249-H253 HydrophobicContact CB-CB 4.15Å; L249-I254 HydrophobicContact CB-CD1 3.89Å; L249-I254 HydrophobicContact CB-CG1 4.1Å; L249-I254 HydrophobicContact CD1-CD1 4.06Å; L249-I254 HydrophobicContact CG-CD1 4.29Å; L249-L268 HydrophobicContact CD1-CD2 3.67Å; L249-L268 HydrophobicContact CG-CD2 4.36Å
250	L	96.6	Very high	95.5	Very high	40 Å²	40	49.2 Å²	49.2	21%	0.209	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-59.4	146.1	172.9	-65.7	-179.5	0	0	0	111.2	R252 H253 I254 D302	L250-R252 PolarHBondContact O-N 3.49Å; L250-R252 VanDerWaalsContact O-N 3.12Å; L250-H253 WeakPolarHBondContact O-CB 3.36Å; L250-H253 PolarHBondContact O-N 3.4Å; L250-I254 PolarHBondContact O-N 3.19Å; L250-I254 VanDerWaalsContact O-N 3.07Å; L250-D302 HydrophobicContact CD1-CB 4.12Å; L250-D302 HydrophobicContact CD2-CB 4.35Å
251	P	96.4	Very high	95.1	Very high	108 Å²	108	53 Å²	53	70%	0.701	28%	0.283	S	S	*	.	H	α-helix	trans	-51.1	-39.4	176.5	-29.4	35.5	0	0	0	113.4	H253 I254 Q255	P251-H253 PolarHBondContact O-N 3.24Å; P251-I254 PolarHBondContact O-N 3.38Å; P251-Q255 PolarHBondContact O-N 3.05Å
252	R	95.5	Very high	94.6	Very high	106 Å²	106	58.7 Å²	58.7	40%	0.4	30%	0.303	S	S	.	.	H	α-helix	trans	-58	-47.8	173.9	179.4	-174.7	172	98.1	-0.6	112.3	D204 L250 I254 Q255 I256	D204-R252 IonicContact OD1-NH2 3.55Å; D204-R252 PolarHBondContact OD1-NH2 3.38Å; D204-R252 IonicContact OD2-CZ 3.36Å; D204-R252 IonicContact OD2-NE 2.68Å; D204-R252 PolarHBondContact OD2-NE 3.27Å; D204-R252 IonicContact OD2-NH2 3.29Å; D204-R252 PolarHBondContact OD2-NH2 3.02Å; L250-R252 PolarHBondContact O-N 3.49Å; L250-R252 VanDerWaalsContact O-N 3.12Å; R252-I254 VanDerWaalsContact C-N 3.32Å; R252-I254 PolarHBondContact O-N 3.29Å; R252-Q255 PolarHBondContact O-N 2.94Å; R252-I256 HydrophobicContact CG-CD1 3.86Å; R252-I256 HydrophobicContact CG-CG1 4.5Å; R252-I256 VanDerWaalsContact O-CG1 3.3Å; R252-I256 WeakPolarHBondContact O-CG1 3.25Å; R252-I256 PolarHBondContact O-N 2.86Å
253	H	95.9	Very high	94.2	Very high	4 Å²	4	59 Å²	59	2%	0.019	30%	0.304	C	S	.	.	H	α-helix	trans	-66.1	-37.1	-179	-63.3	164.1	0	0	0	111.5	V202 L249 L250 P251 I256 F257	V202-H253 HydrophobicContact CG1-CB 4.21Å; V202-H253 HydrophobicContact CG2-CB 4.09Å; L249-H253 HydrophobicContact CB-CB 4.15Å; L250-H253 WeakPolarHBondContact O-CB 3.36Å; L250-H253 PolarHBondContact O-N 3.4Å; P251-H253 PolarHBondContact O-N 3.24Å; H253-I256 PolarHBondContact O-N 2.79Å; H253-F257 WeakPolarHBondContact O-CB 3.34Å; H253-F257 PolarHBondContact O-N 3.36Å
254	I	94.8	Very high	93.8	Very high	73 Å²	73	65.1 Å²	65.1	37%	0.374	33%	0.331	S	S	.	.	H	α-helix	trans	-63.8	-43.9	173.6	-62.9	-64.6	0	0	0	111.2	L249 L250 P251 R252 F257 G258 L268	L249-I254 HydrophobicContact CB-CD1 3.89Å; L249-I254 HydrophobicContact CB-CG1 4.1Å; L249-I254 HydrophobicContact CD1-CD1 4.06Å; L249-I254 HydrophobicContact CG-CD1 4.29Å; L250-I254 PolarHBondContact O-N 3.19Å; L250-I254 VanDerWaalsContact O-N 3.07Å; P251-I254 PolarHBondContact O-N 3.38Å; R252-I254 VanDerWaalsContact C-N 3.32Å; R252-I254 PolarHBondContact O-N 3.29Å; I254-F257 PolarHBondContact O-N 3.49Å; I254-G258 PolarHBondContact O-N 3.13Å; I254-L268 HydrophobicContact CD1-CD2 4.18Å
255	Q	94.6	Very high	93.4	Very high	115 Å²	115	67.2 Å²	67.2	54%	0.537	36%	0.364	S	S	.	.	H	α-helix	trans	-60.9	-47.2	176.6	-179	-176.9	-13.6	0	0	111.6	P251 R252 G258 Q259	P251-Q255 PolarHBondContact O-N 3.05Å; R252-Q255 PolarHBondContact O-N 2.94Å; Q255-G258 PolarHBondContact O-N 3.35Å; Q255-Q259 WeakPolarHBondContact O-CG 3.45Å; Q255-Q259 PolarHBondContact O-N 3.25Å; Q255-Q259 VanDerWaalsContact O-N 3.08Å
256	I	94.3	Very high	93.1	Very high	29 Å²	29	70.6 Å²	70.6	15%	0.149	38%	0.381	C	S	.	.	H	α-helix	trans	-61.8	-45.8	178.8	-68.5	170.9	0	0	0	110.4	V202 D204 R252 H253 G258 Q259 N260	V202-I256 HydrophobicContact CB-CG2 4.45Å; V202-I256 HydrophobicContact CG2-CB 4.39Å; V202-I256 HydrophobicContact CG2-CG2 4.11Å; V202-I256 WeakPolarHBondContact O-CG2 3.5Å; D204-I256 HydrophobicContact CB-CD1 3.66Å; D204-I256 VanDerWaalsContact OD2-CD1 3.23Å; D204-I256 WeakPolarHBondContact OD2-CD1 3.46Å; R252-I256 HydrophobicContact CG-CD1 3.86Å; R252-I256 HydrophobicContact CG-CG1 4.5Å; R252-I256 VanDerWaalsContact O-CG1 3.3Å; R252-I256 WeakPolarHBondContact O-CG1 3.25Å; R252-I256 PolarHBondContact O-N 2.86Å; H253-I256 PolarHBondContact O-N 2.79Å; I256-G258 VanDerWaalsContact C-N 3.31Å; I256-G258 PolarHBondContact O-N 3.01Å; I256-Q259 PolarHBondContact O-N 2.91Å; I256-Q259 VanDerWaalsContact O-N 3.15Å; I256-N260 WeakPolarHBondContact O-CB 3.31Å; I256-N260 PolarHBondContact O-N 3.49Å
257	F	93.7	Very high	92.7	Very high	11 Å²	11	74.7 Å²	74.7	5%	0.048	41%	0.408	C	S	.	.	H	α-helix	trans	-55.4	-46	176	-178.5	-87.7	0	0	0	111.7	V202 V236 L239 H253 I254 Q259 N260 F263 I266 L268	V202-F257 HydrophobicContact CB-CB 4.16Å; V202-F257 HydrophobicContact CG1-CB 4.07Å; V202-F257 HydrophobicContact CG1-CD2 4.25Å; V236-F257 HydrophobicContact CG2-CE2 4.48Å; V236-F257 HydrophobicContact CG2-CZ 4.4Å; L239-F257 HydrophobicContact CD1-CD2 3.86Å; L239-F257 HydrophobicContact CD1-CE2 3.87Å; H253-F257 WeakPolarHBondContact O-CB 3.34Å; H253-F257 PolarHBondContact O-N 3.36Å; I254-F257 PolarHBondContact O-N 3.49Å; F257-Q259 VanDerWaalsContact C-N 3.31Å; F257-Q259 PolarHBondContact O-N 3.15Å; F257-N260 PolarHBondContact O-N 3.43Å; F257-F263 HydrophobicContact CD1-CB 4.48Å; F257-F263 HydrophobicContact CD2-CB 4.38Å; F257-F263 HydrophobicContact CD2-CD1 4.34Å; F257-F263 AromaticContact CD2-CD2 3.46Å; F257-F263 HydrophobicContact CD2-CD2 3.46Å; F257-F263 VanDerWaalsContact CD2-CD2 3.46Å; F257-F263 AromaticContact CD2-CE2 3.74Å; F257-F263 HydrophobicContact CD2-CE2 3.74Å; F257-F263 AromaticContact CD2-CG 3.82Å; F257-F263 HydrophobicContact CD2-CG 3.82Å; F257-F263 HydrophobicContact CD2-CZ 4.28Å; F257-F263 HydrophobicContact CE1-CB 4.06Å; F257-F263 HydrophobicContact CE1-CG 4.4Å; F257-F263 HydrophobicContact CE2-CB 3.97Å; F257-F263 AromaticContact CE2-CD1 3.55Å; F257-F263 HydrophobicContact CE2-CD1 3.55Å; F257-F263 AromaticContact CE2-CD2 3.54Å; F257-F263 HydrophobicContact CE2-CD2 3.54Å; F257-F263 AromaticContact CE2-CE1 3.84Å; F257-F263 HydrophobicContact CE2-CE1 3.84Å; F257-F263 AromaticContact CE2-CE2 3.86Å; F257-F263 HydrophobicContact CE2-CE2 3.86Å; F257-F263 AromaticContact CE2-CG 3.4Å; F257-F263 HydrophobicContact CE2-CG 3.4Å; F257-F263 HydrophobicContact CE2-CZ 4Å; F257-F263 HydrophobicContact CG-CD2 4.14Å; F257-F263 HydrophobicContact CG-CG 4.48Å; F257-F263 HydrophobicContact CZ-CB 3.79Å; F257-F263 AromaticContact CZ-CD1 3.9Å; F257-F263 HydrophobicContact CZ-CD1 3.9Å; F257-F263 HydrophobicContact CZ-CD2 4.25Å; F257-F263 AromaticContact CZ-CG 3.73Å; F257-F263 HydrophobicContact CZ-CG 3.73Å; F257-I266 HydrophobicContact CZ-CG2 4.34Å; F257-L268 HydrophobicContact CE1-CB 4.11Å; F257-L268 HydrophobicContact CZ-CB 4.29Å
258	G	92.6	Very high	92.5	Very high	68 Å²	68	74.8 Å²	74.8	70%	0.701	41%	0.406	S	S	*	.	H	α-helix	trans	-70.3	-21.7	-179.9	0	0	0	0	0	114.9	I254 Q255 I256	I254-G258 PolarHBondContact O-N 3.13Å; Q255-G258 PolarHBondContact O-N 3.35Å; I256-G258 VanDerWaalsContact C-N 3.31Å; I256-G258 PolarHBondContact O-N 3.01Å
259	Q	92.8	Very high	92.3	Very high	133 Å²	133	73.3 Å²	73.3	62%	0.621	40%	0.401	S	S	*	.	H	α-helix	trans	-93.4	-13.4	177.5	-69.4	178.5	-12.7	0	0	113.2	Q255 I256 F257 E261	Q255-Q259 WeakPolarHBondContact O-CG 3.45Å; Q255-Q259 PolarHBondContact O-N 3.25Å; Q255-Q259 VanDerWaalsContact O-N 3.08Å; I256-Q259 PolarHBondContact O-N 2.91Å; I256-Q259 VanDerWaalsContact O-N 3.15Å; F257-Q259 VanDerWaalsContact C-N 3.31Å; F257-Q259 PolarHBondContact O-N 3.15Å; Q259-E261 PolarHBondContact O-N 2.87Å
260	N	89.5	Confident	92.1	Very high	34 Å²	34	77.8 Å²	77.8	18%	0.182	43%	0.428	C	S	.	.			trans	-77.8	117.6	-177.6	-173.8	-19.7	0	0	0	110.2	V202 I256 F257 Y262 F263 K264	V202-N260 PolarHBondContact O-ND2 3.42Å; I256-N260 WeakPolarHBondContact O-CB 3.31Å; I256-N260 PolarHBondContact O-N 3.49Å; F257-N260 PolarHBondContact O-N 3.43Å; N260-Y262 PolarHBondContact O-N 3.38Å; N260-Y262 VanDerWaalsContact O-N 3.12Å; N260-Y262 VanDerWaalsContact OD1-CB 3.29Å; N260-Y262 WeakPolarHBondContact OD1-CB 3.43Å; N260-Y262 PolarHBondContact OD1-N 2.85Å; N260-F263 HydrophobicContact CB-CD2 3.88Å; N260-F263 PolarHBondContact O-N 3.24Å; N260-K264 PolarHBondContact O-N 3.46Å
261	E	89.3	Confident	92	Very high	136 Å²	136	76.5 Å²	76.5	64%	0.636	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-57.4	-27.4	-180	-72.6	-68	139.1	0	0	112.9	Q259 F263 K264	Q259-E261 PolarHBondContact O-N 2.87Å; E261-F263 PolarHBondContact O-N 3.29Å; E261-K264 VanDerWaalsContact O-CB 3.29Å; E261-K264 WeakPolarHBondContact O-CB 3.35Å; E261-K264 PolarHBondContact O-N 3.03Å; E261-K264 IonicContact OE1-NZ 3.72Å; E261-K264 IonicContact OE2-NZ 3.27Å; E261-K264 PolarHBondContact OE2-NZ 3.44Å
262	Y	86.2	Confident	91.9	Very high	155 Å²	155	76.9 Å²	76.9	61%	0.608	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-63.3	-28.9	175.6	-178.4	-104.2	0	0	0	112.8	N260	N260-Y262 PolarHBondContact O-N 3.38Å; N260-Y262 VanDerWaalsContact O-N 3.12Å; N260-Y262 VanDerWaalsContact OD1-CB 3.29Å; N260-Y262 WeakPolarHBondContact OD1-CB 3.43Å; N260-Y262 PolarHBondContact OD1-N 2.85Å
263	F	89.4	Confident	91.8	Very high	9 Å²	9	76.1 Å²	76.1	4%	0.039	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-101.9	12.3	179.1	-59.4	-58.4	0	0	0	113.2	L201 D235 V236 F257 N260 E261 G265 I266	L201-F263 VanDerWaalsContact O-CZ 3.31Å; L201-F263 WeakPolarHBondContact O-CZ 3.44Å; D235-F263 HydrophobicContact CB-CE1 4.29Å; D235-F263 HydrophobicContact CB-CZ 4.23Å; V236-F263 HydrophobicContact CG2-CD1 4.04Å; V236-F263 HydrophobicContact CG2-CE1 3.99Å; F257-F263 HydrophobicContact CD1-CB 4.48Å; F257-F263 HydrophobicContact CD2-CB 4.38Å; F257-F263 HydrophobicContact CD2-CD1 4.34Å; F257-F263 AromaticContact CD2-CD2 3.46Å; F257-F263 HydrophobicContact CD2-CD2 3.46Å; F257-F263 VanDerWaalsContact CD2-CD2 3.46Å; F257-F263 AromaticContact CD2-CE2 3.74Å; F257-F263 HydrophobicContact CD2-CE2 3.74Å; F257-F263 AromaticContact CD2-CG 3.82Å; F257-F263 HydrophobicContact CD2-CG 3.82Å; F257-F263 HydrophobicContact CD2-CZ 4.28Å; F257-F263 HydrophobicContact CE1-CB 4.06Å; F257-F263 HydrophobicContact CE1-CG 4.4Å; F257-F263 HydrophobicContact CE2-CB 3.97Å; F257-F263 AromaticContact CE2-CD1 3.55Å; F257-F263 HydrophobicContact CE2-CD1 3.55Å; F257-F263 AromaticContact CE2-CD2 3.54Å; F257-F263 HydrophobicContact CE2-CD2 3.54Å; F257-F263 AromaticContact CE2-CE1 3.84Å; F257-F263 HydrophobicContact CE2-CE1 3.84Å; F257-F263 AromaticContact CE2-CE2 3.86Å; F257-F263 HydrophobicContact CE2-CE2 3.86Å; F257-F263 AromaticContact CE2-CG 3.4Å; F257-F263 HydrophobicContact CE2-CG 3.4Å; F257-F263 HydrophobicContact CE2-CZ 4Å; F257-F263 HydrophobicContact CG-CD2 4.14Å; F257-F263 HydrophobicContact CG-CG 4.48Å; F257-F263 HydrophobicContact CZ-CB 3.79Å; F257-F263 AromaticContact CZ-CD1 3.9Å; F257-F263 HydrophobicContact CZ-CD1 3.9Å; F257-F263 HydrophobicContact CZ-CD2 4.25Å; F257-F263 AromaticContact CZ-CG 3.73Å; F257-F263 HydrophobicContact CZ-CG 3.73Å; N260-F263 HydrophobicContact CB-CD2 3.88Å; N260-F263 PolarHBondContact O-N 3.24Å; E261-F263 PolarHBondContact O-N 3.29Å; F263-G265 PolarHBondContact O-N 3.05Å; F263-I266 HydrophobicContact CD1-CD1 4.49Å; F263-I266 WeakPolarHBondContact O-CB 3.46Å; F263-I266 PolarHBondContact O-N 3.36Å
264	K	90.1	Very high	91.9	Very high	147 Å²	147	81 Å²	81	64%	0.639	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	126.7	-178.7	-169.5	-177.8	-153.3	147	0	111.4	N260 E261 I266	N260-K264 PolarHBondContact O-N 3.46Å; E261-K264 VanDerWaalsContact O-CB 3.29Å; E261-K264 WeakPolarHBondContact O-CB 3.35Å; E261-K264 PolarHBondContact O-N 3.03Å; E261-K264 IonicContact OE1-NZ 3.72Å; E261-K264 IonicContact OE2-NZ 3.27Å; E261-K264 PolarHBondContact OE2-NZ 3.44Å; K264-I266 PolarHBondContact O-N 2.89Å
265	G	88.9	Confident	91.9	Very high	85 Å²	85	80.8 Å²	80.8	88%	0.876	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	0.7	-178.2	0	0	0	0	0	114.7	F263	F263-G265 PolarHBondContact O-N 3.05Å
266	I	91.2	Very high	91.9	Very high	80 Å²	80	77.7 Å²	77.7	41%	0.41	45%	0.445	S	S	.	.			trans	-99.2	131.9	174.6	-55.4	179.5	0	0	0	108.9	V236 F257 F263 K264	V236-I266 HydrophobicContact CG1-CG2 4.15Å; V236-I266 HydrophobicContact CG2-CD1 4.45Å; V236-I266 HydrophobicContact CG2-CG2 3.9Å; F257-I266 HydrophobicContact CZ-CG2 4.34Å; F263-I266 HydrophobicContact CD1-CD1 4.49Å; F263-I266 WeakPolarHBondContact O-CB 3.46Å; F263-I266 PolarHBondContact O-N 3.36Å; K264-I266 PolarHBondContact O-N 2.89Å
267	T	89.2	Confident	91.9	Very high	123 Å²	123	76.6 Å²	76.6	76%	0.755	44%	0.439	S	S	*	.			trans	-104.9	133.3	171.1	-51.1	0	0	0	0	109.2	P269	T267-P269 VanDerWaalsContact O-CD 3.31Å; T267-P269 WeakPolarHBondContact O-CD 3.46Å
268	L	89.8	Confident	91.9	Very high	14 Å²	14	78.7 Å²	78.7	7%	0.073	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-69.9	118.8	176.3	-174.2	66.9	0	0	0	109.9	V236 L239 R243 L249 I254 F257	V236-L268 HydrophobicContact CG1-CD1 4.24Å; L239-L268 HydrophobicContact CB-CD1 3.58Å; L239-L268 HydrophobicContact CB-CD2 4.43Å; L239-L268 HydrophobicContact CD1-CD1 4.25Å; R243-L268 PolarHBondContact NH1-O 3.48Å; L249-L268 HydrophobicContact CD1-CD2 3.67Å; L249-L268 HydrophobicContact CG-CD2 4.36Å; I254-L268 HydrophobicContact CD1-CD2 4.18Å; F257-L268 HydrophobicContact CE1-CB 4.11Å; F257-L268 HydrophobicContact CZ-CB 4.29Å
269	P	91.6	Very high	92	Very high	60 Å²	60	80.7 Å²	80.7	39%	0.39	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-63.3	145.1	-176.3	-20.1	31.7	0	0	0	112.3	Y240 R243 T267 P271	Y240-P269 HydrophobicContact CD2-CB 3.79Å; Y240-P269 HydrophobicContact CD2-CG 4.42Å; Y240-P269 HydrophobicContact CE2-CB 4.16Å; R243-P269 VanDerWaalsContact NH1-C 3.29Å; R243-P269 PolarHBondContact NH1-O 3.04Å; T267-P269 VanDerWaalsContact O-CD 3.31Å; T267-P269 WeakPolarHBondContact O-CD 3.46Å; P269-P271 WeakPolarHBondContact O-CD 3.45Å
270	V	92.6	Very high	92	Very high	103 Å²	103	77 Å²	77	62%	0.624	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-92.5	116.6	174.1	-172.1	0	0	0	0	108.8	R243	R243-V270 VanDerWaalsContact NH1-CA 3.32Å
271	P	93.8	Very high	92.3	Very high	14 Å²	14	75.7 Å²	75.7	9%	0.091	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-62.1	132.8	173	-18.2	29.2	0	0	0	110.3	Y240 R243 K244 P269 T273	Y240-P271 HydrophobicContact CD2-CG 3.94Å; Y240-P271 HydrophobicContact CE2-CB 3.96Å; Y240-P271 HydrophobicContact CE2-CG 3.67Å; R243-P271 HydrophobicContact CB-CG 4.18Å; R243-P271 HydrophobicContact CG-CG 3.93Å; K244-P271 HydrophobicContact CB-CB 4.01Å; K244-P271 HydrophobicContact CB-CG 3.91Å; K244-P271 HydrophobicContact CG-CB 3.99Å; K244-P271 HydrophobicContact CG-CG 4.45Å; P269-P271 WeakPolarHBondContact O-CD 3.45Å; P271-T273 VanDerWaalsContact C-N 3.28Å; P271-T273 PolarHBondContact O-N 3.45Å
272	P	93.3	Very high	92.5	Very high	116 Å²	116	71 Å²	71	75%	0.753	40%	0.4	S	S	*	.	S	Bend	trans	-70.7	-27.4	-179.6	28.4	-35	0	0	0	112.4
273	T	95.1	Very high	92.7	Very high	90 Å²	90	66.7 Å²	66.7	55%	0.552	40%	0.397	S	S	*	.	S	Bend	trans	-138.4	152.5	177.8	55.9	0	0	0	0	109.9	P271	P271-T273 VanDerWaalsContact C-N 3.28Å; P271-T273 PolarHBondContact O-N 3.45Å
274	L	96.4	Very high	92.4	Very high	107 Å²	107	72.1 Å²	72.1	56%	0.56	42%	0.42	S	S	*	.			trans	-89.2	145.2	172.8	-61.3	-180	0	0	0	110.5	K244	K244-L274 CarbonylContact O-C 3.52Å; K244-L274 VanDerWaalsContact O-CA 3.27Å; K244-L274 WeakPolarHBondContact O-CA 2.88Å
275	E	95.8	Very high	92.1	Very high	67 Å²	67	65.5 Å²	65.5	31%	0.313	39%	0.393	S	S	.	.			trans	-117.6	91.5	168.1	-74.3	177.6	-172.2	0	0	108.2	K244 T245 K280	K244-E275 HydrophobicContact CD-CG 4.37Å; K244-E275 VanDerWaalsContact CE-CD 3.48Å; K244-E275 WeakPolarHBondContact CE-OE1 3.31Å; K244-E275 HydrophobicContact CG-CB 4.45Å; K244-E275 HydrophobicContact CG-CG 4.43Å; K244-E275 VanDerWaalsContact NZ-CD 3.32Å; K244-E275 IonicContact NZ-OE1 3.74Å; K244-E275 PolarHBondContact NZ-OE1 3.26Å; K244-E275 IonicContact NZ-OE2 2.8Å; K244-E275 PolarHBondContact O-N 3.12Å; T245-E275 VanDerWaalsContact CA-O 3.23Å; T245-E275 WeakPolarHBondContact CA-O 3.33Å; T245-E275 WeakPolarHBondContact CG2-O 3.23Å; T245-E275 PolarHBondContact OG1-O 2.94Å; E275-K280 IonicContact OE2-NZ 3Å; E275-K280 PolarHBondContact OE2-NZ 3.34Å
276	P	94.7	Very high	91.7	Very high	50 Å²	50	65.7 Å²	65.7	33%	0.325	37%	0.37	S	S	.	.			trans	-49.9	155.1	-178	-26.9	32.8	0	0	0	113.8	E278 D279 K280	P276-E278 WeakPolarHBondContact CB-OE2 3.31Å; P276-E278 PolarHBondContact O-N 3.28Å; P276-D279 WeakPolarHBondContact CD-OD2 3.31Å; P276-D279 PolarHBondContact O-N 3.22Å; P276-D279 VanDerWaalsContact O-N 3.08Å; P276-K280 PolarHBondContact O-N 3.49Å
277	L	94.3	Very high	91	Very high	6 Å²	6	69.7 Å²	69.7	3%	0.031	39%	0.388	C	S	.	.	H	α-helix	trans	-60.4	-34.7	-177.5	-176	58.7	0	0	0	112	L229 T245 D279 K280 M281 L295 K296 L299	L229-L277 HydrophobicContact CD1-CD1 4.06Å; L229-L277 HydrophobicContact CD2-CD1 4.08Å; T245-L277 HydrophobicContact CG2-CB 4.04Å; T245-L277 HydrophobicContact CG2-CD1 4.18Å; L277-D279 VanDerWaalsContact C-N 3.34Å; L277-D279 PolarHBondContact O-N 3.38Å; L277-K280 PolarHBondContact O-N 2.95Å; L277-M281 WeakPolarHBondContact O-CG 3.41Å; L277-M281 PolarHBondContact O-N 3.44Å; L277-L295 HydrophobicContact CD2-CB 3.86Å; L277-K296 HydrophobicContact CD2-CG 4.46Å; L277-L299 HydrophobicContact CD1-CD1 4.26Å; L277-L299 HydrophobicContact CD2-CD1 4.24Å
278	E	93.9	Very high	90.8	Very high	56 Å²	56	66 Å²	66	26%	0.262	36%	0.363	S	S	.	.	H	α-helix	trans	-58.1	-43.2	175.4	-63.3	84.6	170.2	0	0	112	P276 K280 M281 Q286 I292 K296	P276-E278 WeakPolarHBondContact CB-OE2 3.31Å; P276-E278 PolarHBondContact O-N 3.28Å; E278-K280 PolarHBondContact O-N 3.18Å; E278-M281 WeakPolarHBondContact O-CB 3.32Å; E278-M281 PolarHBondContact O-N 3.46Å; E278-Q286 PolarHBondContact O-NE2 3.11Å; E278-I292 HydrophobicContact CG-CD1 4.27Å; E278-I292 HydrophobicContact CG-CG1 4.38Å; E278-I292 HydrophobicContact CG-CG2 3.9Å; E278-K296 WeakPolarHBondContact OE1-CE 3.46Å; E278-K296 IonicContact OE1-NZ 2.87Å; E278-K296 PolarHBondContact OE1-NZ 3.48Å
279	D	93.8	Very high	90.8	Very high	109 Å²	109	69.9 Å²	69.9	58%	0.583	39%	0.389	S	S	*	.	H	α-helix	trans	-72.4	-22.3	-178	-66.4	-14.8	0	0	0	112.1	P276 L277 M281	P276-D279 WeakPolarHBondContact CD-OD2 3.31Å; P276-D279 PolarHBondContact O-N 3.22Å; P276-D279 VanDerWaalsContact O-N 3.08Å; L277-D279 VanDerWaalsContact C-N 3.34Å; L277-D279 PolarHBondContact O-N 3.38Å; D279-M281 VanDerWaalsContact C-N 3.3Å
280	K	94	Very high	91	Very high	55 Å²	55	70.2 Å²	70.2	24%	0.239	39%	0.387	C	S	.	.	H	α-helix	trans	-74.3	-23.2	169.5	-63.2	-162.3	172.6	-68.8	0	111.7	R225 L229 T245 E275 P276 L277 E278	R225-K280 VanDerWaalsContact CZ-C 3.4Å; R225-K280 PolarHBondContact NE-O 3Å; R225-K280 VanDerWaalsContact NH1-CB 3.27Å; R225-K280 PolarHBondContact NH1-O 3.48Å; R225-K280 VanDerWaalsContact NH1-O 3.09Å; R225-K280 PolarHBondContact NH2-O 2.82Å; L229-K280 HydrophobicContact CD1-CB 4.22Å; L229-K280 HydrophobicContact CD1-CD 4.08Å; T245-K280 HydrophobicContact CG2-CD 4.29Å; T245-K280 WeakPolarHBondContact OG1-CE 3.48Å; E275-K280 IonicContact OE2-NZ 3Å; E275-K280 PolarHBondContact OE2-NZ 3.34Å; P276-K280 PolarHBondContact O-N 3.49Å; L277-K280 PolarHBondContact O-N 2.95Å; E278-K280 PolarHBondContact O-N 3.18Å
281	M	95.2	Very high	91.1	Very high	8 Å²	8	65.6 Å²	65.6	4%	0.039	36%	0.359	C	S	.	.	S	Bend	trans	-76.9	143.5	-179	-59	-55.5	-64.4	0	0	114	V224 R225 L277 E278 D279 Q286 T291 I292 L295	V224-M281 HydrophobicContact CB-CE 3.82Å; V224-M281 HydrophobicContact CG1-CE 3.47Å; V224-M281 VanDerWaalsContact CG1-CE 3.47Å; V224-M281 HydrophobicContact CG2-CE 4.45Å; R225-M281 PolarHBondContact NH1-SD 2.83Å; R225-M281 VanDerWaalsContact NH2-CA 3.25Å; R225-M281 PolarHBondContact NH2-SD 3.44Å; L277-M281 WeakPolarHBondContact O-CG 3.41Å; L277-M281 PolarHBondContact O-N 3.44Å; E278-M281 WeakPolarHBondContact O-CB 3.32Å; E278-M281 PolarHBondContact O-N 3.46Å; D279-M281 VanDerWaalsContact C-N 3.3Å; M281-Q286 HydrophobicContact CB-CG 4.46Å; M281-T291 HydrophobicContact CE-CG2 4.11Å; M281-I292 HydrophobicContact CB-CD1 4.13Å; M281-I292 HydrophobicContact CG-CD1 3.52Å; M281-L295 HydrophobicContact CE-CD1 3.65Å; M281-L295 HydrophobicContact CG-CD1 4.06Å; M281-L295 HydrophobicContact SD-CD1 3.34Å; M281-L295 WeakPolarHBondContact SD-CD1 3.4Å
282	P	93.4	Very high	91.2	Very high	36 Å²	36	65.6 Å²	65.6	23%	0.234	36%	0.358	C	S	.	.			trans	-54.9	144.3	169.8	-24.6	34.5	0	0	0	110.4	V224 R225 K284 S285 Q286	V224-P282 HydrophobicContact CG1-CG 4.48Å; R225-P282 HydrophobicContact CB-CG 3.94Å; P282-K284 HydrophobicContact CB-CG 3.99Å; P282-K284 PolarHBondContact O-N 2.87Å; P282-K284 VanDerWaalsContact O-N 3.09Å; P282-S285 WeakPolarHBondContact O-CA 3.39Å; P282-S285 VanDerWaalsContact O-CB 3.29Å; P282-S285 WeakPolarHBondContact O-CB 3.19Å; P282-S285 PolarHBondContact O-N 3.39Å; P282-Q286 PolarHBondContact O-N 3.42Å
283	A	89.6	Confident	91.4	Very high	65 Å²	65	62.7 Å²	62.7	54%	0.537	34%	0.337	S	S	.	.	H	α-helix	trans	-52.5	-37.2	-177.6	0	0	0	0	0	113.4	S285 Q286 Q287	A283-S285 PolarHBondContact O-N 3.11Å; A283-Q286 WeakPolarHBondContact O-CB 2.91Å; A283-Q286 PolarHBondContact O-N 3.05Å; A283-Q287 PolarHBondContact O-N 3.13Å
284	K	84.8	Confident	91.6	Very high	124 Å²	124	58.4 Å²	58.4	54%	0.539	31%	0.31	S	S	.	.	H	α-helix	trans	-56.7	-33.9	174.3	64.1	178.9	179.8	-175.1	0	113.2	P282	P282-K284 HydrophobicContact CB-CG 3.99Å; P282-K284 PolarHBondContact O-N 2.87Å; P282-K284 VanDerWaalsContact O-N 3.09Å
285	S	83.5	Confident	91.6	Very high	8 Å²	8	53.3 Å²	53.3	6%	0.056	28%	0.284	C	S	.	.	H	α-helix	trans	-82.8	-27.2	-178.4	-58.7	0	0	0	0	112.3	V224 P282 A283 Q287 N288	V224-S285 WeakPolarHBondContact CG1-OG 3.05Å; P282-S285 WeakPolarHBondContact O-CA 3.39Å; P282-S285 VanDerWaalsContact O-CB 3.29Å; P282-S285 WeakPolarHBondContact O-CB 3.19Å; P282-S285 PolarHBondContact O-N 3.39Å; A283-S285 PolarHBondContact O-N 3.11Å; S285-Q287 PolarHBondContact O-N 3.42Å; S285-N288 PolarHBondContact O-N 3.23Å; S285-N288 VanDerWaalsContact O-N 3.13Å
286	Q	79.9	Confident	91.7	Very high	88 Å²	88	54.7 Å²	54.7	41%	0.411	29%	0.289	S	S	.	.	H	α-helix	trans	-64.3	-29.8	173.6	-62.2	178.9	-27.5	0	0	111.6	E278 M281 P282 A283 N288	E278-Q286 PolarHBondContact O-NE2 3.11Å; M281-Q286 HydrophobicContact CB-CG 4.46Å; P282-Q286 PolarHBondContact O-N 3.42Å; A283-Q286 WeakPolarHBondContact O-CB 2.91Å; A283-Q286 PolarHBondContact O-N 3.05Å; Q286-N288 VanDerWaalsContact C-N 3.27Å; Q286-N288 PolarHBondContact O-N 3.41Å
287	Q	76.6	Confident	91.9	Very high	165 Å²	165	54.7 Å²	54.7	77%	0.771	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-15.3	175.7	-63.8	176.6	-6.1	0	0	113.3	A283 S285 P289	A283-Q287 PolarHBondContact O-N 3.13Å; S285-Q287 PolarHBondContact O-N 3.42Å; Q287-P289 VanDerWaalsContact O-CD 3.27Å; Q287-P289 WeakPolarHBondContact O-CD 3.43Å
288	N	85.3	Confident	92.1	Very high	44 Å²	44	54.4 Å²	54.4	24%	0.235	28%	0.282	C	S	.	.			trans	-102.4	96.8	176.4	-174.4	-22.8	0	0	0	110.1	S285 Q286 L290 T291	S285-N288 PolarHBondContact O-N 3.23Å; S285-N288 VanDerWaalsContact O-N 3.13Å; Q286-N288 VanDerWaalsContact C-N 3.27Å; Q286-N288 PolarHBondContact O-N 3.41Å; N288-L290 PolarHBondContact O-N 3.39Å; N288-L290 VanDerWaalsContact O-N 3.1Å; N288-L290 WeakPolarHBondContact OD1-CB 3.5Å; N288-L290 PolarHBondContact OD1-N 3.38Å; N288-L290 VanDerWaalsContact OD1-N 3.11Å; N288-T291 WeakPolarHBondContact O-CB 3.13Å; N288-T291 PolarHBondContact O-N 3.13Å; N288-T291 PolarHBondContact OD1-N 3.32Å
289	P	89.8	Confident	92.4	Very high	96 Å²	96	52 Å²	52	62%	0.623	27%	0.271	S	S	*	.	H	α-helix	trans	-61.3	-25.5	-175.6	24.7	-34.4	0	0	0	113.1	Q287 T291 D293	Q287-P289 VanDerWaalsContact O-CD 3.27Å; Q287-P289 WeakPolarHBondContact O-CD 3.43Å; P289-T291 VanDerWaalsContact C-N 3.32Å; P289-T291 PolarHBondContact O-N 3.26Å; P289-D293 WeakPolarHBondContact O-CB 3.35Å; P289-D293 PolarHBondContact O-N 3.43Å
290	L	95.7	Very high	92.6	Very high	67 Å²	67	49 Å²	49	35%	0.351	26%	0.255	S	S	.	.	H	α-helix	trans	-70	-30.1	178	-57.8	175.8	0	0	0	112.2	N288 F294 H315 Y317	N288-L290 PolarHBondContact O-N 3.39Å; N288-L290 VanDerWaalsContact O-N 3.1Å; N288-L290 WeakPolarHBondContact OD1-CB 3.5Å; N288-L290 PolarHBondContact OD1-N 3.38Å; N288-L290 VanDerWaalsContact OD1-N 3.11Å; L290-F294 VanDerWaalsContact O-CB 3.26Å; L290-F294 WeakPolarHBondContact O-CB 3.37Å; L290-F294 PolarHBondContact O-N 3.33Å; L290-H315 PolarHBondContact O-CE1 3.39Å; L290-Y317 HydrophobicContact CB-CD2 4.18Å
291	T	95.2	Very high	92.6	Very high	6 Å²	6	49.5 Å²	49.5	4%	0.037	26%	0.257	C	S	.	.	H	α-helix	trans	-66.4	-47	177.3	-61.3	0	0	0	0	110.5	F220 M281 N288 P289 L295 Y317	F220-T291 HydrophobicContact CE1-CG2 3.75Å; F220-T291 HydrophobicContact CZ-CG2 3.95Å; M281-T291 HydrophobicContact CE-CG2 4.11Å; N288-T291 WeakPolarHBondContact O-CB 3.13Å; N288-T291 PolarHBondContact O-N 3.13Å; N288-T291 PolarHBondContact OD1-N 3.32Å; P289-T291 VanDerWaalsContact C-N 3.32Å; P289-T291 PolarHBondContact O-N 3.26Å; T291-L295 PolarHBondContact O-N 3.49Å; T291-L295 VanDerWaalsContact O-N 3.16Å; T291-Y317 WeakPolarHBondContact OG1-CE2 3.44Å
292	I	95.4	Very high	92.7	Very high	14 Å²	14	50.5 Å²	50.5	7%	0.072	26%	0.263	C	S	.	.	H	α-helix	trans	-69.2	-42.2	178.5	-59.6	-56.6	0	0	0	111.2	E278 M281 F294 L295 K296	E278-I292 HydrophobicContact CG-CD1 4.27Å; E278-I292 HydrophobicContact CG-CG1 4.38Å; E278-I292 HydrophobicContact CG-CG2 3.9Å; M281-I292 HydrophobicContact CB-CD1 4.13Å; M281-I292 HydrophobicContact CG-CD1 3.52Å; I292-F294 PolarHBondContact O-N 3.03Å; I292-L295 PolarHBondContact O-N 3.1Å; I292-K296 HydrophobicContact CG2-CD 4.07Å; I292-K296 HydrophobicContact CG2-CG 4.41Å; I292-K296 WeakPolarHBondContact O-CG 3.39Å; I292-K296 PolarHBondContact O-N 3.28Å
293	D	97.5	Very high	92.9	Very high	56 Å²	56	50.1 Å²	50.1	30%	0.299	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-45.5	177.7	-169.4	58.7	0	0	0	111.3	P289 L295 K296 K297 H315	P289-D293 WeakPolarHBondContact O-CB 3.35Å; P289-D293 PolarHBondContact O-N 3.43Å; D293-L295 VanDerWaalsContact C-N 3.32Å; D293-L295 PolarHBondContact O-N 3.4Å; D293-K296 PolarHBondContact O-N 2.82Å; D293-K296 VanDerWaalsContact O-N 3.12Å; D293-K297 WeakPolarHBondContact O-CG 3.31Å; D293-K297 PolarHBondContact O-N 2.92Å; D293-K297 IonicContact OD1-NZ 3.55Å; D293-K297 PolarHBondContact OD1-NZ 3.25Å; D293-K297 IonicContact OD2-NZ 3.24Å; D293-K297 PolarHBondContact OD2-NZ 3.04Å; D293-H315 IonicContact OD2-NE2 2.88Å; D293-H315 PolarHBondContact OD2-NE2 2.92Å; D293-H315 VanDerWaalsContact OD2-NE2 3.14Å
294	F	98.4	Very high	93.3	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-55.8	-47.5	176.4	-178.8	-95.9	0	0	0	111.7	L140 F220 L290 I292 K296 K297 C298 L312 H315 F318	L140-F294 HydrophobicContact CD1-CE2 4.15Å; L140-F294 HydrophobicContact CD1-CZ 4.03Å; F220-F294 HydrophobicContact CB-CD1 4.49Å; F220-F294 HydrophobicContact CB-CE1 3.96Å; F220-F294 AromaticContact CD1-CD1 3.59Å; F220-F294 HydrophobicContact CD1-CD1 3.59Å; F220-F294 AromaticContact CD1-CE1 3.92Å; F220-F294 HydrophobicContact CD1-CE1 3.92Å; F220-F294 HydrophobicContact CD2-CD1 4.21Å; F220-F294 HydrophobicContact CD2-CE1 4Å; F220-F294 AromaticContact CE1-CD1 3.74Å; F220-F294 HydrophobicContact CE1-CD1 3.74Å; F220-F294 HydrophobicContact CE1-CE1 4.43Å; F220-F294 HydrophobicContact CE2-CD1 4.35Å; F220-F294 AromaticContact CG-CD1 3.82Å; F220-F294 HydrophobicContact CG-CD1 3.82Å; F220-F294 AromaticContact CG-CE1 3.67Å; F220-F294 HydrophobicContact CG-CE1 3.67Å; F220-F294 HydrophobicContact CZ-CD1 4.12Å; L290-F294 VanDerWaalsContact O-CB 3.26Å; L290-F294 WeakPolarHBondContact O-CB 3.37Å; L290-F294 PolarHBondContact O-N 3.33Å; I292-F294 PolarHBondContact O-N 3.03Å; F294-K296 PolarHBondContact O-N 3.49Å; F294-K297 PolarHBondContact O-N 2.98Å; F294-C298 PolarHBondContact O-N 3.4Å; F294-C298 VanDerWaalsContact O-N 3.14Å; F294-C298 PolarHBondContact O-SG 3.08Å; F294-L312 HydrophobicContact CD2-CD2 3.95Å; F294-L312 HydrophobicContact CE2-CB 4.1Å; F294-L312 HydrophobicContact CE2-CD2 3.65Å; F294-L312 HydrophobicContact CE2-CG 4.36Å; F294-L312 HydrophobicContact CZ-CD2 4.37Å; F294-H315 HydrophobicContact CD2-CB 4.08Å; F294-H315 AromaticContact CD2-CG 3.81Å; F294-H315 AromaticContact CD2-ND1 3.84Å; F294-F318 HydrophobicContact CD2-CE2 4.11Å; F294-F318 AromaticContact CE2-CE2 3.52Å; F294-F318 HydrophobicContact CE2-CE2 3.52Å; F294-F318 AromaticContact CE2-CZ 3.98Å; F294-F318 HydrophobicContact CE2-CZ 3.98Å; F294-F318 HydrophobicContact CZ-CE2 4.07Å; F294-F318 HydrophobicContact CZ-CZ 4.07Å
295	L	98	Very high	93.9	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.3	-45.8	175.8	-82.6	169.2	0	0	0	112.3	G217 F220 A221 L277 M281 T291 I292 D293 K297 C298 L299	G217-L295 WeakPolarHBondContact O-CD2 3.2Å; F220-L295 HydrophobicContact CD1-CD1 4.37Å; F220-L295 HydrophobicContact CD1-CD2 3.69Å; F220-L295 HydrophobicContact CD1-CG 3.72Å; F220-L295 HydrophobicContact CE1-CD1 4.31Å; F220-L295 HydrophobicContact CE1-CD2 4.39Å; F220-L295 HydrophobicContact CE1-CG 3.91Å; A221-L295 HydrophobicContact CB-CD2 3.9Å; L277-L295 HydrophobicContact CD2-CB 3.86Å; M281-L295 HydrophobicContact CE-CD1 3.65Å; M281-L295 HydrophobicContact CG-CD1 4.06Å; M281-L295 HydrophobicContact SD-CD1 3.34Å; M281-L295 WeakPolarHBondContact SD-CD1 3.4Å; T291-L295 PolarHBondContact O-N 3.49Å; T291-L295 VanDerWaalsContact O-N 3.16Å; I292-L295 PolarHBondContact O-N 3.1Å; D293-L295 VanDerWaalsContact C-N 3.32Å; D293-L295 PolarHBondContact O-N 3.4Å; L295-K297 VanDerWaalsContact C-N 3.29Å; L295-K297 PolarHBondContact O-N 2.96Å; L295-C298 PolarHBondContact O-N 3.29Å; L295-L299 HydrophobicContact CD2-CD1 3.79Å; L295-L299 WeakPolarHBondContact O-CB 3.39Å; L295-L299 PolarHBondContact O-N 3.24Å
296	K	97.6	Very high	94.6	Very high	96 Å²	96	53.1 Å²	53.1	42%	0.417	27%	0.27	S	S	.	.	H	α-helix	trans	-63	-33.9	176.8	-73.7	177.7	177	176.5	0	112.4	L277 E278 I292 D293 F294 C298	L277-K296 HydrophobicContact CD2-CG 4.46Å; E278-K296 WeakPolarHBondContact OE1-CE 3.46Å; E278-K296 IonicContact OE1-NZ 2.87Å; E278-K296 PolarHBondContact OE1-NZ 3.48Å; I292-K296 HydrophobicContact CG2-CD 4.07Å; I292-K296 HydrophobicContact CG2-CG 4.41Å; I292-K296 WeakPolarHBondContact O-CG 3.39Å; I292-K296 PolarHBondContact O-N 3.28Å; D293-K296 PolarHBondContact O-N 2.82Å; D293-K296 VanDerWaalsContact O-N 3.12Å; F294-K296 PolarHBondContact O-N 3.49Å; K296-C298 VanDerWaalsContact C-N 3.26Å; K296-C298 PolarHBondContact O-N 3.39Å
297	K	98.6	Very high	95.5	Very high	50 Å²	50	52 Å²	52	22%	0.217	26%	0.262	C	S	.	.	H	α-helix	trans	-69.2	-23.8	173.4	-62.4	-37.5	-168.4	-122.8	0	113.1	D293 F294 L295 R306 W307 L312	D293-K297 WeakPolarHBondContact O-CG 3.31Å; D293-K297 PolarHBondContact O-N 2.92Å; D293-K297 IonicContact OD1-NZ 3.55Å; D293-K297 PolarHBondContact OD1-NZ 3.25Å; D293-K297 IonicContact OD2-NZ 3.24Å; D293-K297 PolarHBondContact OD2-NZ 3.04Å; F294-K297 PolarHBondContact O-N 2.98Å; L295-K297 VanDerWaalsContact C-N 3.29Å; L295-K297 PolarHBondContact O-N 2.96Å; K297-R306 WeakPolarHBondContact O-CA 3.34Å; K297-W307 HydrophobicContact CB-CB 4.25Å; K297-W307 HydrophobicContact CB-CD2 4Å; K297-W307 HydrophobicContact CB-CE3 4.39Å; K297-W307 HydrophobicContact CB-CG 3.93Å; K297-W307 HydrophobicContact CD-CD2 4.08Å; K297-W307 HydrophobicContact CD-CG 4.35Å; K297-W307 HydrophobicContact CD-CZ2 3.96Å; K297-W307 VanDerWaalsContact CE-CE2 3.48Å; K297-W307 HydrophobicContact CG-CD2 3.76Å; K297-W307 HydrophobicContact CG-CE3 4.09Å; K297-W307 HydrophobicContact CG-CG 4.15Å; K297-W307 HydrophobicContact CG-CH2 4.45Å; K297-W307 HydrophobicContact CG-CZ2 4.15Å; K297-W307 HydrophobicContact CG-CZ3 4.43Å; K297-W307 PolarHBondContact O-N 3.42Å; K297-L312 HydrophobicContact CB-CD2 3.87Å
298	C	98.8	Very high	96.6	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-92.1	-38.5	178	-60.1	0	0	0	0	113.1	V213 F294 L295 K296 R306	V213-C298 HydrophobicContact CG1-CB 4.19Å; F294-C298 PolarHBondContact O-N 3.4Å; F294-C298 VanDerWaalsContact O-N 3.14Å; F294-C298 PolarHBondContact O-SG 3.08Å; L295-C298 PolarHBondContact O-N 3.29Å; K296-C298 VanDerWaalsContact C-N 3.26Å; K296-C298 PolarHBondContact O-N 3.39Å; C298-R306 WeakPolarHBondContact O-CD 3.46Å; C298-R306 WeakPolarHBondContact O-CG 3.31Å
299	L	98.6	Very high	97.2	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.021	23%	0.233	C	C	.	.			trans	-109.4	37.7	-165.3	-60.1	176.4	0	0	0	113	W214 L229 W230 L246 L277 L295	W214-L299 HydrophobicContact CD2-CD2 3.76Å; W214-L299 HydrophobicContact CE3-CB 4.45Å; W214-L299 HydrophobicContact CE3-CD2 3.87Å; W214-L299 HydrophobicContact CG-CD2 4.17Å; W214-L299 HydrophobicContact CZ2-CD2 4.47Å; W214-L299 HydrophobicContact CZ3-CB 4.29Å; W214-L299 HydrophobicContact CZ3-CD2 4.28Å; W214-L299 WeakPolarHBondContact O-CD2 3.47Å; L229-L299 HydrophobicContact CD2-CD1 3.48Å; L229-L299 VanDerWaalsContact CD2-CD1 3.48Å; W230-L299 HydrophobicContact CH2-CB 4.49Å; W230-L299 HydrophobicContact CH2-CD1 4.02Å; W230-L299 HydrophobicContact CH2-CD2 4.3Å; W230-L299 HydrophobicContact CZ3-CD1 4.36Å; W230-L299 HydrophobicContact CZ3-CD2 4.11Å; L246-L299 WeakPolarHBondContact CD1-O 3.34Å; L277-L299 HydrophobicContact CD1-CD1 4.26Å; L277-L299 HydrophobicContact CD2-CD1 4.24Å; L295-L299 HydrophobicContact CD2-CD1 3.79Å; L295-L299 WeakPolarHBondContact O-CB 3.39Å; L295-L299 PolarHBondContact O-N 3.24Å
300	D	98.1	Very high	97.6	Very high	47 Å²	47	46 Å²	46	25%	0.251	23%	0.23	S	C	.	.			trans	-74.8	136.3	167.6	-159	-52.1	0	0	0	109.8	D302 K305 R306	D300-D302 PolarHBondContact O-N 2.94Å; D300-D302 WeakPolarHBondContact OD1-CB 3.29Å; D300-D302 PolarHBondContact OD1-N 2.86Å; D300-K305 HydrophobicContact CB-CB 3.98Å; D300-K305 WeakPolarHBondContact OD2-CB 3.46Å; D300-K305 WeakPolarHBondContact OD2-CD 3.1Å; D300-R306 HydrophobicContact CB-CG 4.14Å; D300-R306 PolarHBondContact O-NE 3.5Å; D300-R306 PolarHBondContact O-NH2 2.97Å
301	K	95.6	Very high	97.7	Very high	66 Å²	66	47.6 Å²	47.6	29%	0.287	23%	0.234	S	C	.	.	S	Bend	trans	-64.6	-24.2	175	57.7	170.6	169.5	-75.8	0	112.4	L246 D248 P303	L246-K301 PolarHBondContact O-NZ 3.09Å; D248-K301 WeakPolarHBondContact O-CD 3.25Å; D248-K301 WeakPolarHBondContact O-CE 3.46Å; K301-P303 WeakPolarHBondContact O-CD 3.4Å
302	D	97.4	Very high	97.9	Very high	29 Å²	29	47.3 Å²	47.3	16%	0.155	23%	0.233	C	C	.	.	S	Bend	trans	-87.9	111.2	170.7	-173.7	-18.4	0	0	0	110.1	L250 D300 T304 K305	L250-D302 HydrophobicContact CD1-CB 4.12Å; L250-D302 HydrophobicContact CD2-CB 4.35Å; D300-D302 PolarHBondContact O-N 2.94Å; D300-D302 WeakPolarHBondContact OD1-CB 3.29Å; D300-D302 PolarHBondContact OD1-N 2.86Å; D302-T304 VanDerWaalsContact CG-OG1 3.22Å; D302-T304 PolarHBondContact O-N 2.92Å; D302-T304 VanDerWaalsContact O-N 3.1Å; D302-T304 WeakPolarHBondContact OD1-CB 3.43Å; D302-T304 PolarHBondContact OD1-N 3.22Å; D302-T304 PolarHBondContact OD1-OG1 3.38Å; D302-T304 PolarHBondContact OD2-OG1 3.27Å; D302-K305 HydrophobicContact CB-CB 4.29Å; D302-K305 HydrophobicContact CB-CD 3.92Å; D302-K305 HydrophobicContact CB-CG 3.96Å; D302-K305 PolarHBondContact O-N 2.99Å; D302-K305 WeakPolarHBondContact OD2-CE 3.18Å
303	P	97.4	Very high	98	Very high	28 Å²	28	47.4 Å²	47.4	18%	0.182	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-22.9	-178.4	25.2	-33.9	0	0	0	113	P210 K301 K305	P210-P303 HydrophobicContact CB-CB 3.84Å; P210-P303 WeakPolarHBondContact CB-O 3.42Å; P210-P303 HydrophobicContact CG-CB 4.27Å; P210-P303 WeakPolarHBondContact CG-O 3.49Å; K301-P303 WeakPolarHBondContact O-CD 3.4Å; P303-K305 VanDerWaalsContact C-N 3.3Å
304	T	97	Very high	98	Very high	117 Å²	117	51.6 Å²	51.6	72%	0.718	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-20.2	178.6	71.2	0	0	0	0	113.2	D302	D302-T304 VanDerWaalsContact CG-OG1 3.22Å; D302-T304 PolarHBondContact O-N 2.92Å; D302-T304 VanDerWaalsContact O-N 3.1Å; D302-T304 WeakPolarHBondContact OD1-CB 3.43Å; D302-T304 PolarHBondContact OD1-N 3.22Å; D302-T304 PolarHBondContact OD1-OG1 3.38Å; D302-T304 PolarHBondContact OD2-OG1 3.27Å
305	K	98.1	Very high	98	Very high	128 Å²	128	51.9 Å²	51.9	56%	0.557	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-16.2	178.6	-65.2	-175.8	-174.4	174.9	0	113.1	D300 D302 P303	D300-K305 HydrophobicContact CB-CB 3.98Å; D300-K305 WeakPolarHBondContact OD2-CB 3.46Å; D300-K305 WeakPolarHBondContact OD2-CD 3.1Å; D302-K305 HydrophobicContact CB-CB 4.29Å; D302-K305 HydrophobicContact CB-CD 3.92Å; D302-K305 HydrophobicContact CB-CG 3.96Å; D302-K305 PolarHBondContact O-N 2.99Å; D302-K305 WeakPolarHBondContact OD2-CE 3.18Å; P303-K305 VanDerWaalsContact C-N 3.3Å
306	R	98.6	Very high	98	Very high	15 Å²	15	54.7 Å²	54.7	6%	0.057	27%	0.271	C	S	.	.	S	Bend	trans	-66	137.9	175	-60.4	-179.6	-161.7	144.2	13.3	110.1	E199 P210 V213 K297 C298 D300	E199-R306 IonicContact OE1-CZ 3.68Å; E199-R306 IonicContact OE1-NH1 3.14Å; E199-R306 PolarHBondContact OE1-NH1 3.32Å; E199-R306 IonicContact OE1-NH2 2.63Å; E199-R306 PolarHBondContact OE1-NH2 3.24Å; E199-R306 IonicContact OE2-CZ 2.68Å; E199-R306 IonicContact OE2-NH1 3.19Å; E199-R306 IonicContact OE2-NH2 3.28Å; E199-R306 PolarHBondContact OE2-NH2 2.93Å; P210-R306 HydrophobicContact CB-CB 4.45Å; P210-R306 PolarHBondContact O-NH1 2.85Å; V213-R306 HydrophobicContact CG1-CB 4.09Å; K297-R306 WeakPolarHBondContact O-CA 3.34Å; C298-R306 WeakPolarHBondContact O-CD 3.46Å; C298-R306 WeakPolarHBondContact O-CG 3.31Å; D300-R306 HydrophobicContact CB-CG 4.14Å; D300-R306 PolarHBondContact O-NE 3.5Å; D300-R306 PolarHBondContact O-NH2 2.97Å
307	W	98.6	Very high	98	Very high	65 Å²	65	50.4 Å²	50.4	25%	0.246	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-72.3	146.5	175.1	-77.5	19.2	0	0	0	110.9	V213 K297 K311 L312 H315	V213-W307 WeakPolarHBondContact CG1-O 3.42Å; V213-W307 WeakPolarHBondContact CG2-O 3.46Å; K297-W307 HydrophobicContact CB-CB 4.25Å; K297-W307 HydrophobicContact CB-CD2 4Å; K297-W307 HydrophobicContact CB-CE3 4.39Å; K297-W307 HydrophobicContact CB-CG 3.93Å; K297-W307 HydrophobicContact CD-CD2 4.08Å; K297-W307 HydrophobicContact CD-CG 4.35Å; K297-W307 HydrophobicContact CD-CZ2 3.96Å; K297-W307 VanDerWaalsContact CE-CE2 3.48Å; K297-W307 HydrophobicContact CG-CD2 3.76Å; K297-W307 HydrophobicContact CG-CE3 4.09Å; K297-W307 HydrophobicContact CG-CG 4.15Å; K297-W307 HydrophobicContact CG-CH2 4.45Å; K297-W307 HydrophobicContact CG-CZ2 4.15Å; K297-W307 HydrophobicContact CG-CZ3 4.43Å; K297-W307 PolarHBondContact O-N 3.42Å; W307-K311 HydrophobicContact CB-CB 4.33Å; W307-K311 HydrophobicContact CB-CD 4.21Å; W307-K311 HydrophobicContact CD2-CD 3.52Å; W307-K311 HydrophobicContact CD2-CG 3.87Å; W307-K311 VanDerWaalsContact CE2-NZ 3.31Å; W307-K311 HydrophobicContact CE3-CB 4.29Å; W307-K311 HydrophobicContact CE3-CD 3.78Å; W307-K311 HydrophobicContact CE3-CG 3.57Å; W307-K311 HydrophobicContact CG-CD 3.72Å; W307-K311 HydrophobicContact CG-CG 4.3Å; W307-K311 HydrophobicContact CZ2-CD 4.47Å; W307-K311 HydrophobicContact CZ3-CD 4.35Å; W307-K311 HydrophobicContact CZ3-CG 4.04Å; W307-L312 HydrophobicContact CB-CD1 4.38Å; W307-L312 HydrophobicContact CB-CD2 3.88Å; W307-L312 HydrophobicContact CB-CG 3.76Å; W307-L312 HydrophobicContact CE3-CD2 4.13Å; W307-H315 AromaticContact CZ3-CD2 3.86Å
308	S	98.6	Very high	97.9	Very high	59 Å²	59	48 Å²	48	41%	0.413	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-66.3	156.5	171.9	67.1	0	0	0	0	111	E310 K311 L312	S308-E310 PolarHBondContact O-N 3.39Å; S308-K311 PolarHBondContact O-N 3.3Å; S308-K311 WeakPolarHBondContact OG-CB 3.41Å; S308-K311 PolarHBondContact OG-N 2.8Å; S308-L312 WeakPolarHBondContact O-CG 3.32Å; S308-L312 PolarHBondContact O-N 3.18Å
309	C	98.4	Very high	97.8	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-55.8	-40.8	175	-67.5	0	0	0	0	111.5	L140 V143 A144 K311 L312 T313	L140-C309 HydrophobicContact CD2-CB 4.04Å; V143-C309 VanDerWaalsContact CG1-SG 3.52Å; A144-C309 HydrophobicContact CB-CB 3.75Å; C309-K311 VanDerWaalsContact C-N 3.32Å; C309-K311 PolarHBondContact O-N 3.23Å; C309-L312 PolarHBondContact O-N 3.09Å; C309-T313 WeakPolarHBondContact O-CG2 3.4Å; C309-T313 PolarHBondContact O-N 3.13Å
310	E	97.8	Very high	97.6	Very high	120 Å²	120	56.2 Å²	56.2	56%	0.561	29%	0.285	S	S	*	.	H	α-helix	trans	-59.1	-42.2	175.5	-171.6	-175.2	165.7	0	0	112.1	S308 T313 K314	S308-E310 PolarHBondContact O-N 3.39Å; E310-T313 PolarHBondContact O-OG1 3.47Å; E310-K314 IonicContact OE1-NZ 2.73Å
311	K	98.4	Very high	97.4	Very high	99 Å²	99	54.6 Å²	54.6	43%	0.43	28%	0.276	S	S	.	.	H	α-helix	trans	-69.5	-39.1	177.5	-166.5	179	177.5	-174.9	0	111.7	W307 S308 C309 T313 K314	W307-K311 HydrophobicContact CB-CB 4.33Å; W307-K311 HydrophobicContact CB-CD 4.21Å; W307-K311 HydrophobicContact CD2-CD 3.52Å; W307-K311 HydrophobicContact CD2-CG 3.87Å; W307-K311 VanDerWaalsContact CE2-NZ 3.31Å; W307-K311 HydrophobicContact CE3-CB 4.29Å; W307-K311 HydrophobicContact CE3-CD 3.78Å; W307-K311 HydrophobicContact CE3-CG 3.57Å; W307-K311 HydrophobicContact CG-CD 3.72Å; W307-K311 HydrophobicContact CG-CG 4.3Å; W307-K311 HydrophobicContact CZ2-CD 4.47Å; W307-K311 HydrophobicContact CZ3-CD 4.35Å; W307-K311 HydrophobicContact CZ3-CG 4.04Å; S308-K311 PolarHBondContact O-N 3.3Å; S308-K311 WeakPolarHBondContact OG-CB 3.41Å; S308-K311 PolarHBondContact OG-N 2.8Å; C309-K311 VanDerWaalsContact C-N 3.32Å; C309-K311 PolarHBondContact O-N 3.23Å; K311-T313 VanDerWaalsContact C-N 3.33Å; K311-T313 PolarHBondContact O-N 2.72Å; K311-K314 PolarHBondContact O-N 2.87Å; K311-K314 VanDerWaalsContact O-N 3.11Å
312	L	98.6	Very high	97.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.5	-31.1	178.3	-73.8	168.5	0	0	0	113.3	L140 V213 F294 K297 W307 S308 C309 K314 H315	L140-L312 HydrophobicContact CD1-CB 4.02Å; L140-L312 HydrophobicContact CD2-CB 3.69Å; L140-L312 HydrophobicContact CD2-CD1 3.96Å; L140-L312 HydrophobicContact CD2-CG 4.5Å; V213-L312 HydrophobicContact CG1-CD1 3.72Å; F294-L312 HydrophobicContact CD2-CD2 3.95Å; F294-L312 HydrophobicContact CE2-CB 4.1Å; F294-L312 HydrophobicContact CE2-CD2 3.65Å; F294-L312 HydrophobicContact CE2-CG 4.36Å; F294-L312 HydrophobicContact CZ-CD2 4.37Å; K297-L312 HydrophobicContact CB-CD2 3.87Å; W307-L312 HydrophobicContact CB-CD1 4.38Å; W307-L312 HydrophobicContact CB-CD2 3.88Å; W307-L312 HydrophobicContact CB-CG 3.76Å; W307-L312 HydrophobicContact CE3-CD2 4.13Å; S308-L312 WeakPolarHBondContact O-CG 3.32Å; S308-L312 PolarHBondContact O-N 3.18Å; C309-L312 PolarHBondContact O-N 3.09Å; L312-K314 PolarHBondContact O-N 2.7Å; L312-K314 VanDerWaalsContact O-N 3.15Å; L312-H315 WeakPolarHBondContact O-CB 3.47Å; L312-H315 PolarHBondContact O-N 3.38Å; L312-H315 VanDerWaalsContact O-N 3.08Å
313	T	97.5	Very high	97.2	Very high	17 Å²	17	53.9 Å²	53.9	10%	0.104	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-19.7	172.7	61.4	0	0	0	0	113.4	Y137 L140 L141 C309 E310 K311	Y137-T313 WeakPolarHBondContact CE2-O 3.41Å; L140-T313 HydrophobicContact CB-CG2 3.71Å; L141-T313 HydrophobicContact CD2-CG2 4Å; C309-T313 WeakPolarHBondContact O-CG2 3.4Å; C309-T313 PolarHBondContact O-N 3.13Å; E310-T313 PolarHBondContact O-OG1 3.47Å; K311-T313 VanDerWaalsContact C-N 3.33Å; K311-T313 PolarHBondContact O-N 2.72Å
314	K	97.8	Very high	97	Very high	143 Å²	143	57.7 Å²	57.7	62%	0.622	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	10.4	179.2	-57.3	172	-172.6	167.4	0	112.3	E310 K311 L312	E310-K314 IonicContact OE1-NZ 2.73Å; K311-K314 PolarHBondContact O-N 2.87Å; K311-K314 VanDerWaalsContact O-N 3.11Å; L312-K314 PolarHBondContact O-N 2.7Å; L312-K314 VanDerWaalsContact O-N 3.15Å
315	H	98.5	Very high	96.7	Very high	7 Å²	7	54.6 Å²	54.6	3%	0.032	27%	0.274	C	S	.	.	S	Bend	trans	-73.3	136.9	179.5	-173.4	-85.5	0	0	0	110.4	L290 D293 F294 W307 L312 Y317 F318	L290-H315 PolarHBondContact O-CE1 3.39Å; D293-H315 IonicContact OD2-NE2 2.88Å; D293-H315 PolarHBondContact OD2-NE2 2.92Å; D293-H315 VanDerWaalsContact OD2-NE2 3.14Å; F294-H315 HydrophobicContact CD2-CB 4.08Å; F294-H315 AromaticContact CD2-CG 3.81Å; F294-H315 AromaticContact CD2-ND1 3.84Å; W307-H315 AromaticContact CZ3-CD2 3.86Å; L312-H315 WeakPolarHBondContact O-CB 3.47Å; L312-H315 PolarHBondContact O-N 3.38Å; L312-H315 VanDerWaalsContact O-N 3.08Å; H315-Y317 WeakPolarHBondContact ND1-CB 3.43Å; H315-Y317 PolarHBondContact ND1-N 3.31Å; H315-Y317 VanDerWaalsContact ND1-N 3.14Å; H315-Y317 PolarHBondContact O-N 2.86Å; H315-F318 HydrophobicContact CB-CD2 4.45Å; H315-F318 PolarHBondContact O-N 3.5Å
316	S	97.9	Very high	96.4	Very high	59 Å²	59	56.6 Å²	56.6	41%	0.413	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-60.2	-17.1	-173.7	-65.5	0	0	0	0	115.5	F318 D319	S316-F318 PolarHBondContact O-N 3.01Å; S316-F318 VanDerWaalsContact O-N 3.14Å; S316-D319 VanDerWaalsContact CA-OD2 3.25Å; S316-D319 WeakPolarHBondContact CA-OD2 3.5Å; S316-D319 VanDerWaalsContact CB-OD2 3.29Å; S316-D319 WeakPolarHBondContact CB-OD2 3.3Å; S316-D319 PolarHBondContact O-N 3.15Å; S316-D319 PolarHBondContact OG-OD2 3.32Å
317	Y	97.4	Very high	96.1	Very high	6 Å²	6	62.1 Å²	62.1	2%	0.024	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-53.6	-28.1	169.4	179.9	-100.2	0	0	0	113.3	K133 F220 L290 T291 H315	K133-Y317 HydrophobicContact CD-CE1 4.29Å; K133-Y317 WeakPolarHBondContact CE-O 3.38Å; K133-Y317 HydrophobicContact CG-CD1 4.33Å; K133-Y317 HydrophobicContact CG-CE1 3.52Å; K133-Y317 PolarHBondContact NZ-O 3.08Å; F220-Y317 HydrophobicContact CD2-CE1 4.47Å; F220-Y317 HydrophobicContact CE2-CD1 4.17Å; F220-Y317 AromaticContact CE2-CE1 3.36Å; F220-Y317 HydrophobicContact CE2-CE1 3.36Å; F220-Y317 HydrophobicContact CE2-CE2 4.33Å; F220-Y317 AromaticContact CE2-CZ 3.47Å; F220-Y317 VanDerWaalsContact CE2-CZ 3.47Å; F220-Y317 WeakPolarHBondContact CE2-OH 3.44Å; F220-Y317 HydrophobicContact CZ-CD1 4.33Å; F220-Y317 HydrophobicContact CZ-CD2 4.48Å; F220-Y317 AromaticContact CZ-CE1 3.73Å; F220-Y317 HydrophobicContact CZ-CE1 3.73Å; F220-Y317 AromaticContact CZ-CE2 3.9Å; F220-Y317 HydrophobicContact CZ-CE2 3.9Å; F220-Y317 AromaticContact CZ-CZ 3.5Å; F220-Y317 VanDerWaalsContact CZ-CZ 3.5Å; L290-Y317 HydrophobicContact CB-CD2 4.18Å; T291-Y317 WeakPolarHBondContact OG1-CE2 3.44Å; H315-Y317 WeakPolarHBondContact ND1-CB 3.43Å; H315-Y317 PolarHBondContact ND1-N 3.31Å; H315-Y317 VanDerWaalsContact ND1-N 3.14Å; H315-Y317 PolarHBondContact O-N 2.86Å
318	F	97.9	Very high	95.6	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-100.3	-0.1	-178.6	-60.4	-69.4	0	0	0	114.5	K133 C136 Y137 L140 F294 H315 S316 D320 Y321 I322	K133-F318 HydrophobicContact CB-CD1 4.3Å; K133-F318 HydrophobicContact CB-CE1 4.46Å; K133-F318 HydrophobicContact CG-CD1 4.27Å; K133-F318 HydrophobicContact CG-CE1 4.48Å; C136-F318 HydrophobicContact CB-CE1 4.22Å; C136-F318 HydrophobicContact CB-CZ 4.17Å; Y137-F318 HydrophobicContact CD2-CB 4.04Å; Y137-F318 AromaticContact CD2-CD1 3.94Å; Y137-F318 HydrophobicContact CD2-CD1 3.94Å; Y137-F318 HydrophobicContact CD2-CD2 4.08Å; Y137-F318 HydrophobicContact CD2-CE1 4.41Å; Y137-F318 AromaticContact CD2-CG 3.76Å; Y137-F318 HydrophobicContact CD2-CG 3.76Å; Y137-F318 HydrophobicContact CE2-CB 4.41Å; Y137-F318 HydrophobicContact CG-CD1 4.34Å; L140-F318 HydrophobicContact CD1-CE2 3.65Å; L140-F318 HydrophobicContact CD1-CZ 3.83Å; F294-F318 HydrophobicContact CD2-CE2 4.11Å; F294-F318 AromaticContact CE2-CE2 3.52Å; F294-F318 HydrophobicContact CE2-CE2 3.52Å; F294-F318 AromaticContact CE2-CZ 3.98Å; F294-F318 HydrophobicContact CE2-CZ 3.98Å; F294-F318 HydrophobicContact CZ-CE2 4.07Å; F294-F318 HydrophobicContact CZ-CZ 4.07Å; H315-F318 HydrophobicContact CB-CD2 4.45Å; H315-F318 PolarHBondContact O-N 3.5Å; S316-F318 PolarHBondContact O-N 3.01Å; S316-F318 VanDerWaalsContact O-N 3.14Å; F318-D320 PolarHBondContact O-N 3.48Å; F318-Y321 PolarHBondContact O-N 3.47Å; F318-Y321 VanDerWaalsContact O-N 3.15Å; F318-I322 HydrophobicContact CB-CD1 3.89Å; F318-I322 HydrophobicContact CB-CG1 4.24Å; F318-I322 VanDerWaalsContact O-CG1 3.27Å; F318-I322 WeakPolarHBondContact O-CG1 3.49Å; F318-I322 PolarHBondContact O-N 3.48Å
319	D	96.1	Very high	95.1	Very high	85 Å²	85	65.8 Å²	65.8	46%	0.455	32%	0.32	S	S	.	.	H	α-helix	trans	-58.9	-45	-170.6	-73.7	-16.8	0	0	0	112.4	S316 I322 A323	S316-D319 VanDerWaalsContact CA-OD2 3.25Å; S316-D319 WeakPolarHBondContact CA-OD2 3.5Å; S316-D319 VanDerWaalsContact CB-OD2 3.29Å; S316-D319 WeakPolarHBondContact CB-OD2 3.3Å; S316-D319 PolarHBondContact O-N 3.15Å; S316-D319 PolarHBondContact OG-OD2 3.32Å; D319-I322 PolarHBondContact O-N 2.91Å; D319-A323 WeakPolarHBondContact O-CB 3.33Å; D319-A323 PolarHBondContact O-N 3.28Å
320	D	94.1	Very high	94.7	Very high	90 Å²	90	71.1 Å²	71.1	48%	0.481	34%	0.344	S	S	.	.	H	α-helix	trans	-66.4	-40.8	177.3	65.9	-46.7	0	0	0	112.3	K133 F318 A323 K324	K133-D320 IonicContact NZ-OD1 2.86Å; K133-D320 PolarHBondContact NZ-OD1 3.04Å; K133-D320 IonicContact NZ-OD2 3.03Å; K133-D320 PolarHBondContact NZ-OD2 2.81Å; F318-D320 PolarHBondContact O-N 3.48Å; D320-A323 PolarHBondContact O-N 3Å; D320-K324 WeakPolarHBondContact O-CB 3.13Å; D320-K324 PolarHBondContact O-N 2.86Å
321	Y	94.6	Very high	94.3	Very high	13 Å²	13	68.3 Å²	68.3	5%	0.051	34%	0.335	C	S	.	.	H	α-helix	trans	-63.3	-47.1	176.3	173.4	-96.6	0	0	0	110.9	K133 Q134 Y137 F318 A323 K324 Q325	K133-Y321 HydrophobicContact CB-CD2 3.95Å; K133-Y321 HydrophobicContact CB-CG 3.98Å; Q134-Y321 HydrophobicContact CB-CE2 3.82Å; Q134-Y321 HydrophobicContact CG-CE2 4.44Å; Y137-Y321 HydrophobicContact CD1-CD1 4.24Å; Y137-Y321 AromaticContact CD1-CE1 3.63Å; Y137-Y321 HydrophobicContact CD1-CE1 3.63Å; Y137-Y321 HydrophobicContact CE1-CE1 4.3Å; Y137-Y321 HydrophobicContact CG-CD1 4.16Å; Y137-Y321 AromaticContact CG-CE1 3.91Å; Y137-Y321 HydrophobicContact CG-CE1 3.91Å; F318-Y321 PolarHBondContact O-N 3.47Å; F318-Y321 VanDerWaalsContact O-N 3.15Å; Y321-A323 PolarHBondContact O-N 3.48Å; Y321-K324 PolarHBondContact O-N 3.28Å; Y321-Q325 HydrophobicContact CD1-CG 4.23Å; Y321-Q325 HydrophobicContact CD2-CG 4.44Å; Y321-Q325 HydrophobicContact CE1-CG 3.75Å; Y321-Q325 HydrophobicContact CE2-CG 4Å; Y321-Q325 WeakPolarHBondContact O-CG 3.34Å; Y321-Q325 PolarHBondContact O-N 3.44Å
322	I	94.8	Very high	93.8	Very high	24 Å²	24	68 Å²	68	12%	0.123	34%	0.339	C	S	.	.	H	α-helix	trans	-63.7	-43.2	179.2	-66.4	165	0	0	0	110.6	Y137 F318 D319 K324 Q325 R326	Y137-I322 HydrophobicContact CE2-CD1 3.65Å; Y137-I322 HydrophobicContact CE2-CG1 3.82Å; F318-I322 HydrophobicContact CB-CD1 3.89Å; F318-I322 HydrophobicContact CB-CG1 4.24Å; F318-I322 VanDerWaalsContact O-CG1 3.27Å; F318-I322 WeakPolarHBondContact O-CG1 3.49Å; F318-I322 PolarHBondContact O-N 3.48Å; D319-I322 PolarHBondContact O-N 2.91Å; I322-K324 VanDerWaalsContact C-N 3.34Å; I322-K324 PolarHBondContact O-N 3.48Å; I322-Q325 PolarHBondContact O-N 2.95Å; I322-R326 WeakPolarHBondContact O-CG 3.23Å; I322-R326 PolarHBondContact O-N 3.42Å
323	A	94.3	Very high	93.3	Very high	57 Å²	57	71.1 Å²	71.1	47%	0.471	36%	0.36	S	S	.	.	H	α-helix	trans	-58.5	-47.2	176.4	0	0	0	0	0	111.3	D319 D320 Y321 Q325 R326 E327	D319-A323 WeakPolarHBondContact O-CB 3.33Å; D319-A323 PolarHBondContact O-N 3.28Å; D320-A323 PolarHBondContact O-N 3Å; Y321-A323 PolarHBondContact O-N 3.48Å; A323-Q325 PolarHBondContact O-N 3.2Å; A323-R326 PolarHBondContact O-N 3.08Å; A323-E327 PolarHBondContact O-N 3.01Å
324	K	92.9	Very high	93	Very high	107 Å²	107	74.3 Å²	74.3	47%	0.465	38%	0.376	S	S	.	.	H	α-helix	trans	-63.7	-40.1	177.6	-170.9	175.6	-176.1	-179.2	0	112.8	D320 Y321 I322 E327 L328	D320-K324 WeakPolarHBondContact O-CB 3.13Å; D320-K324 PolarHBondContact O-N 2.86Å; Y321-K324 PolarHBondContact O-N 3.28Å; I322-K324 VanDerWaalsContact C-N 3.34Å; I322-K324 PolarHBondContact O-N 3.48Å; K324-E327 PolarHBondContact O-N 3.35Å; K324-L328 HydrophobicContact CG-CD1 4.38Å; K324-L328 WeakPolarHBondContact O-CG 3.49Å; K324-L328 PolarHBondContact O-N 3.06Å
325	Q	91.1	Very high	92.6	Very high	52 Å²	52	72.9 Å²	72.9	24%	0.243	37%	0.372	C	S	.	.	H	α-helix	trans	-63.7	-41.4	176.1	-69.9	-55.6	-48.1	0	0	111.8	Y321 I322 A323 E327 L328 E329	Y321-Q325 HydrophobicContact CD1-CG 4.23Å; Y321-Q325 HydrophobicContact CD2-CG 4.44Å; Y321-Q325 HydrophobicContact CE1-CG 3.75Å; Y321-Q325 HydrophobicContact CE2-CG 4Å; Y321-Q325 WeakPolarHBondContact O-CG 3.34Å; Y321-Q325 PolarHBondContact O-N 3.44Å; I322-Q325 PolarHBondContact O-N 2.95Å; A323-Q325 PolarHBondContact O-N 3.2Å; Q325-E327 VanDerWaalsContact C-N 3.32Å; Q325-E327 PolarHBondContact O-N 2.94Å; Q325-L328 PolarHBondContact O-N 2.66Å; Q325-E329 WeakPolarHBondContact O-CB 3.4Å; Q325-E329 VanDerWaalsContact O-CG 3.31Å; Q325-E329 WeakPolarHBondContact O-CG 3.21Å; Q325-E329 PolarHBondContact O-N 2.95Å
326	R	91.3	Very high	92.2	Very high	170 Å²	170	75.5 Å²	75.5	64%	0.642	40%	0.395	S	S	*	.	H	α-helix	trans	-63.2	-38.9	175.9	-71.9	176.2	-175.2	166.6	4.6	112.5	I322 A323 E329 H330	I322-R326 WeakPolarHBondContact O-CG 3.23Å; I322-R326 PolarHBondContact O-N 3.42Å; A323-R326 PolarHBondContact O-N 3.08Å; R326-E329 PolarHBondContact O-N 3.47Å; R326-H330 WeakPolarHBondContact O-CB 3.5Å; R326-H330 PolarHBondContact O-N 3.15Å
327	E	91.2	Very high	91.8	Very high	131 Å²	131	75 Å²	75	61%	0.612	39%	0.394	S	S	*	.	H	α-helix	trans	-62.7	-47.3	175	-174.1	179.2	-168.4	0	0	111.1	A323 K324 Q325 E329 H330 V331	A323-E327 PolarHBondContact O-N 3.01Å; K324-E327 PolarHBondContact O-N 3.35Å; Q325-E327 VanDerWaalsContact C-N 3.32Å; Q325-E327 PolarHBondContact O-N 2.94Å; E327-E329 PolarHBondContact O-N 2.85Å; E327-H330 WeakPolarHBondContact O-CB 3.47Å; E327-H330 PolarHBondContact O-N 3.27Å; E327-V331 WeakPolarHBondContact O-CG2 3.4Å; E327-V331 PolarHBondContact O-N 3.01Å
328	L	88.4	Confident	91.5	Very high	76 Å²	76	78.9 Å²	78.9	40%	0.398	42%	0.415	S	S	.	.	H	α-helix	trans	-61.3	-43.3	176.2	-70.5	169.6	0	0	0	112.2	K324 Q325 H330 V331 N332	K324-L328 HydrophobicContact CG-CD1 4.38Å; K324-L328 WeakPolarHBondContact O-CG 3.49Å; K324-L328 PolarHBondContact O-N 3.06Å; Q325-L328 PolarHBondContact O-N 2.66Å; L328-H330 VanDerWaalsContact C-N 3.31Å; L328-H330 PolarHBondContact O-N 3.36Å; L328-V331 PolarHBondContact O-N 3.41Å; L328-N332 WeakPolarHBondContact O-CB 3.4Å; L328-N332 PolarHBondContact O-N 2.93Å; L328-N332 PolarHBondContact O-ND2 2.88Å
329	E	88.6	Confident	91.2	Very high	125 Å²	125	83.7 Å²	83.7	58%	0.584	44%	0.44	S	S	*	.	H	α-helix	trans	-60.6	-41.5	175	-75.3	173	177.8	0	0	111.7	Q325 R326 E327 S333	Q325-E329 WeakPolarHBondContact O-CB 3.4Å; Q325-E329 VanDerWaalsContact O-CG 3.31Å; Q325-E329 WeakPolarHBondContact O-CG 3.21Å; Q325-E329 PolarHBondContact O-N 2.95Å; R326-E329 PolarHBondContact O-N 3.47Å; E327-E329 PolarHBondContact O-N 2.85Å; E329-S333 WeakPolarHBondContact O-CB 3.35Å; E329-S333 PolarHBondContact O-N 3.37Å; E329-S333 PolarHBondContact O-OG 3.24Å
330	H	89.1	Confident	90.9	Very high	112 Å²	112	88 Å²	88	52%	0.519	45%	0.45	S	S	.	.	H	α-helix	trans	-63.4	-49.4	176.8	-175.5	57	0	0	0	111.6	R326 E327 L328 N332 S333 L334	R326-H330 WeakPolarHBondContact O-CB 3.5Å; R326-H330 PolarHBondContact O-N 3.15Å; E327-H330 WeakPolarHBondContact O-CB 3.47Å; E327-H330 PolarHBondContact O-N 3.27Å; L328-H330 VanDerWaalsContact C-N 3.31Å; L328-H330 PolarHBondContact O-N 3.36Å; H330-N332 PolarHBondContact O-N 3.07Å; H330-S333 PolarHBondContact O-N 2.76Å; H330-S333 VanDerWaalsContact O-N 3.16Å; H330-S333 PolarHBondContact O-OG 2.76Å; H330-L334 WeakPolarHBondContact O-CG 3.5Å; H330-L334 PolarHBondContact O-N 2.84Å
331	V	89.7	Confident	90.7	Very high	62 Å²	62	90 Å²	90	38%	0.376	46%	0.457	S	S	.	.	H	α-helix	trans	-58.3	-49.4	177	173.4	0	0	0	0	110.9	E327 L328 S333 L334 E335	E327-V331 WeakPolarHBondContact O-CG2 3.4Å; E327-V331 PolarHBondContact O-N 3.01Å; L328-V331 PolarHBondContact O-N 3.41Å; V331-S333 VanDerWaalsContact C-N 3.26Å; V331-S333 PolarHBondContact O-N 3.18Å; V331-L334 PolarHBondContact O-N 3.18Å; V331-L334 VanDerWaalsContact O-N 3.12Å; V331-E335 HydrophobicContact CG1-CG 4.5Å; V331-E335 PolarHBondContact O-N 3.34Å
332	N	87.9	Confident	90.5	Very high	93 Å²	93	95.4 Å²	95.4	50%	0.497	48%	0.482	S	S	.	.	H	α-helix	trans	-59.2	-37.5	177.8	-70.5	-22.1	0	0	0	112.1	L328 H330 A336	L328-N332 WeakPolarHBondContact O-CB 3.4Å; L328-N332 PolarHBondContact O-N 2.93Å; L328-N332 PolarHBondContact O-ND2 2.88Å; H330-N332 PolarHBondContact O-N 3.07Å; N332-A336 VanDerWaalsContact O-CB 3.32Å; N332-A336 WeakPolarHBondContact O-CB 3.19Å; N332-A336 PolarHBondContact O-N 3.48Å
333	S	89.3	Confident	90.3	Very high	64 Å²	64	100.2 Å²	100.2	45%	0.448	50%	0.504	S	S	.	.	H	α-helix	trans	-67.3	-38.1	177.7	77	0	0	0	0	112.6	E329 H330 V331 A337	E329-S333 WeakPolarHBondContact O-CB 3.35Å; E329-S333 PolarHBondContact O-N 3.37Å; E329-S333 PolarHBondContact O-OG 3.24Å; H330-S333 PolarHBondContact O-N 2.76Å; H330-S333 VanDerWaalsContact O-N 3.16Å; H330-S333 PolarHBondContact O-OG 2.76Å; V331-S333 VanDerWaalsContact C-N 3.26Å; V331-S333 PolarHBondContact O-N 3.18Å; S333-A337 WeakPolarHBondContact O-CB 3.27Å; S333-A337 PolarHBondContact O-N 3.12Å
334	L	90.8	Very high	90.2	Very high	84 Å²	84	101.4 Å²	101.4	44%	0.44	50%	0.502	S	S	.	.	H	α-helix	trans	-68.4	-44.6	175.9	-68.5	174.2	0	0	0	111.1	H330 V331 A336 A337 N338	H330-L334 WeakPolarHBondContact O-CG 3.5Å; H330-L334 PolarHBondContact O-N 2.84Å; V331-L334 PolarHBondContact O-N 3.18Å; V331-L334 VanDerWaalsContact O-N 3.12Å; L334-A336 PolarHBondContact O-N 3.44Å; L334-A337 PolarHBondContact O-N 3.45Å; L334-N338 WeakPolarHBondContact O-CB 3.23Å; L334-N338 VanDerWaalsContact O-CG 3.28Å; L334-N338 PolarHBondContact O-N 3.36Å; L334-N338 PolarHBondContact O-ND2 2.68Å
335	E	89.7	Confident	90.1	Very high	114 Å²	114	98.9 Å²	98.9	53%	0.533	50%	0.501	S	S	.	.	H	α-helix	trans	-60.3	-45.2	175.7	-72.2	-177.4	173.3	0	0	111.6	V331 A337 N338 L339	V331-E335 HydrophobicContact CG1-CG 4.5Å; V331-E335 PolarHBondContact O-N 3.34Å; E335-A337 VanDerWaalsContact C-N 3.33Å; E335-A337 PolarHBondContact O-N 3.24Å; E335-N338 PolarHBondContact O-N 2.96Å; E335-L339 WeakPolarHBondContact O-CB 3.23Å; E335-L339 PolarHBondContact O-N 3.37Å
336	A	88.6	Confident	90.1	Very high	62 Å²	62	99.9 Å²	99.9	51%	0.512	51%	0.514	S	S	.	.	H	α-helix	trans	-62.4	-39.2	176.6	0	0	0	0	0	112.4	N332 L334 R340	N332-A336 VanDerWaalsContact O-CB 3.32Å; N332-A336 WeakPolarHBondContact O-CB 3.19Å; N332-A336 PolarHBondContact O-N 3.48Å; L334-A336 PolarHBondContact O-N 3.44Å; A336-R340 WeakPolarHBondContact O-CB 3.35Å; A336-R340 PolarHBondContact O-N 3.32Å
337	A	89.9	Confident	90.1	Very high	49 Å²	49	97.8 Å²	97.8	41%	0.405	51%	0.512	S	S	.	.	H	α-helix	trans	-65.2	-43.5	175.5	0	0	0	0	0	111.8	S333 L334 E335 R340 Q341	S333-A337 WeakPolarHBondContact O-CB 3.27Å; S333-A337 PolarHBondContact O-N 3.12Å; L334-A337 PolarHBondContact O-N 3.45Å; E335-A337 VanDerWaalsContact C-N 3.33Å; E335-A337 PolarHBondContact O-N 3.24Å; A337-R340 PolarHBondContact O-N 3.1Å; A337-Q341 PolarHBondContact O-N 3.4Å
338	N	91.3	Very high	90	Very high	87 Å²	87	98 Å²	98	47%	0.465	51%	0.513	S	S	.	.	H	α-helix	trans	-62.4	-45.1	176.3	-73	-19.3	0	0	0	111.5	L334 E335 R340 Q341 Q342	L334-N338 WeakPolarHBondContact O-CB 3.23Å; L334-N338 VanDerWaalsContact O-CG 3.28Å; L334-N338 PolarHBondContact O-N 3.36Å; L334-N338 PolarHBondContact O-ND2 2.68Å; E335-N338 PolarHBondContact O-N 2.96Å; N338-R340 VanDerWaalsContact C-N 3.3Å; N338-R340 PolarHBondContact O-N 3.36Å; N338-Q341 PolarHBondContact O-N 2.68Å; N338-Q342 WeakPolarHBondContact O-CG 3.36Å; N338-Q342 PolarHBondContact O-N 3.2Å
339	L	90.8	Very high	90.1	Very high	100 Å²	100	101.5 Å²	101.5	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-60.3	-42	176.9	-134.7	80.9	0	0	0	111.2	E335 Q342 Q343	E335-L339 WeakPolarHBondContact O-CB 3.23Å; E335-L339 PolarHBondContact O-N 3.37Å; L339-Q342 PolarHBondContact O-N 2.9Å; L339-Q343 WeakPolarHBondContact O-CG 3.4Å; L339-Q343 PolarHBondContact O-N 2.79Å
340	R	91.4	Very high	90.2	Very high	177 Å²	177	102 Å²	102	67%	0.668	53%	0.529	S	S	*	.	H	α-helix	trans	-64.8	-41.2	176.8	-171.2	176.5	-176.4	175.7	1	111.8	A336 A337 N338 Q343 L344	A336-R340 WeakPolarHBondContact O-CB 3.35Å; A336-R340 PolarHBondContact O-N 3.32Å; A337-R340 PolarHBondContact O-N 3.1Å; N338-R340 VanDerWaalsContact C-N 3.3Å; N338-R340 PolarHBondContact O-N 3.36Å; R340-Q343 PolarHBondContact O-N 2.8Å; R340-L344 HydrophobicContact CG-CD1 4.3Å; R340-L344 VanDerWaalsContact O-CG 3.29Å; R340-L344 WeakPolarHBondContact O-CG 3.35Å; R340-L344 PolarHBondContact O-N 3.04Å
341	Q	90.2	Very high	90.2	Very high	132 Å²	132	102.2 Å²	102.2	62%	0.617	53%	0.533	S	S	*	.	H	α-helix	trans	-63.6	-43	174.9	-77	-173.9	-3.4	0	0	111.9	A337 N338 Q343 L344 A345	A337-Q341 PolarHBondContact O-N 3.4Å; N338-Q341 PolarHBondContact O-N 2.68Å; Q341-Q343 VanDerWaalsContact C-N 3.35Å; Q341-Q343 PolarHBondContact O-N 3.14Å; Q341-L344 PolarHBondContact O-N 3.27Å; Q341-A345 WeakPolarHBondContact O-CB 3.41Å; Q341-A345 PolarHBondContact O-N 3Å
342	Q	89.7	Confident	90.1	Very high	125 Å²	125	102 Å²	102	58%	0.584	54%	0.538	S	S	*	.	H	α-helix	trans	-62.2	-41.4	175.8	-72.5	175.8	0.7	0	0	112.1	N338 L339 A345 S346	N338-Q342 WeakPolarHBondContact O-CG 3.36Å; N338-Q342 PolarHBondContact O-N 3.2Å; L339-Q342 PolarHBondContact O-N 2.9Å; Q342-A345 PolarHBondContact O-N 2.83Å; Q342-S346 WeakPolarHBondContact O-CB 3.19Å; Q342-S346 PolarHBondContact O-N 2.98Å; Q342-S346 PolarHBondContact O-OG 2.84Å
343	Q	91.3	Very high	90	Very high	125 Å²	125	99.9 Å²	99.9	58%	0.584	53%	0.528	S	S	*	.	H	α-helix	trans	-63	-43.7	175.1	-75.6	175.8	0.2	0	0	112	L339 R340 Q341 S346 Q347	L339-Q343 WeakPolarHBondContact O-CG 3.4Å; L339-Q343 PolarHBondContact O-N 2.79Å; R340-Q343 PolarHBondContact O-N 2.8Å; Q341-Q343 VanDerWaalsContact C-N 3.35Å; Q341-Q343 PolarHBondContact O-N 3.14Å; Q343-S346 PolarHBondContact O-N 3.45Å; Q343-Q347 WeakPolarHBondContact O-CB 3.19Å; Q343-Q347 PolarHBondContact O-N 3.12Å
344	L	92.1	Very high	89.7	Confident	83 Å²	83	99 Å²	99	44%	0.435	53%	0.525	S	S	.	.	H	α-helix	trans	-64.9	-44.2	177.5	-72.4	169.6	0	0	0	112	R340 Q341 S346 Q347 Q348	R340-L344 HydrophobicContact CG-CD1 4.3Å; R340-L344 VanDerWaalsContact O-CG 3.29Å; R340-L344 WeakPolarHBondContact O-CG 3.35Å; R340-L344 PolarHBondContact O-N 3.04Å; Q341-L344 PolarHBondContact O-N 3.27Å; L344-S346 VanDerWaalsContact C-N 3.34Å; L344-S346 PolarHBondContact O-N 3.38Å; L344-Q347 PolarHBondContact O-N 2.93Å; L344-Q348 WeakPolarHBondContact O-CG 3.27Å; L344-Q348 PolarHBondContact O-N 3.39Å
345	A	90.8	Very high	89.4	Confident	54 Å²	54	97.1 Å²	97.1	45%	0.446	52%	0.522	S	S	.	.	H	α-helix	trans	-61.9	-43	176.4	0	0	0	0	0	111.5	Q341 Q342 Q347 Q348 F349	Q341-A345 WeakPolarHBondContact O-CB 3.41Å; Q341-A345 PolarHBondContact O-N 3Å; Q342-A345 PolarHBondContact O-N 2.83Å; A345-Q347 VanDerWaalsContact C-N 3.33Å; A345-Q347 PolarHBondContact O-N 3.48Å; A345-Q348 PolarHBondContact O-N 3.36Å; A345-F349 WeakPolarHBondContact O-CB 3.44Å; A345-F349 PolarHBondContact O-N 3.33Å
346	S	90.7	Very high	88.8	Confident	73 Å²	73	97.9 Å²	97.9	51%	0.51	53%	0.525	S	S	.	.	H	α-helix	trans	-62.2	-41.3	176.1	-57.6	0	0	0	0	111.7	Q342 Q343 L344 F349 M350	Q342-S346 WeakPolarHBondContact O-CB 3.19Å; Q342-S346 PolarHBondContact O-N 2.98Å; Q342-S346 PolarHBondContact O-OG 2.84Å; Q343-S346 PolarHBondContact O-N 3.45Å; L344-S346 VanDerWaalsContact C-N 3.34Å; L344-S346 PolarHBondContact O-N 3.38Å; S346-F349 PolarHBondContact O-N 3.01Å; S346-M350 VanDerWaalsContact O-CG 3.24Å; S346-M350 WeakPolarHBondContact O-CG 3.27Å; S346-M350 PolarHBondContact O-N 3.21Å
347	Q	89.7	Confident	88.2	Confident	126 Å²	126	101.3 Å²	101.3	59%	0.589	53%	0.53	S	S	*	.	H	α-helix	trans	-68.4	-39.8	178.2	-164.4	173.1	69.3	0	0	112	Q343 L344 A345 M350 L351	Q343-Q347 WeakPolarHBondContact O-CB 3.19Å; Q343-Q347 PolarHBondContact O-N 3.12Å; L344-Q347 PolarHBondContact O-N 2.93Å; A345-Q347 VanDerWaalsContact C-N 3.33Å; A345-Q347 PolarHBondContact O-N 3.48Å; Q347-M350 PolarHBondContact O-N 3.22Å; Q347-L351 WeakPolarHBondContact O-CG 3.35Å; Q347-L351 PolarHBondContact O-N 3.08Å
348	Q	90.3	Very high	87.4	Confident	136 Å²	136	105.5 Å²	105.5	64%	0.636	55%	0.545	S	S	*	.	H	α-helix	trans	-63.6	-42.4	173.6	-75.4	177.8	-1.3	0	0	111.9	L344 A345 L351 A352	L344-Q348 WeakPolarHBondContact O-CG 3.27Å; L344-Q348 PolarHBondContact O-N 3.39Å; A345-Q348 PolarHBondContact O-N 3.36Å; Q348-L351 PolarHBondContact O-N 3.15Å; Q348-A352 WeakPolarHBondContact O-CB 3.26Å; Q348-A352 PolarHBondContact O-N 2.7Å
349	F	90.5	Very high	86.4	Confident	149 Å²	149	108.5 Å²	108.5	65%	0.654	56%	0.557	S	S	*	*	H	α-helix	trans	-62.1	-43.5	176.2	-178.3	-97.5	0	0	0	112.2	A345 S346 A352 T353	A345-F349 WeakPolarHBondContact O-CB 3.44Å; A345-F349 PolarHBondContact O-N 3.33Å; S346-F349 PolarHBondContact O-N 3.01Å; F349-A352 PolarHBondContact O-N 3.44Å; F349-T353 WeakPolarHBondContact O-CB 3.35Å; F349-T353 PolarHBondContact O-N 3.16Å; F349-T353 PolarHBondContact O-OG1 3.14Å
350	M	90.4	Very high	85.1	Confident	135 Å²	135	106.6 Å²	106.6	67%	0.665	55%	0.549	S	S	*	.	H	α-helix	trans	-60	-45.2	174.6	-73.7	-78.4	-71.5	0	0	111.8	S346 Q347 T353 A354	S346-M350 VanDerWaalsContact O-CG 3.24Å; S346-M350 WeakPolarHBondContact O-CG 3.27Å; S346-M350 PolarHBondContact O-N 3.21Å; Q347-M350 PolarHBondContact O-N 3.22Å; M350-T353 PolarHBondContact O-N 3.2Å; M350-A354 WeakPolarHBondContact O-CB 3.39Å; M350-A354 PolarHBondContact O-N 2.99Å
351	L	89.8	Confident	83.7	Confident	117 Å²	117	99.7 Å²	99.7	61%	0.613	53%	0.533	S	S	*	.	H	α-helix	trans	-65.1	-42.4	178.1	-73.2	169.2	0	0	0	112.3	Q347 Q348 A354 A355	Q347-L351 WeakPolarHBondContact O-CG 3.35Å; Q347-L351 PolarHBondContact O-N 3.08Å; Q348-L351 PolarHBondContact O-N 3.15Å; L351-A354 PolarHBondContact O-N 3.38Å; L351-A355 WeakPolarHBondContact O-CB 3.47Å; L351-A355 PolarHBondContact O-N 3Å
352	A	87.1	Confident	82.3	Confident	57 Å²	57	97.6 Å²	97.6	47%	0.471	53%	0.531	S	S	.	.	H	α-helix	trans	-63.1	-42.7	176.8	0	0	0	0	0	111.6	Q348 F349 A355 Q356	Q348-A352 WeakPolarHBondContact O-CB 3.26Å; Q348-A352 PolarHBondContact O-N 2.7Å; F349-A352 PolarHBondContact O-N 3.44Å; A352-A355 PolarHBondContact O-N 3.48Å; A352-Q356 WeakPolarHBondContact O-CB 3.17Å; A352-Q356 PolarHBondContact O-N 3.1Å
353	T	85.6	Confident	80.8	Confident	48 Å²	48	94.8 Å²	94.8	29%	0.294	53%	0.529	S	S	.	.	H	α-helix	trans	-63.5	-44.2	177.3	-54.5	0	0	0	0	111.2	F349 M350 A355 Q356 Q357	F349-T353 WeakPolarHBondContact O-CB 3.35Å; F349-T353 PolarHBondContact O-N 3.16Å; F349-T353 PolarHBondContact O-OG1 3.14Å; M350-T353 PolarHBondContact O-N 3.2Å; T353-A355 PolarHBondContact O-N 3.48Å; T353-Q356 PolarHBondContact O-N 2.97Å; T353-Q357 WeakPolarHBondContact O-CG 3.37Å; T353-Q357 PolarHBondContact O-N 3.49Å
354	A	84.1	Confident	79.2	Confident	45 Å²	45	94.9 Å²	94.9	37%	0.372	53%	0.529	S	S	.	.	H	α-helix	trans	-63.2	-41.4	176.5	0	0	0	0	0	112.3	M350 L351 Q356 Q357 L358	M350-A354 WeakPolarHBondContact O-CB 3.39Å; M350-A354 PolarHBondContact O-N 2.99Å; L351-A354 PolarHBondContact O-N 3.38Å; A354-Q356 VanDerWaalsContact C-N 3.34Å; A354-Q356 PolarHBondContact O-N 2.95Å; A354-Q357 PolarHBondContact O-N 2.94Å; A354-L358 PolarHBondContact O-N 3.46Å
355	A	82.5	Confident	77.5	Confident	46 Å²	46	93.7 Å²	93.7	38%	0.38	53%	0.532	S	S	.	.	H	α-helix	trans	-63	-39.8	175.7	0	0	0	0	0	112.1	L351 A352 T353 L358 Q359	L351-A355 WeakPolarHBondContact O-CB 3.47Å; L351-A355 PolarHBondContact O-N 3Å; A352-A355 PolarHBondContact O-N 3.48Å; T353-A355 PolarHBondContact O-N 3.48Å; A355-L358 PolarHBondContact O-N 3.19Å; A355-Q359 WeakPolarHBondContact O-CG 3.48Å; A355-Q359 PolarHBondContact O-N 3.33Å
356	Q	78.8	Confident	76	Confident	129 Å²	129	94 Å²	94	60%	0.603	53%	0.534	S	S	*	.	H	α-helix	trans	-69.2	-34.9	178.6	-153.9	172.1	17.5	0	0	112.4	A352 T353 A354 Q359 T360	A352-Q356 WeakPolarHBondContact O-CB 3.17Å; A352-Q356 PolarHBondContact O-N 3.1Å; T353-Q356 PolarHBondContact O-N 2.97Å; A354-Q356 VanDerWaalsContact C-N 3.34Å; A354-Q356 PolarHBondContact O-N 2.95Å; Q356-Q359 PolarHBondContact O-N 2.95Å; Q356-T360 WeakPolarHBondContact O-CB 3.46Å; Q356-T360 WeakPolarHBondContact O-CG2 2.97Å; Q356-T360 PolarHBondContact O-N 3.11Å; Q356-T360 PolarHBondContact O-OG1 3.48Å
357	Q	75.4	Confident	74.5	Confident	134 Å²	134	93.4 Å²	93.4	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-66.8	-37.3	172	-72.8	177.4	-6	0	0	112.3	T353 A354 Q359 G361	T353-Q357 WeakPolarHBondContact O-CG 3.37Å; T353-Q357 PolarHBondContact O-N 3.49Å; A354-Q357 PolarHBondContact O-N 2.94Å; Q357-Q359 VanDerWaalsContact C-N 3.35Å; Q357-G361 WeakPolarHBondContact O-CA 3.43Å; Q357-G361 PolarHBondContact O-N 3.14Å
358	L	72.8	Confident	73.1	Confident	137 Å²	137	92.5 Å²	92.5	72%	0.717	53%	0.532	S	S	*	.	H	α-helix	trans	-68.1	-32.8	175.1	-77.5	160.5	0	0	0	112.7	A354 A355 P362	A354-L358 PolarHBondContact O-N 3.46Å; A355-L358 PolarHBondContact O-N 3.19Å; L358-P362 VanDerWaalsContact O-CD 3.23Å; L358-P362 WeakPolarHBondContact O-CD 3.39Å
359	Q	71.2	Confident	71.5	Confident	150 Å²	150	88.8 Å²	88.8	70%	0.701	52%	0.524	S	S	*	.	H	α-helix	trans	-78.8	-34.3	176.9	-71.8	178.5	5.4	0	0	113.1	A355 Q356 Q357	A355-Q359 WeakPolarHBondContact O-CG 3.48Å; A355-Q359 PolarHBondContact O-N 3.33Å; Q356-Q359 PolarHBondContact O-N 2.95Å; Q357-Q359 VanDerWaalsContact C-N 3.35Å
360	T	63.8	Low	69.9	Low	61 Å²	61	84.2 Å²	84.2	37%	0.374	51%	0.514	S	S	.	.	H	α-helix	trans	-87.4	-20.5	179	54.6	0	0	0	0	113.3	Q356 A363 Q364	Q356-T360 WeakPolarHBondContact O-CB 3.46Å; Q356-T360 WeakPolarHBondContact O-CG2 2.97Å; Q356-T360 PolarHBondContact O-N 3.11Å; Q356-T360 PolarHBondContact O-OG1 3.48Å; T360-A363 PolarHBondContact O-N 3.48Å; T360-A363 VanDerWaalsContact O-N 3.16Å; T360-Q364 WeakPolarHBondContact O-CB 3.43Å; T360-Q364 PolarHBondContact O-N 3.28Å
361	G	60.8	Low	68.2	Low	32 Å²	32	80.8 Å²	80.8	33%	0.33	51%	0.507	S	S	.	.	H	α-helix	trans	-53.9	-47.7	178.5	0	0	0	0	0	115	Q357 A365	Q357-G361 WeakPolarHBondContact O-CA 3.43Å; Q357-G361 PolarHBondContact O-N 3.14Å; G361-A365 WeakPolarHBondContact O-CB 3.44Å; G361-A365 PolarHBondContact O-N 3.28Å
362	P	60.5	Low	66.5	Low	88 Å²	88	84.4 Å²	84.4	57%	0.571	51%	0.513	S	S	*	.	H	α-helix	trans	-66.1	-37.7	176.3	-18.9	30.1	0	0	0	112.6	L358 A366	L358-P362 VanDerWaalsContact O-CD 3.23Å; L358-P362 WeakPolarHBondContact O-CD 3.39Å; P362-A366 WeakPolarHBondContact O-CB 3Å; P362-A366 PolarHBondContact O-N 3.5Å
363	A	58.9	Low	64.8	Low	65 Å²	65	87.7 Å²	87.7	54%	0.537	52%	0.523	S	S	.	.	H	α-helix	trans	-72.9	-38.7	-179.1	0	0	0	0	0	112.5	T360 A367	T360-A363 PolarHBondContact O-N 3.48Å; T360-A363 VanDerWaalsContact O-N 3.16Å; A363-A367 VanDerWaalsContact O-CB 3.28Å; A363-A367 WeakPolarHBondContact O-CB 3.34Å; A363-A367 PolarHBondContact O-N 3.12Å
364	Q	57.1	Low	63.1	Low	127 Å²	127	94.2 Å²	94.2	59%	0.593	55%	0.547	S	S	*	.	H	α-helix	trans	-71.1	-39.9	172.8	-84.2	178.9	-22.7	0	0	111.9	T360 A366 A367 I368	T360-Q364 WeakPolarHBondContact O-CB 3.43Å; T360-Q364 PolarHBondContact O-N 3.28Å; Q364-A366 VanDerWaalsContact C-N 3.35Å; Q364-A367 PolarHBondContact O-N 3.19Å; Q364-I368 WeakPolarHBondContact O-CB 3.33Å; Q364-I368 WeakPolarHBondContact O-CD1 3.5Å; Q364-I368 WeakPolarHBondContact O-CG1 3.46Å; Q364-I368 PolarHBondContact O-N 2.93Å
365	A	57.4	Low	61.3	Low	59 Å²	59	96.4 Å²	96.4	49%	0.488	56%	0.56	S	S	.	*	H	α-helix	trans	-63.4	-40.4	173.9	0	0	0	0	0	111.9	G361 A369	G361-A365 WeakPolarHBondContact O-CB 3.44Å; G361-A365 PolarHBondContact O-N 3.28Å; A365-A369 VanDerWaalsContact O-CB 3.26Å; A365-A369 WeakPolarHBondContact O-CB 3.29Å; A365-A369 PolarHBondContact O-N 2.95Å
366	A	59.1	Low	59.7	Low	59 Å²	59	102.3 Å²	102.3	49%	0.488	58%	0.577	S	S	.	*	H	α-helix	trans	-67.5	-39.2	174	0	0	0	0	0	112.5	P362 Q364 A369 A370	P362-A366 WeakPolarHBondContact O-CB 3Å; P362-A366 PolarHBondContact O-N 3.5Å; Q364-A366 VanDerWaalsContact C-N 3.35Å; A366-A369 PolarHBondContact O-N 3.03Å; A366-A370 VanDerWaalsContact O-CB 3.23Å; A366-A370 WeakPolarHBondContact O-CB 3.4Å; A366-A370 PolarHBondContact O-N 2.9Å
367	A	58.8	Low	58.1	Low	61 Å²	61	102.2 Å²	102.2	50%	0.504	59%	0.585	S	S	.	*	H	α-helix	trans	-67.9	-38.9	176.1	0	0	0	0	0	112.6	A363 Q364 A370 A371	A363-A367 VanDerWaalsContact O-CB 3.28Å; A363-A367 WeakPolarHBondContact O-CB 3.34Å; A363-A367 PolarHBondContact O-N 3.12Å; Q364-A367 PolarHBondContact O-N 3.19Å; A367-A370 PolarHBondContact O-N 2.93Å; A367-A371 VanDerWaalsContact O-CB 3.29Å; A367-A371 WeakPolarHBondContact O-CB 3.4Å; A367-A371 PolarHBondContact O-N 3.1Å
368	I	59.6	Low	56.2	Low	107 Å²	107	101.4 Å²	101.4	55%	0.549	59%	0.594	S	S	.	*	H	α-helix	trans	-69.5	-38.7	175.1	-67.7	164.9	0	0	0	110.7	Q364 A371 R372	Q364-I368 WeakPolarHBondContact O-CB 3.33Å; Q364-I368 WeakPolarHBondContact O-CD1 3.5Å; Q364-I368 WeakPolarHBondContact O-CG1 3.46Å; Q364-I368 PolarHBondContact O-N 2.93Å; I368-A371 PolarHBondContact O-N 2.64Å; I368-R372 WeakPolarHBondContact O-CB 3.42Å; I368-R372 PolarHBondContact O-N 2.95Å
369	A	57	Low	54.6	Low	58 Å²	58	102.7 Å²	102.7	48%	0.479	60%	0.602	S	S	.	*	H	α-helix	trans	-64.9	-43.4	173.1	0	0	0	0	0	111.8	A365 A366 A371 R372 D373	A365-A369 VanDerWaalsContact O-CB 3.26Å; A365-A369 WeakPolarHBondContact O-CB 3.29Å; A365-A369 PolarHBondContact O-N 2.95Å; A366-A369 PolarHBondContact O-N 3.03Å; A369-A371 PolarHBondContact O-N 2.84Å; A369-R372 PolarHBondContact O-N 3.21Å; A369-D373 PolarHBondContact O-N 2.9Å
370	A	57	Low	52.9	Low	53 Å²	53	101.4 Å²	101.4	44%	0.438	60%	0.604	S	S	.	*	H	α-helix	trans	-67.5	-31.9	176	0	0	0	0	0	113.2	A366 A367 K374	A366-A370 VanDerWaalsContact O-CB 3.23Å; A366-A370 WeakPolarHBondContact O-CB 3.4Å; A366-A370 PolarHBondContact O-N 2.9Å; A367-A370 PolarHBondContact O-N 2.93Å; A370-K374 WeakPolarHBondContact O-CG 3.25Å; A370-K374 PolarHBondContact O-N 3.02Å
371	A	55.9	Low	51.5	Low	63 Å²	63	103.8 Å²	103.8	52%	0.521	62%	0.623	S	S	.	*	H	α-helix	trans	-72.6	-34.2	173.3	0	0	0	0	0	112.4	A367 I368 A369	A367-A371 VanDerWaalsContact O-CB 3.29Å; A367-A371 WeakPolarHBondContact O-CB 3.4Å; A367-A371 PolarHBondContact O-N 3.1Å; I368-A371 PolarHBondContact O-N 2.64Å; A369-A371 PolarHBondContact O-N 2.84Å
372	R	53.4	Low	50.4	Low	193 Å²	193	110.1 Å²	110.1	73%	0.728	65%	0.649	S	S	*	*	H	α-helix	trans	-71.3	-28	173.3	-107.1	177.5	168.8	167.4	-2.8	113.5	I368 A369 S375	I368-R372 WeakPolarHBondContact O-CB 3.42Å; I368-R372 PolarHBondContact O-N 2.95Å; A369-R372 PolarHBondContact O-N 3.21Å; R372-S375 PolarHBondContact O-OG 2.89Å
373	D	50.3	Low	49.6	Very low	127 Å²	127	111.1 Å²	111.1	68%	0.679	66%	0.655	S	S	*	*	H	α-helix	trans	-81.4	-25	178.5	-140.8	18.2	0	0	0	112.3	A369 S375	A369-D373 PolarHBondContact O-N 2.9Å; D373-S375 VanDerWaalsContact C-N 3.35Å
374	K	50.3	Low	48.2	Very low	184 Å²	184	115.2 Å²	115.2	80%	0.8	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-6.3	174	-74.3	-174.8	178.7	-176.6	0	114.9	A370	A370-K374 WeakPolarHBondContact O-CG 3.25Å; A370-K374 PolarHBondContact O-N 3.02Å
375	S	47.6	Very low	47.2	Very low	92 Å²	92	116.3 Å²	116.3	64%	0.643	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	15.4	179.7	72.3	0	0	0	0	114.4	R372 D373	R372-S375 PolarHBondContact O-OG 2.89Å; D373-S375 VanDerWaalsContact C-N 3.35Å
376	K	47.6	Very low	46.2	Very low	170 Å²	170	119 Å²	119	74%	0.739	69%	0.689	S	S	*	*	S	Bend	trans	-98.4	5.2	179.4	-85.6	-174.3	178.1	176.3	0	116
377	T	45.2	Very low	45.3	Very low	126 Å²	126	120.7 Å²	120.7	77%	0.773	70%	0.697	S	S	*	*	S	Bend	trans	-136.8	82.7	173.7	57.4	0	0	0	0	111.7
378	S	36.6	Very low	44	Very low	117 Å²	117	123.8 Å²	123.8	82%	0.818	71%	0.71	S	S	*	*			trans	-177.6	112.4	142.1	34.9	0	0	0	0	108.5
379	N	37.7	Very low	42.7	Very low	165 Å²	165	126.6 Å²	126.6	88%	0.882	72%	0.721	S	S	*	*			trans	-103.7	105.9	172.7	-160	18.7	0	0	0	106
380	T	35.8	Very low	41.6	Very low	122 Å²	122	133.1 Å²	133.1	75%	0.748	74%	0.741	S	S	*	*			trans	-155.8	114.6	159.5	35	0	0	0	0	110.7
381	S	34.5	Very low	40.5	Very low	112 Å²	112	138.9 Å²	138.9	78%	0.783	76%	0.759	S	S	*	*			trans	67	110.9	135.9	-36.6	0	0	0	0	120.5
382	L	38.7	Very low	39.4	Very low	164 Å²	164	144.5 Å²	144.5	86%	0.859	77%	0.774	S	S	*	*			trans	-39.1	154.7	154.6	-81.7	157.8	0	0	0	114.3
383	P	42.2	Very low	38.5	Very low	109 Å²	109	144.3 Å²	144.3	71%	0.708	78%	0.781	S	S	*	*				-153.5	160.8	70.6	37	-14.4	0	0	0	120.4
384	L	31	Very low	37.8	Very low	152 Å²	152	143.3 Å²	143.3	80%	0.796	78%	0.781	S	S	*	*			trans	49.4	114.9	139.6	-71.6	149.7	0	0	0	122.3
385	L	34.8	Very low	37	Very low	149 Å²	149	143.3 Å²	143.3	78%	0.78	78%	0.784	S	S	*	*			trans	13	150.4	135.5	-77.6	162.9	0	0	0	120.3
386	P	38	Very low	36.3	Very low	115 Å²	115	147.6 Å²	147.6	75%	0.747	79%	0.794	S	S	*	*			cis	-145.7	165.4	48.9	38.2	-16.6	0	0	0	119
387	S	39.7	Very low	35.5	Very low	96 Å²	96	146.4 Å²	146.4	67%	0.671	80%	0.795	S	S	*	*			trans	-47	135.8	161.7	45	0	0	0	0	115.9
388	T	31	Very low	34.8	Very low	126 Å²	126	151.5 Å²	151.5	77%	0.773	80%	0.802	S	S	*	*			trans	-154.2	121.1	144.7	32.1	0	0	0	0	113.1
389	Q	32	Very low	34.5	Very low	165 Å²	165	152 Å²	152	77%	0.771	80%	0.8	S	S	*	*			trans	71.8	101.5	136.9	-63.7	-178.1	-9.2	0	0	120.7	H391	Q389-H391 PolarHBondContact O-N 3.11Å
390	H	35.3	Very low	34.1	Very low	195 Å²	195	152.9 Å²	152.9	90%	0.903	80%	0.796	S	S	*	*			trans	-47.2	123.3	145.7	-82.8	-74.5	0	0	0	111.6
391	H	33.3	Very low	33.9	Very low	174 Å²	174	155 Å²	155	81%	0.806	80%	0.802	S	S	*	*			trans	-123.2	139.8	157.4	-97.5	5.5	0	0	0	111.4	Q389	Q389-H391 PolarHBondContact O-N 3.11Å
392	H	32.6	Very low	33.7	Very low	182 Å²	182	157.9 Å²	157.9	84%	0.843	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-48.8	137.2	-170.1	-73.5	-15.2	0	0	0	114.8
393	H	33.9	Very low	33.2	Very low	188 Å²	188	156 Å²	156	87%	0.87	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-74.7	125.2	151.2	-105.3	-57.7	0	0	0	109
394	P	36.1	Very low	32.7	Very low	107 Å²	107	159.4 Å²	159.4	70%	0.695	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-80.3	133.7	167.7	29.4	-28.1	0	0	0	110.7
395	H	33.7	Very low	32.6	Very low	184 Å²	184	159.6 Å²	159.6	85%	0.852	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-50.8	136.1	158.9	-88.5	-93.5	0	0	0	110.8
396	Q	33	Very low	32.4	Very low	182 Å²	182	161 Å²	161	85%	0.85	81%	0.813	S	S	*	*			trans	-124.2	96.8	160	-87.7	-173.5	-17.6	0	0	109.9
397	D	30.6	Very low	31.9	Very low	144 Å²	144	163.3 Å²	163.3	77%	0.77	82%	0.819	S	S	*	*			trans	31.5	92.5	130.6	-59.8	-30.5	0	0	0	118.9	V399	D397-V399 PolarHBondContact O-N 2.63Å
398	Y	29.8	Very low	31.3	Very low	233 Å²	233	162.9 Å²	162.9	91%	0.914	82%	0.821	S	S	*	*			trans	-73.9	109.7	146.6	-93.7	-96.4	0	0	0	109.1	K400	Y398-K400 PolarHBondContact O-N 3.14Å
399	V	30.9	Very low	31.2	Very low	127 Å²	127	164.1 Å²	164.1	77%	0.77	82%	0.823	S	S	*	*			trans	-66.2	104	169.1	175.6	0	0	0	0	109.1	D397 L401	D397-V399 PolarHBondContact O-N 2.63Å; V399-L401 PolarHBondContact O-N 3.2Å
400	K	29.2	Very low	31	Very low	184 Å²	184	163.9 Å²	163.9	80%	0.8	83%	0.827	S	S	*	*			trans	-69	113.1	163.8	-77.9	175.8	176.5	173.4	0	108.9	Y398 Q402	Y398-K400 PolarHBondContact O-N 3.14Å; K400-Q402 PolarHBondContact O-N 3.32Å
401	L	31.3	Very low	30.7	Very low	168 Å²	168	162.7 Å²	162.7	88%	0.88	83%	0.826	S	S	*	*			trans	-74.9	109.1	158.3	-74.5	166.2	0	0	0	108	V399	V399-L401 PolarHBondContact O-N 3.2Å
402	Q	30.5	Very low	30.5	Very low	172 Å²	172	162.6 Å²	162.6	80%	0.804	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-74.8	143.9	170.1	-77.7	-175.7	-13.9	0	0	110.6	K400	K400-Q402 PolarHBondContact O-N 3.32Å
403	P	29	Very low	30.3	Very low	123 Å²	123	164.7 Å²	164.7	80%	0.799	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-75.1	133.6	174.1	29.4	-30.8	0	0	0	111
404	L	31.6	Very low	30	Very low	181 Å²	181	160.9 Å²	160.9	95%	0.948	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-65	141.1	173.6	-99.1	140.4	0	0	0	111.6
405	N	29.1	Very low	29.5	Very low	156 Å²	156	164.4 Å²	164.4	83%	0.834	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-71.5	144.5	-162.7	-151.6	1.2	0	0	0	113
406	K	29.3	Very low	29.3	Very low	179 Å²	179	163.9 Å²	163.9	78%	0.778	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-78.9	131.5	165.4	-68.2	174.4	175.9	178.1	0	108.5
407	N	28	Very low	29	Very low	164 Å²	164	163.7 Å²	163.7	88%	0.877	82%	0.819	S	S	*	*			trans	174.3	153.8	130.8	-91.7	-18.8	0	0	0	113.1
408	A	28.1	Very low	28.9	Very low	86 Å²	86	164.3 Å²	164.3	71%	0.711	82%	0.822	S	S	*	*			trans	86	122	177	0	0	0	0	0	114.8
409	N	27.7	Very low	28.6	Very low	153 Å²	153	158.4 Å²	158.4	82%	0.818	81%	0.812	S	S	*	*			cis	-151.1	138.3	6.1	-96.3	-31.9	0	0	0	109.4
410	L	27.8	Very low	28.5	Very low	160 Å²	160	159 Å²	159	84%	0.838	82%	0.816	S	S	*	*			trans	-67.7	126.8	162.1	-86.2	90.3	0	0	0	109.1
411	L	29.3	Very low	28.5	Very low	170 Å²	170	161.1 Å²	161.1	89%	0.89	83%	0.834	S	S	*	*			trans	-127.4	111.1	150.3	-83.9	168	0	0	0	108.3
412	H	28.9	Very low	28.4	Very low	171 Å²	171	160.8 Å²	160.8	79%	0.792	83%	0.832	S	S	*	*			trans	-53.9	133.5	163	-95.4	-68.4	0	0	0	110.7
413	R	28.6	Very low	28.2	Very low	227 Å²	227	160.2 Å²	160.2	86%	0.857	83%	0.833	S	S	*	*			trans	-174	106.6	138.7	-103.9	161.4	-173.7	-161.3	1.6	110.6
414	T	27.7	Very low	28.2	Very low	107 Å²	107	162.3 Å²	162.3	66%	0.656	84%	0.835	S	S	*	*				88.5	100	114.4	50.4	0	0	0	0	113.9	H416	T414-H416 PolarHBondContact O-N 3.39Å
415	E	26.5	Very low	28	Very low	182 Å²	182	161.2 Å²	161.2	85%	0.85	83%	0.828	S	S	*	*			trans	-55	119.6	162.3	-65.4	175.4	148.7	0	0	109.6
416	H	28.1	Very low	27.9	Very low	172 Å²	172	161.5 Å²	161.5	80%	0.796	83%	0.828	S	S	*	*			trans	-91.6	102.8	163.2	-81.4	-67.5	0	0	0	108.6	T414 L418	T414-H416 PolarHBondContact O-N 3.39Å; H416-L418 PolarHBondContact O-N 2.73Å
417	H	26.9	Very low	27.8	Very low	178 Å²	178	160.3 Å²	160.3	82%	0.824	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-54.8	121	156.3	-80.9	-50.6	0	0	0	109.2
418	L	28.3	Very low	27.8	Very low	158 Å²	158	160.1 Å²	160.1	83%	0.827	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-96.2	143.4	158.5	-81.7	168.1	0	0	0	109.3	H416	H416-L418 PolarHBondContact O-N 2.73Å
419	P	24.9	Very low	27.8	Very low	108 Å²	108	165.8 Å²	165.8	70%	0.701	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-75	148.4	-162.9	30.1	-34.6	0	0	0	112.4
420	T	27.8	Very low	27.8	Very low	139 Å²	139	166.8 Å²	166.8	85%	0.853	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-61.1	126.6	164.6	-35.2	0	0	0	0	109.3
421	I	29.2	Very low	27.8	Very low	230 Å²	230	167.5 Å²	167.5	100%	1.179	84%	0.839	S	S	*	*			trans	-116.2	0	152.7	-61.8	-179.9	0	0	0	106.2

Retrieved 421 of 421 residues in 167.8 ms (Link to these results)

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