A0A075B751_HUMAN Loading...

Phospholipase A1

AlphaFold DB , UniProt , Accession A0A075B751, Species HUMAN (Homo sapiens, Human), Gene LIPG, Length 188 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	L	39.1	Very low	39.3	Very low	224 Å²	224	135.5 Å²	135.5	100%	1.173	83%	0.832	S	S	*	*				0	84.5	0	-73.2	155.3	0	0	0	106.6
2	C	34.9	Very low	39.6	Very low	108 Å²	108	133.3 Å²	133.3	73%	0.73	82%	0.822	S	S	*	*				63	103.5	103.5	-84.7	0	0	0	0	114.1
3	Y	35.2	Very low	38.9	Very low	213 Å²	213	138.7 Å²	138.7	84%	0.835	83%	0.827	S	S	*	*				68.8	136.3	88	-80.2	-78.8	0	0	0	111.9
4	C	41.9	Very low	38.8	Very low	92 Å²	92	134.1 Å²	134.1	62%	0.622	82%	0.823	S	S	*	*			cis	-173.6	162.4	-14.4	-112.6	0	0	0	0	108.9
5	F	38.4	Very low	39.5	Very low	200 Å²	200	134 Å²	134	88%	0.877	83%	0.826	S	S	*	*			trans	12.4	141.5	155.9	-66.5	-84.9	0	0	0	123.9
6	A	39.1	Very low	39.7	Very low	105 Å²	105	137.1 Å²	137.1	87%	0.868	83%	0.828	S	S	*	*				173.1	154.8	99.8	0	0	0	0	0	113.8
7	A	44.7	Very low	39.3	Very low	111 Å²	111	133.9 Å²	133.9	92%	0.917	83%	0.829	S	S	*	*			trans	-98.7	161.3	-178.3	0	0	0	0	0	113.5
8	G	32.8	Very low	38.9	Very low	75 Å²	75	138.9 Å²	138.9	77%	0.773	83%	0.83	S	S	*	*			trans	-177.9	139	167.3	0	0	0	0	0	114.1
9	S	34.3	Very low	38.8	Very low	122 Å²	122	138.3 Å²	138.3	85%	0.853	82%	0.821	S	S	*	*			trans	-100	-158.1	-169.7	-50.1	0	0	0	0	113.9
10	P	55.3	Low	38.9	Very low	114 Å²	114	138.5 Å²	138.5	74%	0.74	81%	0.813	S	S	*	*				-118.8	-171.3	-113.6	34	-11.4	0	0	0	117.2
11	V	36.1	Very low	38.8	Very low	126 Å²	126	139 Å²	139	76%	0.764	81%	0.813	S	S	*	*			trans	73.4	155.5	163.1	-119.1	0	0	0	0	117.3
12	P	43.4	Very low	39.1	Very low	109 Å²	109	134 Å²	134	71%	0.708	78%	0.781	S	S	*	*			cis	-146.3	167.3	10.9	38.5	-14.4	0	0	0	121.4
13	F	29.9	Very low	39.1	Very low	204 Å²	204	137.2 Å²	137.2	90%	0.895	79%	0.791	S	S	*	*			trans	44	116.1	142.5	-80.7	-96.6	0	0	0	125.5
14	G	37.6	Very low	39.3	Very low	75 Å²	75	133.6 Å²	133.6	77%	0.773	78%	0.781	S	S	*	*				84.2	163.2	125.7	0	0	0	0	0	121.2
15	P	49.8	Very low	39.1	Very low	132 Å²	132	138.3 Å²	138.3	86%	0.857	79%	0.791	S	S	*	*			cis	-125.9	172.4	2.1	40.5	-24	0	0	0	116.5
16	E	43.3	Very low	38.9	Very low	184 Å²	184	134.6 Å²	134.6	86%	0.86	79%	0.787	S	S	*	*			trans	-45.4	141.3	168.5	-151	78.2	-173.1	0	0	115.5
17	G	31.5	Very low	38.7	Very low	82 Å²	82	138.8 Å²	138.8	85%	0.845	79%	0.785	S	S	*	*			trans	-159.8	101.4	168.6	0	0	0	0	0	112.5
18	R	33.6	Very low	38.5	Very low	224 Å²	224	137.4 Å²	137.4	85%	0.845	77%	0.774	S	S	*	*			trans	-105.2	152.6	179.3	-178.9	-178.7	-168	160.3	5.5	110.7
19	L	36.8	Very low	38.5	Very low	127 Å²	127	139.9 Å²	139.9	67%	0.665	77%	0.774	S	S	*	*			trans	110.7	94.9	147.2	-142.3	75.5	0	0	0	116.9
20	E	40	Very low	38.9	Very low	143 Å²	143	142.6 Å²	142.6	67%	0.668	77%	0.774	S	S	*	*				87.9	133.4	110.4	-66.5	-169.6	-164.2	0	0	114
21	D	36.9	Very low	38.3	Very low	150 Å²	150	142.3 Å²	142.3	80%	0.802	77%	0.77	S	S	*	*				-162.2	172.3	77.4	-170	24.9	0	0	0	112.4
22	K	45	Very low	38.8	Very low	118 Å²	118	145.4 Å²	145.4	51%	0.513	78%	0.776	S	S	.	*			trans	-94.2	148	-144.3	-65.6	174.6	175	-153.4	0	113.8	H24	K22-H24 VanDerWaalsContact CD-CE1 3.43Å; K22-H24 WeakPolarHBondContact CD-CE1 3.48Å
23	L	36.4	Very low	39.7	Very low	176 Å²	176	145.8 Å²	145.8	92%	0.921	78%	0.776	S	S	*	*			trans	-130.3	88.3	136.4	-166.5	62.9	0	0	0	108.7	K25	L23-K25 PolarHBondContact O-N 3.43Å
24	H	37.9	Very low	41.8	Very low	137 Å²	137	144.6 Å²	144.6	63%	0.634	77%	0.77	S	S	*	*			trans	-62.9	100.9	168	-78.9	48.2	0	0	0	108.2	K22	K22-H24 VanDerWaalsContact CD-CE1 3.43Å; K22-H24 WeakPolarHBondContact CD-CE1 3.48Å
25	K	37.9	Very low	43.8	Very low	191 Å²	191	144.1 Å²	144.1	83%	0.83	75%	0.754	S	S	*	*			trans	-62.8	126	160.5	-165.7	174.5	-175.4	178.3	0	106.6	L23 K27	L23-K25 PolarHBondContact O-N 3.43Å; K25-K27 PolarHBondContact O-N 2.8Å
26	P	35.6	Very low	45.6	Very low	121 Å²	121	140.9 Å²	140.9	79%	0.786	73%	0.734	S	S	*	*			trans	-59.5	115.4	-176.2	20.7	-29.7	0	0	0	109	A28	P26-A28 PolarHBondContact O-N 3.43Å
27	K	33.8	Very low	48	Very low	194 Å²	194	133 Å²	133	84%	0.843	70%	0.699	S	S	*	*			trans	-61.2	106.2	165.8	-169	177.8	-175.6	-177.7	0	105.1	K25 T29	K25-K27 PolarHBondContact O-N 2.8Å; K27-T29 PolarHBondContact O-N 3.19Å
28	A	40	Very low	50.9	Low	82 Å²	82	134.3 Å²	134.3	68%	0.678	68%	0.678	S	S	*	*			trans	-52.2	117.2	166.6	0	0	0	0	0	106.3	P26 Q30	P26-A28 PolarHBondContact O-N 3.43Å; A28-Q30 VanDerWaalsContact C-N 3.25Å; A28-Q30 PolarHBondContact O-N 3.26Å
29	T	33.4	Very low	53.8	Low	127 Å²	127	124.1 Å²	124.1	78%	0.779	64%	0.64	S	S	*	*			trans	-58.5	95.5	172	-54.5	0	0	0	0	106.6	K27 T31	K27-T29 PolarHBondContact O-N 3.19Å; T29-T31 PolarHBondContact O-N 3.37Å
30	Q	43.7	Very low	56.5	Low	179 Å²	179	118.6 Å²	118.6	84%	0.836	61%	0.611	S	S	*	*			trans	-69.1	92.1	161.7	-67.8	-172.8	0.2	0	0	105	A28 E32	A28-Q30 VanDerWaalsContact C-N 3.25Å; A28-Q30 PolarHBondContact O-N 3.26Å; Q30-E32 PolarHBondContact O-N 3.37Å; Q30-E32 VanDerWaalsContact O-N 3.12Å
31	T	42.7	Very low	59.1	Low	108 Å²	108	112 Å²	112	66%	0.663	58%	0.58	S	S	*	*			trans	-55	116.2	156.1	-45.5	0	0	0	0	104.7	T29 V33	T29-T31 PolarHBondContact O-N 3.37Å; T31-V33 WeakPolarHBondContact O-CG2 3.46Å; T31-V33 PolarHBondContact O-N 3.21Å
32	E	45.5	Very low	61.7	Low	190 Å²	190	106 Å²	106	89%	0.888	55%	0.547	S	S	*	.			trans	-58.8	94.5	170.3	-82.6	-166.8	159.6	0	0	107.5	Q30 K34	Q30-E32 PolarHBondContact O-N 3.37Å; Q30-E32 VanDerWaalsContact O-N 3.12Å; E32-K34 PolarHBondContact O-N 3.34Å
33	V	62.8	Low	63.7	Low	118 Å²	118	104 Å²	104	72%	0.715	55%	0.545	S	S	*	.			trans	-75.2	101	176.1	-178.6	0	0	0	0	105.8	T31	T31-V33 WeakPolarHBondContact O-CG2 3.46Å; T31-V33 PolarHBondContact O-N 3.21Å
34	K	73.9	Confident	66	Low	178 Å²	178	97.4 Å²	97.4	77%	0.774	51%	0.513	S	S	*	.			trans	-52.7	128	172.7	-174.8	175.2	-178.4	175.4	0	108.5	E32 S36	E32-K34 PolarHBondContact O-N 3.34Å; K34-S36 PolarHBondContact O-N 3.02Å; K34-S36 VanDerWaalsContact O-N 3.14Å
35	P	79.1	Confident	67.9	Low	66 Å²	66	95.5 Å²	95.5	43%	0.429	50%	0.503	S	S	.	.			trans	-59	122.8	-179.7	21.3	-31	0	0	0	109.6	P113 L114	P35-P113 HydrophobicContact CB-CB 3.76Å; P35-L114 HydrophobicContact CB-CD2 3.81Å; P35-L114 HydrophobicContact CB-CG 4.28Å; P35-L114 HydrophobicContact CG-CD2 3.94Å
36	S	87.6	Confident	69.9	Low	63 Å²	63	90 Å²	90	44%	0.441	48%	0.483	S	S	.	.			trans	-126.5	149.6	-173.1	63	0	0	0	0	111.1	K34	K34-S36 PolarHBondContact O-N 3.02Å; K34-S36 VanDerWaalsContact O-N 3.14Å
37	V	92.8	Very high	71.7	Confident	20 Å²	20	87 Å²	87	12%	0.121	46%	0.463	C	S	.	.			trans	-75.3	131.2	171.4	-177.2	0	0	0	0	109.3	F39 V109 D110 W111 L114 V129	V37-F39 HydrophobicContact CG1-CE2 4.41Å; V37-F39 HydrophobicContact CG1-CZ 4.22Å; V37-V109 HydrophobicContact CG1-CG1 3.58Å; V37-D110 CarbonylContact C-O 3.57Å; V37-D110 WeakPolarHBondContact CA-O 3.45Å; V37-W111 HydrophobicContact CG1-CB 4.43Å; V37-W111 HydrophobicContact CG2-CB 4.05Å; V37-L114 HydrophobicContact CG2-CD1 3.89Å; V37-V129 HydrophobicContact CG2-CB 4.29Å; V37-V129 HydrophobicContact CG2-CG1 4.4Å; V37-V129 HydrophobicContact CG2-CG2 3.83Å
38	R	93.7	Very high	73.8	Confident	108 Å²	108	85.6 Å²	85.6	41%	0.408	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	150.5	179	-54.7	-172.7	-66.4	171.2	-4.6	110.1	Y53 D110	R38-Y53 HydrophobicContact CB-CD1 3.83Å; R38-Y53 HydrophobicContact CB-CE1 3.9Å; R38-D110 HydrophobicContact CB-CB 4.23Å; R38-D110 IonicContact CZ-OD2 3.18Å; R38-D110 PolarHBondContact N-O 2.95Å; R38-D110 IonicContact NE-OD2 3.02Å; R38-D110 PolarHBondContact NE-OD2 3.31Å; R38-D110 IonicContact NH2-OD2 2.64Å; R38-D110 PolarHBondContact NH2-OD2 3.43Å; R38-D110 PolarHBondContact O-N 3.44Å
39	F	93.4	Very high	75.8	Confident	10 Å²	10	85.8 Å²	85.8	4%	0.044	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	105.8	-179	-62.5	-85.8	0	0	0	108.7	V37 Y53 L54 F75 V107 V109 S132 I133 M136	V37-F39 HydrophobicContact CG1-CE2 4.41Å; V37-F39 HydrophobicContact CG1-CZ 4.22Å; F39-Y53 CarbonylContact O-C 3.55Å; F39-Y53 WeakPolarHBondContact O-CA 3.45Å; F39-L54 HydrophobicContact CB-CB 4.08Å; F39-L54 PolarHBondContact O-N 2.97Å; F39-F75 HydrophobicContact CD1-CD1 4.29Å; F39-F75 AromaticContact CD1-CE1 3.75Å; F39-F75 HydrophobicContact CD1-CE1 3.75Å; F39-F75 HydrophobicContact CE1-CE1 4.07Å; F39-V107 HydrophobicContact CB-CG1 3.98Å; F39-V107 HydrophobicContact CD1-CG1 4.34Å; F39-V109 HydrophobicContact CD1-CG2 4.09Å; F39-V109 HydrophobicContact CE1-CG1 4.26Å; F39-V109 HydrophobicContact CE1-CG2 4.11Å; F39-S132 WeakPolarHBondContact CZ-O 3.42Å; F39-I133 HydrophobicContact CE1-CG1 4.12Å; F39-I133 HydrophobicContact CZ-CG1 4.42Å; F39-M136 HydrophobicContact CB-CE 3.75Å; F39-M136 HydrophobicContact CD1-CB 4.37Å; F39-M136 HydrophobicContact CD1-CE 4.24Å; F39-M136 HydrophobicContact CD1-CG 3.99Å; F39-M136 HydrophobicContact CD2-CB 4.41Å; F39-M136 HydrophobicContact CD2-CE 3.24Å; F39-M136 HydrophobicContact CD2-CG 4.33Å; F39-M136 HydrophobicContact CE1-CB 3.81Å; F39-M136 HydrophobicContact CE1-CG 3.92Å; F39-M136 HydrophobicContact CE2-CB 3.87Å; F39-M136 HydrophobicContact CE2-CE 3.84Å; F39-M136 HydrophobicContact CE2-CG 4.27Å; F39-M136 HydrophobicContact CG-CE 3.47Å; F39-M136 VanDerWaalsContact CG-CE 3.47Å; F39-M136 HydrophobicContact CG-CG 4.19Å; F39-M136 HydrophobicContact CZ-CB 3.53Å; F39-M136 HydrophobicContact CZ-CG 4.07Å
40	N	93.8	Very high	78	Confident	11 Å²	11	87.3 Å²	87.3	6%	0.059	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	105.9	-173.8	-175.4	-3.2	0	0	0	110.4	R42 G51 C52 Y53 V107 V108	N40-R42 PolarHBondContact O-N 3.35Å; N40-G51 WeakPolarHBondContact OD1-CA 3.49Å; N40-C52 CarbonylContact C-O 3.44Å; N40-C52 PolarHBondContact OD1-N 3.11Å; N40-Y53 HydrophobicContact CB-CD1 4.01Å; N40-Y53 HydrophobicContact CB-CE1 3.76Å; N40-V107 CarbonylContact O-C 3.54Å; N40-V107 WeakPolarHBondContact O-CA 3.25Å; N40-V108 HydrophobicContact CB-CB 4.4Å; N40-V108 PolarHBondContact N-O 3.03Å; N40-V108 PolarHBondContact O-N 2.99Å
41	L	94.2	Very high	80	Confident	4 Å²	4	79.2 Å²	79.2	2%	0.021	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	118.3	172.1	-176.3	67.4	0	0	0	110.2	G51 C52 L54 C65 F67 N105 V107	L41-G51 WeakPolarHBondContact O-CA 3.04Å; L41-C52 WeakPolarHBondContact CB-O 3.4Å; L41-C52 PolarHBondContact N-O 3.05Å; L41-C52 PolarHBondContact O-N 3.03Å; L41-L54 HydrophobicContact CB-CD1 4.4Å; L41-L54 HydrophobicContact CB-CG 4.32Å; L41-C65 HydrophobicContact CD2-CB 3.8Å; L41-C65 VanDerWaalsContact CD2-O 3.25Å; L41-C65 WeakPolarHBondContact CD2-O 3.49Å; L41-F67 HydrophobicContact CD1-CD2 4.03Å; L41-F67 HydrophobicContact CD1-CE2 4.44Å; L41-F67 HydrophobicContact CD2-CB 4.18Å; L41-F67 HydrophobicContact CD2-CD2 4.08Å; L41-N105 HydrophobicContact CD1-CB 3.77Å; L41-V107 HydrophobicContact CD1-CG2 3.81Å
42	R	93.1	Very high	82.3	Confident	25 Å²	25	75.8 Å²	75.8	9%	0.094	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	122.3	174.1	-56.7	-65	-74.8	169.3	-4.7	108.8	N40 D46 P47 H49 V94 H98 V106 V108	N40-R42 PolarHBondContact O-N 3.35Å; R42-D46 PolarHBondContact NH2-O 3.42Å; R42-D46 VanDerWaalsContact NH2-O 3.07Å; R42-P47 PolarHBondContact NH2-O 3.45Å; R42-H49 PolarHBondContact NH1-O 3.01Å; R42-V94 HydrophobicContact CB-CG1 3.8Å; R42-V94 HydrophobicContact CG-CG1 3.93Å; R42-V94 HydrophobicContact CG-CG2 4.09Å; R42-H98 PolarHBondContact O-CE1 2.88Å; R42-H98 PolarHBondContact O-NE2 2.92Å; R42-V106 HydrophobicContact CB-CB 4.34Å; R42-V106 HydrophobicContact CB-CG1 4.48Å; R42-V106 PolarHBondContact N-O 2.94Å; R42-V108 HydrophobicContact CG-CG2 3.78Å
43	T	86.5	Confident	84.6	Confident	77 Å²	77	70.4 Å²	70.4	47%	0.472	36%	0.361	S	S	.	.			trans	-104.6	-11.9	179.2	52.2	0	0	0	0	112.3	H49	T43-H49 PolarHBondContact OG1-CD2 3.26Å; T43-H49 PolarHBondContact OG1-NE2 3.34Å
44	S	83.8	Confident	85.9	Confident	37 Å²	37	65 Å²	65	26%	0.259	33%	0.328	S	S	.	.			trans	-135.3	152.3	-175.3	-177.2	0	0	0	0	111.9	D46	S44-D46 WeakPolarHBondContact OG-CB 3.48Å; S44-D46 PolarHBondContact OG-N 3.42Å; S44-D46 VanDerWaalsContact OG-N 3.08Å
45	K	79.1	Confident	86.5	Confident	96 Å²	96	59.3 Å²	59.3	42%	0.417	31%	0.311	S	S	.	.	S	Bend	trans	-74.1	-17.6	169.6	-60.5	-174.2	-174.8	-173.9	0	112.4	H98 T99	K45-H98 HydrophobicContact CD-CB 4.3Å; K45-H98 HydrophobicContact CG-CB 3.75Å; K45-T99 WeakPolarHBondContact CE-OG1 2.81Å; K45-T99 PolarHBondContact NZ-OG1 3.05Å
46	D	79	Confident	86.8	Confident	77 Å²	77	58.6 Å²	58.6	41%	0.412	31%	0.305	S	S	.	.			trans	-67.7	123.1	179.1	-177.3	-1.7	0	0	0	110	R42 S44 E48 H49	R42-D46 PolarHBondContact NH2-O 3.42Å; R42-D46 VanDerWaalsContact NH2-O 3.07Å; S44-D46 WeakPolarHBondContact OG-CB 3.48Å; S44-D46 PolarHBondContact OG-N 3.42Å; S44-D46 VanDerWaalsContact OG-N 3.08Å; D46-E48 VanDerWaalsContact C-N 3.25Å; D46-E48 PolarHBondContact O-N 3.01Å; D46-E48 PolarHBondContact OD1-N 3.47Å; D46-H49 HydrophobicContact CB-CB 4.04Å; D46-H49 PolarHBondContact O-N 3.01Å
47	P	74.1	Confident	86.4	Confident	57 Å²	57	58.1 Å²	58.1	37%	0.37	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-36.9	175.2	23.2	-33.7	0	0	0	113	R42 H49 H91	R42-P47 PolarHBondContact NH2-O 3.45Å; P47-H49 VanDerWaalsContact C-N 3.32Å; P47-H49 PolarHBondContact O-N 3.29Å; P47-H91 HydrophobicContact CB-CB 3.97Å; P47-H91 WeakPolarHBondContact CB-ND1 3.35Å
48	E	77.4	Confident	85.5	Confident	165 Å²	165	63 Å²	63	77%	0.771	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-14.6	-173.6	-59.8	-58.6	127.7	0	0	112.9	D46 E50	D46-E48 VanDerWaalsContact C-N 3.25Å; D46-E48 PolarHBondContact O-N 3.01Å; D46-E48 PolarHBondContact OD1-N 3.47Å; E48-E50 PolarHBondContact O-N 3.24Å
49	H	81.7	Confident	84.5	Confident	86 Å²	86	60.5 Å²	60.5	40%	0.398	33%	0.331	S	S	.	.	S	Bend	trans	-66.3	124.4	177.9	-165.6	73.8	0	0	0	110.1	R42 T43 D46 P47 G51	R42-H49 PolarHBondContact NH1-O 3.01Å; T43-H49 PolarHBondContact OG1-CD2 3.26Å; T43-H49 PolarHBondContact OG1-NE2 3.34Å; D46-H49 HydrophobicContact CB-CB 4.04Å; D46-H49 PolarHBondContact O-N 3.01Å; P47-H49 VanDerWaalsContact C-N 3.32Å; P47-H49 PolarHBondContact O-N 3.29Å; H49-G51 PolarHBondContact O-N 3.21Å
50	E	79.4	Confident	83.4	Confident	158 Å²	158	65.5 Å²	65.5	74%	0.738	35%	0.354	S	S	*	.			trans	-65.5	124.4	172.4	-169.5	168.7	-161.8	0	0	108.6	E48	E48-E50 PolarHBondContact O-N 3.24Å
51	G	87	Confident	82.5	Confident	9 Å²	9	66.3 Å²	66.3	9%	0.093	36%	0.36	C	S	.	.			trans	-84.2	176.8	177	0	0	0	0	0	111.4	N40 L41 H49	N40-G51 WeakPolarHBondContact OD1-CA 3.49Å; L41-G51 WeakPolarHBondContact O-CA 3.04Å; H49-G51 PolarHBondContact O-N 3.21Å
52	C	91.1	Very high	81.8	Confident	37 Å²	37	66.7 Å²	66.7	25%	0.25	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	129.9	-175.1	-167	0	0	0	0	111.3	N40 L41 C65	N40-C52 CarbonylContact C-O 3.44Å; N40-C52 PolarHBondContact OD1-N 3.11Å; L41-C52 WeakPolarHBondContact CB-O 3.4Å; L41-C52 PolarHBondContact N-O 3.05Å; L41-C52 PolarHBondContact O-N 3.03Å; C52-C65 HydrophobicContact CB-CB 3.57Å; C52-C65 WeakPolarHBondContact CB-SG 3.31Å; C52-C65 WeakPolarHBondContact SG-CA 3.32Å; C52-C65 WeakPolarHBondContact SG-CB 3.42Å; C52-C65 CovalentContact SG-SG 2.01Å; C52-C65 PolarHBondContact SG-SG 2.88Å
53	Y	92.1	Very high	81.1	Confident	76 Å²	76	71.1 Å²	71.1	30%	0.298	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	121.8	-174.1	-70.8	-85.8	0	0	0	112.6	R38 F39 N40	R38-Y53 HydrophobicContact CB-CD1 3.83Å; R38-Y53 HydrophobicContact CB-CE1 3.9Å; F39-Y53 CarbonylContact O-C 3.55Å; F39-Y53 WeakPolarHBondContact O-CA 3.45Å; N40-Y53 HydrophobicContact CB-CD1 4.01Å; N40-Y53 HydrophobicContact CB-CE1 3.76Å
54	L	90.9	Very high	81	Confident	5 Å²	5	73.1 Å²	73.1	3%	0.026	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	138.5	175.1	-53.8	179.1	0	0	0	110.6	F39 L41 L62 C65 F67 V107 M136	F39-L54 HydrophobicContact CB-CB 4.08Å; F39-L54 PolarHBondContact O-N 2.97Å; L41-L54 HydrophobicContact CB-CD1 4.4Å; L41-L54 HydrophobicContact CB-CG 4.32Å; L54-L62 HydrophobicContact CD1-CD2 4.18Å; L54-L62 HydrophobicContact CD2-CD2 3.86Å; L54-C65 HydrophobicContact CD2-CB 3.79Å; L54-F67 HydrophobicContact CD1-CD2 3.91Å; L54-F67 HydrophobicContact CD1-CE2 4.16Å; L54-V107 HydrophobicContact CD1-CG2 4.21Å; L54-M136 HydrophobicContact CB-CE 3.8Å
55	S	87.6	Confident	81.1	Confident	59 Å²	59	71.6 Å²	71.6	41%	0.413	38%	0.381	S	S	.	.			trans	-124.9	130.1	177.7	-65.5	0	0	0	0	110.9	W139	S55-W139 WeakPolarHBondContact O-CH2 3.33Å; S55-W139 WeakPolarHBondContact O-CZ3 3.49Å
56	V	85.2	Confident	81.5	Confident	50 Å²	50	71.8 Å²	71.8	30%	0.303	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	140.9	178.4	-178.4	0	0	0	0	110.6	H58 R135 M136 W139	V56-H58 VanDerWaalsContact C-N 3.31Å; V56-H58 PolarHBondContact O-N 2.97Å; V56-H58 PolarHBondContact O-ND1 3.41Å; V56-R135 HydrophobicContact CG1-CG 4.07Å; V56-M136 HydrophobicContact CG2-CB 3.98Å; V56-M136 HydrophobicContact CG2-CE 3.72Å; V56-M136 HydrophobicContact CG2-SD 3.99Å; V56-W139 HydrophobicContact CG1-CB 3.84Å; V56-W139 HydrophobicContact CG1-CD2 4.16Å; V56-W139 HydrophobicContact CG1-CG 3.87Å
57	G	77.8	Confident	82	Confident	53 Å²	53	69.1 Å²	69.1	55%	0.546	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	-2.8	174.2	0	0	0	0	0	115
58	H	74.1	Confident	82.6	Confident	122 Å²	122	69.4 Å²	69.4	57%	0.565	38%	0.378	S	S	*	.			trans	-126.1	112.4	177.2	-61.2	83.6	0	0	0	109.1	V56 Q60 P61 W139	V56-H58 VanDerWaalsContact C-N 3.31Å; V56-H58 PolarHBondContact O-N 2.97Å; V56-H58 PolarHBondContact O-ND1 3.41Å; H58-Q60 VanDerWaalsContact C-N 3.32Å; H58-P61 HydrophobicContact CB-CG 4.07Å; H58-P61 WeakPolarHBondContact O-CD 3.28Å; H58-W139 VanDerWaalsContact C-CZ2 3.48Å; H58-W139 WeakPolarHBondContact O-CH2 3.36Å; H58-W139 VanDerWaalsContact O-CZ2 3.25Å; H58-W139 WeakPolarHBondContact O-CZ2 3.35Å
59	S	72.9	Confident	83	Confident	57 Å²	57	64 Å²	64	40%	0.399	35%	0.353	S	S	.	.	S	Bend	trans	-72.1	-25.7	-179.4	51	0	0	0	0	113.1	L62 E63	S59-L62 WeakPolarHBondContact O-CB 3.42Å; S59-L62 PolarHBondContact O-N 3.41Å; S59-E63 PolarHBondContact O-N 3.35Å
60	Q	70.7	Confident	83.1	Confident	115 Å²	115	65 Å²	65	54%	0.537	37%	0.365	S	S	.	.	H	α-helix	trans	-53.6	-51.1	179.5	-65	-73.8	-79.8	0	0	112.4	H58 L62 E63 D64	H58-Q60 VanDerWaalsContact C-N 3.32Å; Q60-L62 PolarHBondContact O-N 3.38Å; Q60-L62 VanDerWaalsContact O-N 3.11Å; Q60-E63 PolarHBondContact O-N 3.11Å; Q60-D64 VanDerWaalsContact O-CG 3.25Å; Q60-D64 PolarHBondContact O-N 2.89Å
61	P	74.4	Confident	83.4	Confident	28 Å²	28	58 Å²	58	18%	0.182	34%	0.335	C	S	.	.	H	α-helix	trans	-53.1	-30.5	171.9	-29.9	30.5	0	0	0	116.2	H58 C65	H58-P61 HydrophobicContact CB-CG 4.07Å; H58-P61 WeakPolarHBondContact O-CD 3.28Å; P61-C65 WeakPolarHBondContact O-CB 3.4Å; P61-C65 PolarHBondContact O-N 3.15Å; P61-C65 PolarHBondContact O-SG 2.96Å
62	L	79.1	Confident	83.4	Confident	12 Å²	12	60.2 Å²	60.2	6%	0.063	34%	0.342	C	S	.	.	H	α-helix	trans	-70.9	-42.1	176.9	-74.2	164.9	0	0	0	111.2	L54 S59 Q60 S66 F67 W139 L140 L143	L54-L62 HydrophobicContact CD1-CD2 4.18Å; L54-L62 HydrophobicContact CD2-CD2 3.86Å; S59-L62 WeakPolarHBondContact O-CB 3.42Å; S59-L62 PolarHBondContact O-N 3.41Å; Q60-L62 PolarHBondContact O-N 3.38Å; Q60-L62 VanDerWaalsContact O-N 3.11Å; L62-S66 PolarHBondContact O-N 3.44Å; L62-F67 HydrophobicContact CB-CB 4.26Å; L62-F67 HydrophobicContact CD2-CB 3.71Å; L62-F67 HydrophobicContact CD2-CD1 3.71Å; L62-F67 HydrophobicContact CD2-CD2 4.13Å; L62-F67 HydrophobicContact CD2-CE1 4.36Å; L62-F67 HydrophobicContact CD2-CG 3.57Å; L62-F67 WeakPolarHBondContact O-CB 3.17Å; L62-F67 PolarHBondContact O-N 3.28Å; L62-W139 HydrophobicContact CD1-CH2 3.26Å; L62-W139 HydrophobicContact CD1-CZ2 3.86Å; L62-W139 HydrophobicContact CD1-CZ3 3.64Å; L62-W139 HydrophobicContact CD2-CH2 4.48Å; L62-W139 HydrophobicContact CD2-CZ3 4.31Å; L62-W139 HydrophobicContact CG-CH2 3.67Å; L62-W139 HydrophobicContact CG-CZ3 3.99Å; L62-L140 HydrophobicContact CD1-CD2 4.08Å; L62-L140 HydrophobicContact CD2-CD2 3.83Å; L62-L143 HydrophobicContact CD1-CD1 3.39Å
63	E	79.3	Confident	83.2	Confident	117 Å²	117	58.9 Å²	58.9	55%	0.547	33%	0.332	S	S	.	.	H	α-helix	trans	-68.5	-45.8	178.3	-65.1	179.5	172.4	0	0	110.8	S59 Q60 C65 S66	S59-E63 PolarHBondContact O-N 3.35Å; Q60-E63 PolarHBondContact O-N 3.11Å; E63-C65 VanDerWaalsContact C-N 3.3Å; E63-C65 PolarHBondContact O-N 3.12Å; E63-S66 WeakPolarHBondContact O-CA 3.23Å; E63-S66 PolarHBondContact O-N 2.75Å
64	D	83.8	Confident	83	Confident	119 Å²	119	55.7 Å²	55.7	64%	0.636	32%	0.32	S	S	*	.	H	α-helix	trans	-60.8	-40.2	178.1	-65.7	-25.4	0	0	0	111.6	Q60 S66	Q60-D64 VanDerWaalsContact O-CG 3.25Å; Q60-D64 PolarHBondContact O-N 2.89Å; D64-S66 PolarHBondContact O-N 2.96Å
65	C	86.6	Confident	82.9	Confident	5 Å²	5	55.5 Å²	55.5	3%	0.034	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-0.3	176.1	-63.8	0	0	0	0	113.6	L41 C52 L54 P61 E63 F67	L41-C65 HydrophobicContact CD2-CB 3.8Å; L41-C65 VanDerWaalsContact CD2-O 3.25Å; L41-C65 WeakPolarHBondContact CD2-O 3.49Å; C52-C65 HydrophobicContact CB-CB 3.57Å; C52-C65 WeakPolarHBondContact CB-SG 3.31Å; C52-C65 WeakPolarHBondContact SG-CA 3.32Å; C52-C65 WeakPolarHBondContact SG-CB 3.42Å; C52-C65 CovalentContact SG-SG 2.01Å; C52-C65 PolarHBondContact SG-SG 2.88Å; L54-C65 HydrophobicContact CD2-CB 3.79Å; P61-C65 WeakPolarHBondContact O-CB 3.4Å; P61-C65 PolarHBondContact O-N 3.15Å; P61-C65 PolarHBondContact O-SG 2.96Å; E63-C65 VanDerWaalsContact C-N 3.3Å; E63-C65 PolarHBondContact O-N 3.12Å; C65-F67 PolarHBondContact O-N 3.02Å
66	S	88.1	Confident	82.9	Confident	101 Å²	101	52.7 Å²	52.7	71%	0.706	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	37	-174.6	-57.4	0	0	0	0	112.9	L62 E63 D64 N68	L62-S66 PolarHBondContact O-N 3.44Å; E63-S66 WeakPolarHBondContact O-CA 3.23Å; E63-S66 PolarHBondContact O-N 2.75Å; D64-S66 PolarHBondContact O-N 2.96Å; S66-N68 PolarHBondContact O-N 3.04Å
67	F	88.6	Confident	83	Confident	21 Å²	21	50.5 Å²	50.5	9%	0.092	29%	0.286	C	S	.	.			trans	-67.3	122.9	178.8	-174.7	-87.9	0	0	0	110.4	L41 L54 L62 C65 M69 T73 N105 V107 L140	L41-F67 HydrophobicContact CD1-CD2 4.03Å; L41-F67 HydrophobicContact CD1-CE2 4.44Å; L41-F67 HydrophobicContact CD2-CB 4.18Å; L41-F67 HydrophobicContact CD2-CD2 4.08Å; L54-F67 HydrophobicContact CD1-CD2 3.91Å; L54-F67 HydrophobicContact CD1-CE2 4.16Å; L62-F67 HydrophobicContact CB-CB 4.26Å; L62-F67 HydrophobicContact CD2-CB 3.71Å; L62-F67 HydrophobicContact CD2-CD1 3.71Å; L62-F67 HydrophobicContact CD2-CD2 4.13Å; L62-F67 HydrophobicContact CD2-CE1 4.36Å; L62-F67 HydrophobicContact CD2-CG 3.57Å; L62-F67 WeakPolarHBondContact O-CB 3.17Å; L62-F67 PolarHBondContact O-N 3.28Å; C65-F67 PolarHBondContact O-N 3.02Å; F67-M69 HydrophobicContact CD1-CG 4.3Å; F67-M69 HydrophobicContact CD1-SD 3.83Å; F67-M69 HydrophobicContact CE1-CG 4.5Å; F67-M69 HydrophobicContact CE1-SD 3.64Å; F67-M69 PolarHBondContact O-N 3.37Å; F67-T73 HydrophobicContact CE2-CG2 3.98Å; F67-T73 HydrophobicContact CZ-CG2 3.94Å; F67-T73 WeakPolarHBondContact CZ-OG1 3.38Å; F67-N105 HydrophobicContact CD2-CB 4.02Å; F67-N105 HydrophobicContact CE2-CB 3.61Å; F67-N105 HydrophobicContact CZ-CB 4.22Å; F67-N105 WeakPolarHBondContact CZ-ND2 3.31Å; F67-V107 HydrophobicContact CE2-CG2 4.22Å; F67-L140 HydrophobicContact CE1-CD2 4.1Å; F67-L140 HydrophobicContact CZ-CD1 4.28Å; F67-L140 HydrophobicContact CZ-CD2 4.28Å
68	N	87	Confident	83.6	Confident	63 Å²	63	48.5 Å²	48.5	34%	0.337	26%	0.262	S	S	.	.			trans	-91.3	103.4	-178.1	-175.2	-10.8	0	0	0	111.2	S66 T70 A71 N105	S66-N68 PolarHBondContact O-N 3.04Å; N68-T70 PolarHBondContact O-N 3.03Å; N68-T70 VanDerWaalsContact O-N 3.15Å; N68-T70 PolarHBondContact OD1-N 2.94Å; N68-T70 PolarHBondContact OD1-OG1 3.32Å; N68-A71 HydrophobicContact CB-CB 3.67Å; N68-A71 WeakPolarHBondContact O-CB 3.42Å; N68-A71 PolarHBondContact O-N 3.47Å; N68-A71 VanDerWaalsContact O-N 3.11Å; N68-A71 PolarHBondContact OD1-N 2.85Å; N68-N105 PolarHBondContact N-OD1 3.37Å; N68-N105 PolarHBondContact O-ND2 3Å
69	M	85.1	Confident	84	Confident	50 Å²	50	43.7 Å²	43.7	25%	0.246	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.7	179.2	-71.4	-65.2	-66.7	0	0	114.5	F67 L140 L143	F67-M69 HydrophobicContact CD1-CG 4.3Å; F67-M69 HydrophobicContact CD1-SD 3.83Å; F67-M69 HydrophobicContact CE1-CG 4.5Å; F67-M69 HydrophobicContact CE1-SD 3.64Å; F67-M69 PolarHBondContact O-N 3.37Å; M69-L140 WeakPolarHBondContact CE-O 3.4Å; M69-L140 HydrophobicContact SD-CD2 4.3Å; M69-L143 HydrophobicContact CE-CB 4.02Å
70	T	83.9	Confident	84.7	Confident	107 Å²	107	44.8 Å²	44.8	66%	0.656	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-11.7	179.8	67.5	0	0	0	0	112.9	N68 K183	N68-T70 PolarHBondContact O-N 3.03Å; N68-T70 VanDerWaalsContact O-N 3.15Å; N68-T70 PolarHBondContact OD1-N 2.94Å; N68-T70 PolarHBondContact OD1-OG1 3.32Å; T70-K183 WeakPolarHBondContact O-CE 3.36Å; T70-K183 PolarHBondContact O-NZ 3.38Å
71	A	87	Confident	85.4	Confident	12 Å²	12	39.7 Å²	39.7	10%	0.099	22%	0.218	C	C	.	.	S	Bend	trans	-81.1	164.2	180	0	0	0	0	0	113	N68 D103 K183	N68-A71 HydrophobicContact CB-CB 3.67Å; N68-A71 WeakPolarHBondContact O-CB 3.42Å; N68-A71 PolarHBondContact O-N 3.47Å; N68-A71 VanDerWaalsContact O-N 3.11Å; N68-A71 PolarHBondContact OD1-N 2.85Å; A71-D103 WeakPolarHBondContact CB-O 3.31Å; A71-K183 VanDerWaalsContact C-CE 3.42Å
72	K	86.2	Confident	85.9	Confident	55 Å²	55	45.5 Å²	45.5	24%	0.239	25%	0.245	C	C	.	.			trans	-64.3	140.5	167.3	-73.1	-178.2	173.7	-160.3	0	108.9	F74 E101 A104 N105 E181 K183	K72-F74 HydrophobicContact CB-CE2 4.1Å; K72-F74 HydrophobicContact CB-CZ 4.45Å; K72-F74 HydrophobicContact CD-CZ 4.29Å; K72-E101 IonicContact NZ-OE1 2.88Å; K72-E101 PolarHBondContact NZ-OE1 3.01Å; K72-A104 HydrophobicContact CB-CB 3.91Å; K72-A104 CarbonylContact O-C 3.56Å; K72-A104 WeakPolarHBondContact O-CA 3.36Å; K72-A104 WeakPolarHBondContact O-CB 3.39Å; K72-N105 PolarHBondContact O-N 3.23Å; K72-E181 WeakPolarHBondContact CD-OE1 3.23Å; K72-E181 VanDerWaalsContact CE-OE1 3.23Å; K72-E181 WeakPolarHBondContact CE-OE1 3.43Å; K72-E181 IonicContact NZ-OE1 3.02Å; K72-E181 PolarHBondContact NZ-OE1 2.8Å; K72-K183 HydrophobicContact CB-CD 4.38Å; K72-K183 HydrophobicContact CB-CG 4.38Å; K72-K183 HydrophobicContact CD-CD 4.41Å; K72-K183 HydrophobicContact CG-CB 3.91Å; K72-K183 HydrophobicContact CG-CD 3.35Å; K72-K183 HydrophobicContact CG-CG 3.67Å
73	T	87.2	Confident	86.2	Confident	9 Å²	9	48.2 Å²	48.2	6%	0.055	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	125.5	173.8	-56.7	0	0	0	0	109.7	F67 F75 N105 V107 I182	F67-T73 HydrophobicContact CE2-CG2 3.98Å; F67-T73 HydrophobicContact CZ-CG2 3.94Å; F67-T73 WeakPolarHBondContact CZ-OG1 3.38Å; T73-F75 HydrophobicContact CG2-CD2 3.82Å; T73-F75 HydrophobicContact CG2-CE2 3.4Å; T73-F75 VanDerWaalsContact CG2-CE2 3.4Å; T73-F75 HydrophobicContact CG2-CZ 4.35Å; T73-N105 CarbonylContact C-O 3.58Å; T73-N105 WeakPolarHBondContact CA-O 3.39Å; T73-N105 HydrophobicContact CG2-CB 3.91Å; T73-N105 PolarHBondContact OG1-ND2 3.33Å; T73-V107 HydrophobicContact CG2-CG2 4.08Å; T73-I182 HydrophobicContact CG2-CD1 4.14Å; T73-I182 PolarHBondContact O-N 3Å
74	F	87.6	Confident	86.5	Confident	10 Å²	10	43.8 Å²	43.8	4%	0.044	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.2	176.2	-64.4	-77.1	0	0	0	109.8	K72 L97 E101 A104 N105 V107 I179 F180 E181	K72-F74 HydrophobicContact CB-CE2 4.1Å; K72-F74 HydrophobicContact CB-CZ 4.45Å; K72-F74 HydrophobicContact CD-CZ 4.29Å; F74-L97 HydrophobicContact CB-CD1 4.12Å; F74-L97 HydrophobicContact CD1-CD2 4.16Å; F74-L97 HydrophobicContact CD2-CD2 4.18Å; F74-L97 HydrophobicContact CE1-CD2 4.27Å; F74-L97 HydrophobicContact CE2-CD2 4.29Å; F74-L97 HydrophobicContact CG-CD1 4.32Å; F74-L97 HydrophobicContact CG-CD2 4.11Å; F74-L97 HydrophobicContact CZ-CD2 4.34Å; F74-E101 HydrophobicContact CE2-CB 3.92Å; F74-E101 HydrophobicContact CE2-CG 3.83Å; F74-E101 HydrophobicContact CZ-CG 3.94Å; F74-A104 HydrophobicContact CD2-CB 3.78Å; F74-A104 HydrophobicContact CE2-CB 3.59Å; F74-N105 PolarHBondContact N-O 3.03Å; F74-V107 PolarHBondContact O-N 3.07Å; F74-I179 HydrophobicContact CD1-CG2 4.04Å; F74-F180 WeakPolarHBondContact CA-O 3.31Å; F74-E181 HydrophobicContact CD1-CB 3.98Å; F74-E181 HydrophobicContact CD1-CG 4.19Å; F74-E181 HydrophobicContact CE1-CB 3.71Å; F74-E181 HydrophobicContact CE1-CG 3.58Å; F74-E181 HydrophobicContact CZ-CG 4.11Å
75	F	88.3	Confident	86.6	Confident	1 Å²	1	43.4 Å²	43.4	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	118.6	170	-78.4	-104.9	0	0	0	109.3	F39 T73 V107 V109 M136 L137 L140 I179 F180 I182	F39-F75 HydrophobicContact CD1-CD1 4.29Å; F39-F75 AromaticContact CD1-CE1 3.75Å; F39-F75 HydrophobicContact CD1-CE1 3.75Å; F39-F75 HydrophobicContact CE1-CE1 4.07Å; T73-F75 HydrophobicContact CG2-CD2 3.82Å; T73-F75 HydrophobicContact CG2-CE2 3.4Å; T73-F75 VanDerWaalsContact CG2-CE2 3.4Å; T73-F75 HydrophobicContact CG2-CZ 4.35Å; F75-V107 CarbonylContact C-O 3.54Å; F75-V107 WeakPolarHBondContact CA-O 3.5Å; F75-V107 HydrophobicContact CD1-CB 4.06Å; F75-V107 HydrophobicContact CD1-CG1 3.93Å; F75-V107 HydrophobicContact CE1-CB 4.07Å; F75-V107 HydrophobicContact CE1-CG1 3.72Å; F75-V107 HydrophobicContact CG-CB 4.34Å; F75-V107 HydrophobicContact CZ-CB 4.31Å; F75-V107 HydrophobicContact CZ-CG1 4.29Å; F75-V107 HydrophobicContact CZ-CG2 4.34Å; F75-V109 HydrophobicContact CD1-CG2 3.76Å; F75-M136 HydrophobicContact CE1-CG 4.11Å; F75-M136 HydrophobicContact CZ-CG 4.13Å; F75-L137 HydrophobicContact CD2-CD2 4.19Å; F75-L137 HydrophobicContact CE2-CD2 3.8Å; F75-L137 HydrophobicContact CZ-CD2 4.03Å; F75-L140 HydrophobicContact CE2-CD1 4.32Å; F75-L140 HydrophobicContact CZ-CD1 3.92Å; F75-I179 WeakPolarHBondContact O-CA 3.41Å; F75-F180 HydrophobicContact CB-CB 4.43Å; F75-F180 PolarHBondContact N-O 3.24Å; F75-F180 PolarHBondContact O-N 3.4Å; F75-F180 VanDerWaalsContact O-N 3.09Å; F75-I182 HydrophobicContact CD2-CD1 3.67Å; F75-I182 HydrophobicContact CD2-CG1 4.31Å; F75-I182 HydrophobicContact CE2-CD1 3.34Å; F75-I182 HydrophobicContact CE2-CG1 4.42Å; F75-I182 HydrophobicContact CZ-CD1 4.44Å
76	I	88.8	Confident	86.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	118.1	174.1	-53.2	172	0	0	0	108.3	W89 L90 L93 V94 L97 V106 V107 V108 V109	I76-W89 HydrophobicContact CG2-CH2 4.13Å; I76-W89 HydrophobicContact CG2-CZ3 3.85Å; I76-L90 HydrophobicContact CB-CD1 4.37Å; I76-L90 HydrophobicContact CG2-CD1 3.52Å; I76-L93 HydrophobicContact CD1-CD2 3.99Å; I76-L93 HydrophobicContact CD1-CG 4.06Å; I76-L93 HydrophobicContact CG1-CD2 4.15Å; I76-L93 HydrophobicContact CG2-CD2 3.82Å; I76-V94 HydrophobicContact CD1-CG2 3.59Å; I76-L97 HydrophobicContact CD1-CD1 3.85Å; I76-L97 HydrophobicContact CG1-CD1 4.16Å; I76-V106 HydrophobicContact CD1-CG1 3.61Å; I76-V106 HydrophobicContact CG1-CG1 4.33Å; I76-V107 PolarHBondContact N-O 3.19Å; I76-V108 HydrophobicContact CD1-CG2 4.47Å; I76-V109 PolarHBondContact O-N 3.31Å
77	I	87.6	Confident	86.4	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.015	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	114.3	178.6	-54.2	160.3	0	0	0	107.7	V109 I133 M171 K178 F180	I77-V109 HydrophobicContact CG1-CB 4.08Å; I77-V109 HydrophobicContact CG1-CG2 3.82Å; I77-I133 HydrophobicContact CD1-CD1 3.66Å; I77-I133 HydrophobicContact CG1-CD1 4.07Å; I77-M171 HydrophobicContact CG2-CE 3.77Å; I77-M171 HydrophobicContact CG2-SD 4.17Å; I77-K178 HydrophobicContact CD1-CB 4.45Å; I77-K178 PolarHBondContact N-O 3.41Å; I77-F180 HydrophobicContact CD1-CD2 3.76Å; I77-F180 HydrophobicContact CD1-CE2 3.69Å
78	H	88.4	Confident	86.3	Confident	11 Å²	11	49.8 Å²	49.8	5%	0.051	27%	0.268	C	S	.	.			trans	-76	161.6	175	69.7	81.8	0	0	0	111.4	F86 W89 V109 W111	H78-F86 AromaticContact CD2-CE1 3.59Å; H78-F86 AromaticContact NE2-CE1 3.68Å; H78-W89 HydrophobicContact CB-CH2 3.92Å; H78-W89 HydrophobicContact CB-CZ2 3.78Å; H78-V109 PolarHBondContact CD2-O 2.93Å; H78-V109 PolarHBondContact NE2-O 3.44Å; H78-W111 AromaticContact CD2-CD1 3.88Å; H78-W111 AromaticContact CD2-NE1 3.98Å; H78-W111 AromaticContact CE1-CD1 3.44Å; H78-W111 VanDerWaalsContact CE1-CD1 3.44Å; H78-W111 AromaticContact CE1-CE2 3.93Å; H78-W111 AromaticContact CE1-CG 3.98Å; H78-W111 AromaticContact CE1-NE1 3.39Å; H78-W111 PolarHBondContact CE1-NE1 3.36Å; H78-W111 AromaticContact CG-NE1 3.92Å; H78-W111 AromaticContact ND1-NE1 3.55Å; H78-W111 AromaticContact NE2-CD1 3.32Å; H78-W111 VanDerWaalsContact NE2-CD1 3.32Å; H78-W111 PolarHBondContact NE2-N 3.25Å; H78-W111 AromaticContact NE2-NE1 3.67Å; H78-W111 WeakPolarHBondContact O-CZ2 3.35Å; H78-W111 PolarHBondContact O-NE1 3.23Å
79	G	84.3	Confident	86.3	Confident	21 Å²	21	49.5 Å²	49.5	22%	0.216	26%	0.262	C	S	.	.			trans	-89.5	-168.7	178.1	0	0	0	0	0	114
80	W	87.9	Confident	86.4	Confident	80 Å²	80	47.4 Å²	47.4	30%	0.303	25%	0.252	S	S	.	.			trans	-62	146.3	168.4	176.8	79.4	0	0	0	111.5	M82 A115 Q117 Y119 A122	W80-M82 HydrophobicContact CE3-CG 4.46Å; W80-M82 HydrophobicContact CH2-CB 4.4Å; W80-M82 HydrophobicContact CH2-CG 3.01Å; W80-M82 HydrophobicContact CH2-SD 3.61Å; W80-M82 HydrophobicContact CZ2-CG 3.53Å; W80-M82 HydrophobicContact CZ3-CG 3.53Å; W80-M82 HydrophobicContact CZ3-SD 4.11Å; W80-A115 PolarHBondContact NE1-O 2.72Å; W80-Q117 PolarHBondContact NE1-O 2.97Å; W80-Y119 HydrophobicContact CD2-CD2 4.15Å; W80-Y119 HydrophobicContact CG-CD2 4.17Å; W80-A122 HydrophobicContact CG-CB 4.35Å
81	T	83.8	Confident	86.7	Confident	9 Å²	9	44.5 Å²	44.5	6%	0.055	23%	0.231	C	C	.	.			trans	-145.5	136.8	177.6	175.2	0	0	0	0	112.7	S83 L112 A115 H116	T81-S83 PolarHBondContact OG1-N 3.17Å; T81-S83 VanDerWaalsContact OG1-N 3.11Å; T81-S83 PolarHBondContact OG1-OG 2.86Å; T81-L112 HydrophobicContact CG2-CD1 3.4Å; T81-A115 PolarHBondContact N-O 3.09Å; T81-H116 PolarHBondContact O-ND1 2.88Å
82	M	84.4	Confident	86.8	Confident	149 Å²	149	50.5 Å²	50.5	73%	0.734	26%	0.255	S	S	*	.	S	Bend	trans	-80.8	-21.8	171.7	-64	-179.2	73.3	0	0	113.2	W80 H116	W80-M82 HydrophobicContact CE3-CG 4.46Å; W80-M82 HydrophobicContact CH2-CB 4.4Å; W80-M82 HydrophobicContact CH2-CG 3.01Å; W80-M82 HydrophobicContact CH2-SD 3.61Å; W80-M82 HydrophobicContact CZ2-CG 3.53Å; W80-M82 HydrophobicContact CZ3-CG 3.53Å; W80-M82 HydrophobicContact CZ3-SD 4.11Å; M82-H116 PolarHBondContact O-CE1 3.02Å; M82-H116 PolarHBondContact O-ND1 3.3Å
83	S	86	Confident	86.9	Confident	70 Å²	70	49.5 Å²	49.5	49%	0.49	25%	0.252	S	S	.	.	S	Bend	trans	-85.9	-17.1	-173.4	61.3	0	0	0	0	112.8	T81 I85	T81-S83 PolarHBondContact OG1-N 3.17Å; T81-S83 VanDerWaalsContact OG1-N 3.11Å; T81-S83 PolarHBondContact OG1-OG 2.86Å; S83-I85 PolarHBondContact O-N 3.35Å; S83-I85 VanDerWaalsContact OG-CG1 3.23Å; S83-I85 WeakPolarHBondContact OG-CG1 3.2Å
84	G	85.2	Confident	87	Confident	23 Å²	23	49.2 Å²	49.2	24%	0.237	25%	0.25	C	S	.	.	S	Bend	trans	65.8	18.8	-176.8	0	0	0	0	0	113.2	L112 H116	G84-L112 VanDerWaalsContact O-CD2 3.31Å; G84-L112 WeakPolarHBondContact O-CD2 3.49Å; G84-H116 VanDerWaalsContact CA-CG 3.49Å; G84-H116 PolarHBondContact N-ND1 3.18Å
85	I	86.7	Confident	87.2	Confident	111 Å²	111	50.8 Å²	50.8	57%	0.569	26%	0.262	S	S	*	.	S	Bend	trans	-127.7	157.8	174.8	59.6	169.2	0	0	0	110.3	S83	S83-I85 PolarHBondContact O-N 3.35Å; S83-I85 VanDerWaalsContact OG-CG1 3.23Å; S83-I85 WeakPolarHBondContact OG-CG1 3.2Å
86	F	86.3	Confident	87.3	Confident	58 Å²	58	53.3 Å²	53.3	25%	0.254	28%	0.284	S	S	.	.			trans	-66.7	137.2	171.4	-64.1	-58.6	0	0	0	110.8	H78 L90 D110 L112	H78-F86 AromaticContact CD2-CE1 3.59Å; H78-F86 AromaticContact NE2-CE1 3.68Å; F86-L90 HydrophobicContact CB-CD2 3.76Å; F86-L90 HydrophobicContact CD1-CD2 3.59Å; F86-L90 HydrophobicContact CD2-CD2 4.35Å; F86-L90 HydrophobicContact CE1-CD2 4.27Å; F86-L90 HydrophobicContact CG-CD2 3.64Å; F86-D110 HydrophobicContact CZ-CB 4.03Å; F86-L112 HydrophobicContact CE1-CB 4.43Å; F86-L112 HydrophobicContact CE1-CD2 4.4Å; F86-L112 HydrophobicContact CE2-CD2 4.47Å; F86-L112 HydrophobicContact CZ-CD2 4.29Å
87	E	83.1	Confident	87.3	Confident	100 Å²	100	54.1 Å²	54.1	47%	0.467	29%	0.288	S	S	.	.			trans	-81.3	151.8	178.3	-64.1	-176.3	145.8	0	0	111.3	W89 L90	E87-W89 HydrophobicContact CB-CG 4.35Å; E87-W89 PolarHBondContact O-N 3.47Å; E87-W89 PolarHBondContact OE2-NE1 3.3Å; E87-L90 VanDerWaalsContact O-CB 3.29Å; E87-L90 WeakPolarHBondContact O-CB 3.49Å; E87-L90 PolarHBondContact O-N 2.8Å
88	N	87.2	Confident	87.4	Confident	104 Å²	104	54.9 Å²	54.9	56%	0.556	29%	0.291	S	S	*	.	H	α-helix	trans	-58.6	-24.7	-175.4	-170.6	30.1	0	0	0	114.2	L90 H91 K92	N88-L90 PolarHBondContact O-N 3.01Å; N88-H91 PolarHBondContact O-N 2.97Å; N88-K92 VanDerWaalsContact ND2-CE 3.34Å; N88-K92 WeakPolarHBondContact ND2-CE 3.46Å; N88-K92 WeakPolarHBondContact O-CG 3.49Å; N88-K92 PolarHBondContact O-N 2.78Å
89	W	87.4	Confident	87.5	Confident	56 Å²	56	58.2 Å²	58.2	21%	0.212	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-30.4	176.2	68.5	-103.3	0	0	0	112.2	I76 H78 E87 K92 L93 I177	I76-W89 HydrophobicContact CG2-CH2 4.13Å; I76-W89 HydrophobicContact CG2-CZ3 3.85Å; H78-W89 HydrophobicContact CB-CH2 3.92Å; H78-W89 HydrophobicContact CB-CZ2 3.78Å; E87-W89 HydrophobicContact CB-CG 4.35Å; E87-W89 PolarHBondContact O-N 3.47Å; E87-W89 PolarHBondContact OE2-NE1 3.3Å; W89-K92 PolarHBondContact O-N 3.49Å; W89-L93 HydrophobicContact CE3-CB 4.47Å; W89-L93 HydrophobicContact CE3-CD2 4.3Å; W89-L93 HydrophobicContact CZ3-CD2 3.99Å; W89-L93 VanDerWaalsContact O-CB 3.31Å; W89-L93 WeakPolarHBondContact O-CB 2.98Å; W89-L93 PolarHBondContact O-N 3.05Å; W89-I177 HydrophobicContact CD2-CD1 3.55Å; W89-I177 HydrophobicContact CD2-CG1 3.98Å; W89-I177 HydrophobicContact CE3-CD1 3.47Å; W89-I177 VanDerWaalsContact CE3-CD1 3.47Å; W89-I177 HydrophobicContact CE3-CG1 3.85Å; W89-I177 HydrophobicContact CE3-CG2 4.3Å; W89-I177 HydrophobicContact CG-CD1 4.06Å; W89-I177 HydrophobicContact CH2-CB 4.47Å; W89-I177 HydrophobicContact CH2-CD1 4.37Å; W89-I177 HydrophobicContact CH2-CG1 3.8Å; W89-I177 HydrophobicContact CH2-CG2 4.15Å; W89-I177 HydrophobicContact CZ2-CD1 4.4Å; W89-I177 HydrophobicContact CZ2-CG1 3.88Å; W89-I177 HydrophobicContact CZ3-CB 4.35Å; W89-I177 HydrophobicContact CZ3-CD1 3.91Å; W89-I177 HydrophobicContact CZ3-CG1 3.77Å; W89-I177 HydrophobicContact CZ3-CG2 3.73Å
90	L	87.6	Confident	87.8	Confident	6 Å²	6	67 Å²	67	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-62.7	-48.6	-178.8	-175.6	73.4	0	0	0	110.1	I76 F86 E87 N88 K92 L93 V94 V108	I76-L90 HydrophobicContact CB-CD1 4.37Å; I76-L90 HydrophobicContact CG2-CD1 3.52Å; F86-L90 HydrophobicContact CB-CD2 3.76Å; F86-L90 HydrophobicContact CD1-CD2 3.59Å; F86-L90 HydrophobicContact CD2-CD2 4.35Å; F86-L90 HydrophobicContact CE1-CD2 4.27Å; F86-L90 HydrophobicContact CG-CD2 3.64Å; E87-L90 VanDerWaalsContact O-CB 3.29Å; E87-L90 WeakPolarHBondContact O-CB 3.49Å; E87-L90 PolarHBondContact O-N 2.8Å; N88-L90 PolarHBondContact O-N 3.01Å; L90-K92 PolarHBondContact O-N 2.9Å; L90-L93 PolarHBondContact O-N 2.99Å; L90-V94 VanDerWaalsContact O-CG2 3.3Å; L90-V94 WeakPolarHBondContact O-CG2 3.36Å; L90-V94 PolarHBondContact O-N 2.77Å; L90-V108 HydrophobicContact CD1-CG1 4.19Å; L90-V108 HydrophobicContact CD1-CG2 4.19Å; L90-V108 HydrophobicContact CD2-CG1 3.96Å; L90-V108 HydrophobicContact CD2-CG2 4.44Å; L90-V108 HydrophobicContact CG-CG2 4.47Å
91	H	89.1	Confident	87.9	Confident	47 Å²	47	65.5 Å²	65.5	22%	0.218	34%	0.335	C	S	.	.	H	α-helix	trans	-64.1	-42.1	178.2	-59.2	-64.9	0	0	0	112.1	P47 N88 L93 V94 S95	P47-H91 HydrophobicContact CB-CB 3.97Å; P47-H91 WeakPolarHBondContact CB-ND1 3.35Å; N88-H91 PolarHBondContact O-N 2.97Å; H91-L93 VanDerWaalsContact C-N 3.31Å; H91-L93 PolarHBondContact O-N 2.82Å; H91-V94 PolarHBondContact O-N 3.17Å; H91-S95 WeakPolarHBondContact O-CB 3.33Å; H91-S95 PolarHBondContact O-N 3.28Å
92	K	88.8	Confident	88	Confident	137 Å²	137	73.2 Å²	73.2	60%	0.596	37%	0.368	S	S	*	.	H	α-helix	trans	-60.4	-42.1	175	-70.1	177.5	179.5	177.2	0	111.7	N88 W89 L90 A96	N88-K92 VanDerWaalsContact ND2-CE 3.34Å; N88-K92 WeakPolarHBondContact ND2-CE 3.46Å; N88-K92 WeakPolarHBondContact O-CG 3.49Å; N88-K92 PolarHBondContact O-N 2.78Å; W89-K92 PolarHBondContact O-N 3.49Å; L90-K92 PolarHBondContact O-N 2.9Å; K92-A96 WeakPolarHBondContact O-CB 3.43Å; K92-A96 PolarHBondContact O-N 3.45Å
93	L	88.8	Confident	88.2	Confident	35 Å²	35	72.6 Å²	72.6	18%	0.183	37%	0.368	C	S	.	.	H	α-helix	trans	-68.3	-45.8	179.4	178.7	60.7	0	0	0	112	I76 W89 L90 H91 S95 A96 L97 I177 I179	I76-L93 HydrophobicContact CD1-CD2 3.99Å; I76-L93 HydrophobicContact CD1-CG 4.06Å; I76-L93 HydrophobicContact CG1-CD2 4.15Å; I76-L93 HydrophobicContact CG2-CD2 3.82Å; W89-L93 HydrophobicContact CE3-CB 4.47Å; W89-L93 HydrophobicContact CE3-CD2 4.3Å; W89-L93 HydrophobicContact CZ3-CD2 3.99Å; W89-L93 VanDerWaalsContact O-CB 3.31Å; W89-L93 WeakPolarHBondContact O-CB 2.98Å; W89-L93 PolarHBondContact O-N 3.05Å; L90-L93 PolarHBondContact O-N 2.99Å; H91-L93 VanDerWaalsContact C-N 3.31Å; H91-L93 PolarHBondContact O-N 2.82Å; L93-S95 VanDerWaalsContact C-N 3.32Å; L93-S95 PolarHBondContact O-N 2.79Å; L93-A96 PolarHBondContact O-N 3.46Å; L93-L97 HydrophobicContact CD1-CD1 4.2Å; L93-L97 HydrophobicContact CD1-CG 4.23Å; L93-L97 HydrophobicContact CG-CD1 4.11Å; L93-L97 WeakPolarHBondContact O-CG 3.48Å; L93-L97 PolarHBondContact O-N 3.2Å; L93-I177 HydrophobicContact CD2-CG2 4.1Å; L93-I179 HydrophobicContact CD1-CD1 3.68Å; L93-I179 HydrophobicContact CD2-CD1 3.62Å; L93-I179 HydrophobicContact CD2-CG1 3.92Å; L93-I179 HydrophobicContact CG-CD1 4.21Å
94	V	90.3	Very high	88.2	Confident	3 Å²	3	69.7 Å²	69.7	2%	0.018	35%	0.348	C	S	.	.	H	α-helix	trans	-56.7	-48	175	168.7	0	0	0	0	110.4	R42 I76 L90 H91 A96 L97 H98 V106 V108	R42-V94 HydrophobicContact CB-CG1 3.8Å; R42-V94 HydrophobicContact CG-CG1 3.93Å; R42-V94 HydrophobicContact CG-CG2 4.09Å; I76-V94 HydrophobicContact CD1-CG2 3.59Å; L90-V94 VanDerWaalsContact O-CG2 3.3Å; L90-V94 WeakPolarHBondContact O-CG2 3.36Å; L90-V94 PolarHBondContact O-N 2.77Å; H91-V94 PolarHBondContact O-N 3.17Å; V94-A96 PolarHBondContact O-N 3.42Å; V94-L97 PolarHBondContact O-N 3.07Å; V94-H98 PolarHBondContact O-CD2 3.38Å; V94-H98 VanDerWaalsContact O-CD2 3.27Å; V94-H98 PolarHBondContact O-N 3.06Å; V94-V106 HydrophobicContact CB-CG1 4.47Å; V94-V106 HydrophobicContact CG1-CG1 4.33Å; V94-V106 HydrophobicContact CG2-CG1 4.01Å; V94-V108 HydrophobicContact CG2-CG2 4.06Å
95	S	90.8	Very high	88.5	Confident	42 Å²	42	69 Å²	69	29%	0.294	34%	0.339	S	S	.	.	H	α-helix	trans	-62.4	-40.9	178	-176	0	0	0	0	112.6	H91 L93 T99	H91-S95 WeakPolarHBondContact O-CB 3.33Å; H91-S95 PolarHBondContact O-N 3.28Å; L93-S95 VanDerWaalsContact C-N 3.32Å; L93-S95 PolarHBondContact O-N 2.79Å; S95-T99 WeakPolarHBondContact O-CB 3.17Å; S95-T99 PolarHBondContact O-N 2.9Å; S95-T99 PolarHBondContact O-OG1 3.13Å
96	A	90.6	Very high	88.7	Confident	55 Å²	55	63.8 Å²	63.8	46%	0.455	31%	0.312	S	S	.	.	H	α-helix	trans	-64.3	-43.1	176	0	0	0	0	0	112.1	K92 L93 V94 T99 R100	K92-A96 WeakPolarHBondContact O-CB 3.43Å; K92-A96 PolarHBondContact O-N 3.45Å; L93-A96 PolarHBondContact O-N 3.46Å; V94-A96 PolarHBondContact O-N 3.42Å; A96-T99 PolarHBondContact O-N 3.05Å; A96-R100 WeakPolarHBondContact O-CB 3.33Å; A96-R100 PolarHBondContact O-N 2.88Å
97	L	88.9	Confident	89.1	Confident	17 Å²	17	61 Å²	61	9%	0.089	30%	0.3	C	S	.	.	H	α-helix	trans	-64.1	-49	177.6	-75.3	169.9	0	0	0	111.6	F74 I76 L93 V94 T99 R100 E101 V106	F74-L97 HydrophobicContact CB-CD1 4.12Å; F74-L97 HydrophobicContact CD1-CD2 4.16Å; F74-L97 HydrophobicContact CD2-CD2 4.18Å; F74-L97 HydrophobicContact CE1-CD2 4.27Å; F74-L97 HydrophobicContact CE2-CD2 4.29Å; F74-L97 HydrophobicContact CG-CD1 4.32Å; F74-L97 HydrophobicContact CG-CD2 4.11Å; F74-L97 HydrophobicContact CZ-CD2 4.34Å; I76-L97 HydrophobicContact CD1-CD1 3.85Å; I76-L97 HydrophobicContact CG1-CD1 4.16Å; L93-L97 HydrophobicContact CD1-CD1 4.2Å; L93-L97 HydrophobicContact CD1-CG 4.23Å; L93-L97 HydrophobicContact CG-CD1 4.11Å; L93-L97 WeakPolarHBondContact O-CG 3.48Å; L93-L97 PolarHBondContact O-N 3.2Å; V94-L97 PolarHBondContact O-N 3.07Å; L97-T99 PolarHBondContact O-N 3.32Å; L97-R100 PolarHBondContact O-N 3.38Å; L97-R100 VanDerWaalsContact O-N 3.15Å; L97-E101 PolarHBondContact O-N 3.3Å; L97-V106 HydrophobicContact CB-CG2 3.94Å; L97-V106 HydrophobicContact CD1-CG1 4.2Å; L97-V106 HydrophobicContact CD1-CG2 4.49Å
98	H	89.8	Confident	89.5	Confident	19 Å²	19	56.4 Å²	56.4	9%	0.088	28%	0.278	C	S	.	.	H	α-helix	trans	-62.5	-23.6	174.6	-75.4	-54.5	0	0	0	113.5	R42 K45 V94	R42-H98 PolarHBondContact O-CE1 2.88Å; R42-H98 PolarHBondContact O-NE2 2.92Å; K45-H98 HydrophobicContact CD-CB 4.3Å; K45-H98 HydrophobicContact CG-CB 3.75Å; V94-H98 PolarHBondContact O-CD2 3.38Å; V94-H98 VanDerWaalsContact O-CD2 3.27Å; V94-H98 PolarHBondContact O-N 3.06Å
99	T	90.9	Very high	89.8	Confident	80 Å²	80	51.4 Å²	51.4	49%	0.491	25%	0.252	S	S	.	.	H	α-helix	trans	-78.8	-39.4	175.7	-60.7	0	0	0	0	111.7	K45 S95 A96 L97	K45-T99 WeakPolarHBondContact CE-OG1 2.81Å; K45-T99 PolarHBondContact NZ-OG1 3.05Å; S95-T99 WeakPolarHBondContact O-CB 3.17Å; S95-T99 PolarHBondContact O-N 2.9Å; S95-T99 PolarHBondContact O-OG1 3.13Å; A96-T99 PolarHBondContact O-N 3.05Å; L97-T99 PolarHBondContact O-N 3.32Å
100	R	90.3	Very high	90.1	Very high	207 Å²	207	48.9 Å²	48.9	78%	0.781	24%	0.242	S	C	*	.	H	α-helix	trans	-79.9	-39.7	-179.3	-173.1	-178.3	170.2	-176.6	-3.7	112.7	A96 L97	A96-R100 WeakPolarHBondContact O-CB 3.33Å; A96-R100 PolarHBondContact O-N 2.88Å; L97-R100 PolarHBondContact O-N 3.38Å; L97-R100 VanDerWaalsContact O-N 3.15Å
101	E	89.3	Confident	90.3	Very high	48 Å²	48	48.8 Å²	48.8	22%	0.224	24%	0.242	C	C	.	.			trans	-129	80.3	-171.2	-63.7	-78.5	-170.5	0	0	108.5	K72 F74 L97 D103 A104	K72-E101 IonicContact NZ-OE1 2.88Å; K72-E101 PolarHBondContact NZ-OE1 3.01Å; F74-E101 HydrophobicContact CE2-CB 3.92Å; F74-E101 HydrophobicContact CE2-CG 3.83Å; F74-E101 HydrophobicContact CZ-CG 3.94Å; L97-E101 PolarHBondContact O-N 3.3Å; E101-D103 VanDerWaalsContact C-N 3.28Å; E101-D103 PolarHBondContact O-N 3.11Å; E101-A104 HydrophobicContact CB-CB 3.66Å; E101-A104 WeakPolarHBondContact O-CB 3.18Å; E101-A104 PolarHBondContact O-N 2.98Å; E101-A104 VanDerWaalsContact O-N 3.17Å
102	K	87.5	Confident	90.5	Very high	171 Å²	171	47.9 Å²	47.9	74%	0.743	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-35.3	-169.2	-67.9	-177.3	-178.6	176.3	0	113.9
103	D	87	Confident	90.7	Very high	135 Å²	135	44 Å²	44	72%	0.722	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	0.6	-176.1	-53.5	-45.7	0	0	0	112.3	A71 E101	A71-D103 WeakPolarHBondContact CB-O 3.31Å; E101-D103 VanDerWaalsContact C-N 3.28Å; E101-D103 PolarHBondContact O-N 3.11Å
104	A	87.5	Confident	90.8	Very high	9 Å²	9	43.1 Å²	43.1	7%	0.074	22%	0.222	C	C	.	.			trans	-79.2	142.3	-176.2	0	0	0	0	0	112.9	K72 F74 E101	K72-A104 HydrophobicContact CB-CB 3.91Å; K72-A104 CarbonylContact O-C 3.56Å; K72-A104 WeakPolarHBondContact O-CA 3.36Å; K72-A104 WeakPolarHBondContact O-CB 3.39Å; F74-A104 HydrophobicContact CD2-CB 3.78Å; F74-A104 HydrophobicContact CE2-CB 3.59Å; E101-A104 HydrophobicContact CB-CB 3.66Å; E101-A104 WeakPolarHBondContact O-CB 3.18Å; E101-A104 PolarHBondContact O-N 2.98Å; E101-A104 VanDerWaalsContact O-N 3.17Å
105	N	90.2	Very high	90.8	Very high	10 Å²	10	43 Å²	43	5%	0.053	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	125.7	167.4	-53	-52.6	0	0	0	108.8	L41 F67 N68 K72 T73 F74	L41-N105 HydrophobicContact CD1-CB 3.77Å; F67-N105 HydrophobicContact CD2-CB 4.02Å; F67-N105 HydrophobicContact CE2-CB 3.61Å; F67-N105 HydrophobicContact CZ-CB 4.22Å; F67-N105 WeakPolarHBondContact CZ-ND2 3.31Å; N68-N105 PolarHBondContact N-OD1 3.37Å; N68-N105 PolarHBondContact O-ND2 3Å; K72-N105 PolarHBondContact O-N 3.23Å; T73-N105 CarbonylContact C-O 3.58Å; T73-N105 WeakPolarHBondContact CA-O 3.39Å; T73-N105 HydrophobicContact CG2-CB 3.91Å; T73-N105 PolarHBondContact OG1-ND2 3.33Å; F74-N105 PolarHBondContact N-O 3.03Å
106	V	92.4	Very high	90.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	108.3	174.8	-179.4	0	0	0	0	108.2	R42 I76 V94 L97	R42-V106 HydrophobicContact CB-CB 4.34Å; R42-V106 HydrophobicContact CB-CG1 4.48Å; R42-V106 PolarHBondContact N-O 2.94Å; I76-V106 HydrophobicContact CD1-CG1 3.61Å; I76-V106 HydrophobicContact CG1-CG1 4.33Å; V94-V106 HydrophobicContact CB-CG1 4.47Å; V94-V106 HydrophobicContact CG1-CG1 4.33Å; V94-V106 HydrophobicContact CG2-CG1 4.01Å; L97-V106 HydrophobicContact CB-CG2 3.94Å; L97-V106 HydrophobicContact CD1-CG1 4.2Å; L97-V106 HydrophobicContact CD1-CG2 4.49Å
107	V	92.8	Very high	90.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	117.3	-176.7	-177.1	0	0	0	0	109.5	F39 N40 L41 L54 F67 T73 F74 F75 I76	F39-V107 HydrophobicContact CB-CG1 3.98Å; F39-V107 HydrophobicContact CD1-CG1 4.34Å; N40-V107 CarbonylContact O-C 3.54Å; N40-V107 WeakPolarHBondContact O-CA 3.25Å; L41-V107 HydrophobicContact CD1-CG2 3.81Å; L54-V107 HydrophobicContact CD1-CG2 4.21Å; F67-V107 HydrophobicContact CE2-CG2 4.22Å; T73-V107 HydrophobicContact CG2-CG2 4.08Å; F74-V107 PolarHBondContact O-N 3.07Å; F75-V107 CarbonylContact C-O 3.54Å; F75-V107 WeakPolarHBondContact CA-O 3.5Å; F75-V107 HydrophobicContact CD1-CB 4.06Å; F75-V107 HydrophobicContact CD1-CG1 3.93Å; F75-V107 HydrophobicContact CE1-CB 4.07Å; F75-V107 HydrophobicContact CE1-CG1 3.72Å; F75-V107 HydrophobicContact CG-CB 4.34Å; F75-V107 HydrophobicContact CZ-CB 4.31Å; F75-V107 HydrophobicContact CZ-CG1 4.29Å; F75-V107 HydrophobicContact CZ-CG2 4.34Å; I76-V107 PolarHBondContact N-O 3.19Å
108	V	93	Very high	90.9	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.018	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	122	170	175.9	0	0	0	0	108.6	N40 R42 I76 L90 V94 D110	N40-V108 HydrophobicContact CB-CB 4.4Å; N40-V108 PolarHBondContact N-O 3.03Å; N40-V108 PolarHBondContact O-N 2.99Å; R42-V108 HydrophobicContact CG-CG2 3.78Å; I76-V108 HydrophobicContact CD1-CG2 4.47Å; L90-V108 HydrophobicContact CD1-CG1 4.19Å; L90-V108 HydrophobicContact CD1-CG2 4.19Å; L90-V108 HydrophobicContact CD2-CG1 3.96Å; L90-V108 HydrophobicContact CD2-CG2 4.44Å; L90-V108 HydrophobicContact CG-CG2 4.47Å; V94-V108 HydrophobicContact CG2-CG2 4.06Å; V108-D110 PolarHBondContact O-N 3.38Å
109	V	92.6	Very high	90.7	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	101.6	172.2	-175.6	0	0	0	0	108.1	V37 F39 F75 I76 I77 H78 W111 I133	V37-V109 HydrophobicContact CG1-CG1 3.58Å; F39-V109 HydrophobicContact CD1-CG2 4.09Å; F39-V109 HydrophobicContact CE1-CG1 4.26Å; F39-V109 HydrophobicContact CE1-CG2 4.11Å; F75-V109 HydrophobicContact CD1-CG2 3.76Å; I76-V109 PolarHBondContact O-N 3.31Å; I77-V109 HydrophobicContact CG1-CB 4.08Å; I77-V109 HydrophobicContact CG1-CG2 3.82Å; H78-V109 PolarHBondContact CD2-O 2.93Å; H78-V109 PolarHBondContact NE2-O 3.44Å; V109-W111 PolarHBondContact O-N 2.83Å; V109-I133 HydrophobicContact CG1-CD1 4.15Å; V109-I133 HydrophobicContact CG1-CG1 4.03Å; V109-I133 HydrophobicContact CG2-CG1 4.36Å
110	D	93.4	Very high	90.5	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.011	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	104.6	177.3	173.8	15	0	0	0	109.9	V37 R38 F86 V108 L112	V37-D110 CarbonylContact C-O 3.57Å; V37-D110 WeakPolarHBondContact CA-O 3.45Å; R38-D110 HydrophobicContact CB-CB 4.23Å; R38-D110 IonicContact CZ-OD2 3.18Å; R38-D110 PolarHBondContact N-O 2.95Å; R38-D110 IonicContact NE-OD2 3.02Å; R38-D110 PolarHBondContact NE-OD2 3.31Å; R38-D110 IonicContact NH2-OD2 2.64Å; R38-D110 PolarHBondContact NH2-OD2 3.43Å; R38-D110 PolarHBondContact O-N 3.44Å; F86-D110 HydrophobicContact CZ-CB 4.03Å; V108-D110 PolarHBondContact O-N 3.38Å; D110-L112 WeakPolarHBondContact OD1-CB 3.15Å; D110-L112 PolarHBondContact OD1-N 2.79Å
111	W	93.6	Very high	90.4	Very high	5 Å²	5	49.9 Å²	49.9	2%	0.019	25%	0.25	C	S	.	.			trans	-121.3	25.5	169.2	67	-68.7	0	0	0	110.3	V37 H78 V109 P113 L114 A115 A122 V129 M171	V37-W111 HydrophobicContact CG1-CB 4.43Å; V37-W111 HydrophobicContact CG2-CB 4.05Å; H78-W111 AromaticContact CD2-CD1 3.88Å; H78-W111 AromaticContact CD2-NE1 3.98Å; H78-W111 AromaticContact CE1-CD1 3.44Å; H78-W111 VanDerWaalsContact CE1-CD1 3.44Å; H78-W111 AromaticContact CE1-CE2 3.93Å; H78-W111 AromaticContact CE1-CG 3.98Å; H78-W111 AromaticContact CE1-NE1 3.39Å; H78-W111 PolarHBondContact CE1-NE1 3.36Å; H78-W111 AromaticContact CG-NE1 3.92Å; H78-W111 AromaticContact ND1-NE1 3.55Å; H78-W111 AromaticContact NE2-CD1 3.32Å; H78-W111 VanDerWaalsContact NE2-CD1 3.32Å; H78-W111 PolarHBondContact NE2-N 3.25Å; H78-W111 AromaticContact NE2-NE1 3.67Å; H78-W111 WeakPolarHBondContact O-CZ2 3.35Å; H78-W111 PolarHBondContact O-NE1 3.23Å; V109-W111 PolarHBondContact O-N 2.83Å; W111-P113 VanDerWaalsContact C-CD 3.41Å; W111-P113 VanDerWaalsContact C-N 3.33Å; W111-L114 HydrophobicContact CE3-CB 3.8Å; W111-L114 CarbonylContact O-C 3.59Å; W111-L114 WeakPolarHBondContact O-CA 3.33Å; W111-L114 WeakPolarHBondContact O-CB 3.45Å; W111-L114 PolarHBondContact O-N 3.22Å; W111-A115 HydrophobicContact CD2-CB 3.73Å; W111-A115 HydrophobicContact CE3-CB 3.6Å; W111-A115 HydrophobicContact CH2-CB 3.64Å; W111-A115 HydrophobicContact CZ2-CB 3.77Å; W111-A115 HydrophobicContact CZ3-CB 3.57Å; W111-A115 PolarHBondContact O-N 3.47Å; W111-A122 HydrophobicContact CZ3-CB 4.46Å; W111-V129 HydrophobicContact CB-CG1 4.34Å; W111-V129 HydrophobicContact CB-CG2 3.8Å; W111-V129 HydrophobicContact CD2-CG1 4.41Å; W111-V129 HydrophobicContact CD2-CG2 3.77Å; W111-V129 HydrophobicContact CE3-CG2 3.6Å; W111-V129 HydrophobicContact CG-CG1 4.11Å; W111-V129 HydrophobicContact CG-CG2 3.87Å; W111-V129 HydrophobicContact CZ3-CG2 4.46Å; W111-M171 HydrophobicContact CZ2-CE 4.06Å
112	L	92.6	Very high	90.3	Very high	27 Å²	27	47.8 Å²	47.8	14%	0.141	24%	0.241	C	C	.	.	H	α-helix	trans	-51.7	-41.4	-174.5	-172.3	62.5	0	0	0	113.7	T81 G84 F86 D110 L114 A115 H116	T81-L112 HydrophobicContact CG2-CD1 3.4Å; G84-L112 VanDerWaalsContact O-CD2 3.31Å; G84-L112 WeakPolarHBondContact O-CD2 3.49Å; F86-L112 HydrophobicContact CE1-CB 4.43Å; F86-L112 HydrophobicContact CE1-CD2 4.4Å; F86-L112 HydrophobicContact CE2-CD2 4.47Å; F86-L112 HydrophobicContact CZ-CD2 4.29Å; D110-L112 WeakPolarHBondContact OD1-CB 3.15Å; D110-L112 PolarHBondContact OD1-N 2.79Å; L112-L114 PolarHBondContact O-N 3.48Å; L112-A115 PolarHBondContact O-N 3.11Å; L112-H116 VanDerWaalsContact O-CB 3.29Å; L112-H116 WeakPolarHBondContact O-CB 3.15Å; L112-H116 PolarHBondContact O-N 3.06Å
113	P	92.6	Very high	90.1	Very high	57 Å²	57	41.7 Å²	41.7	37%	0.37	22%	0.218	S	C	.	.	H	α-helix	trans	-62.6	-28.8	175.8	-23.5	35.5	0	0	0	113.9	P35 W111 Q117	P35-P113 HydrophobicContact CB-CB 3.76Å; W111-P113 VanDerWaalsContact C-CD 3.41Å; W111-P113 VanDerWaalsContact C-N 3.33Å; P113-Q117 PolarHBondContact O-NE2 3.36Å
114	L	91.9	Very high	90.1	Very high	15 Å²	15	40.6 Å²	40.6	8%	0.079	21%	0.212	C	C	.	.	H	α-helix	trans	-88.6	-27.9	178	-63.2	175	0	0	0	112.1	P35 V37 W111 L112 Q117 N125 V129	P35-L114 HydrophobicContact CB-CD2 3.81Å; P35-L114 HydrophobicContact CB-CG 4.28Å; P35-L114 HydrophobicContact CG-CD2 3.94Å; V37-L114 HydrophobicContact CG2-CD1 3.89Å; W111-L114 HydrophobicContact CE3-CB 3.8Å; W111-L114 CarbonylContact O-C 3.59Å; W111-L114 WeakPolarHBondContact O-CA 3.33Å; W111-L114 WeakPolarHBondContact O-CB 3.45Å; W111-L114 PolarHBondContact O-N 3.22Å; L112-L114 PolarHBondContact O-N 3.48Å; L114-Q117 WeakPolarHBondContact O-CG 3.25Å; L114-N125 HydrophobicContact CB-CB 4.1Å; L114-N125 PolarHBondContact O-ND2 3.29Å; L114-N125 VanDerWaalsContact O-ND2 3.08Å; L114-V129 HydrophobicContact CD1-CG2 4.14Å
115	A	88.8	Confident	90.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-80.2	-29.2	177.7	0	0	0	0	0	112.5	W80 T81 W111 L112 Q117	W80-A115 PolarHBondContact NE1-O 2.72Å; T81-A115 PolarHBondContact N-O 3.09Å; W111-A115 HydrophobicContact CD2-CB 3.73Å; W111-A115 HydrophobicContact CE3-CB 3.6Å; W111-A115 HydrophobicContact CH2-CB 3.64Å; W111-A115 HydrophobicContact CZ2-CB 3.77Å; W111-A115 HydrophobicContact CZ3-CB 3.57Å; W111-A115 PolarHBondContact O-N 3.47Å; L112-A115 PolarHBondContact O-N 3.11Å; A115-Q117 PolarHBondContact O-N 3.2Å
116	H	92.1	Very high	89.8	Confident	87 Å²	87	41.7 Å²	41.7	40%	0.403	22%	0.217	S	C	.	.	S	Bend	trans	-90.5	48.2	177.1	-173.7	52.1	0	0	0	111.2	T81 M82 G84 L112	T81-H116 PolarHBondContact O-ND1 2.88Å; M82-H116 PolarHBondContact O-CE1 3.02Å; M82-H116 PolarHBondContact O-ND1 3.3Å; G84-H116 VanDerWaalsContact CA-CG 3.49Å; G84-H116 PolarHBondContact N-ND1 3.18Å; L112-H116 VanDerWaalsContact O-CB 3.29Å; L112-H116 WeakPolarHBondContact O-CB 3.15Å; L112-H116 PolarHBondContact O-N 3.06Å
117	Q	90.4	Very high	89.4	Confident	88 Å²	88	51.3 Å²	51.3	41%	0.411	25%	0.253	S	S	.	.	S	Bend	trans	-116.2	177.1	173.3	-61.4	-59.1	-33.5	0	0	109.1	W80 P113 L114 A115 Y119 D121	W80-Q117 PolarHBondContact NE1-O 2.97Å; P113-Q117 PolarHBondContact O-NE2 3.36Å; L114-Q117 WeakPolarHBondContact O-CG 3.25Å; A115-Q117 PolarHBondContact O-N 3.2Å; Q117-Y119 PolarHBondContact O-N 3.15Å; Q117-D121 HydrophobicContact CB-CB 3.92Å
118	L	90.6	Very high	89.1	Confident	124 Å²	124	55.1 Å²	55.1	65%	0.649	28%	0.276	S	S	*	.			trans	-52.6	142.2	167.8	-65.9	175.5	0	0	0	109.2	T120 D121 A122	L118-T120 PolarHBondContact O-N 2.94Å; L118-T120 VanDerWaalsContact O-N 3.09Å; L118-D121 WeakPolarHBondContact O-CA 3.32Å; L118-D121 WeakPolarHBondContact O-CB 3.43Å; L118-D121 PolarHBondContact O-N 3.3Å; L118-A122 PolarHBondContact O-N 3.1Å
119	Y	84.9	Confident	88.8	Confident	111 Å²	111	55 Å²	55	44%	0.435	28%	0.275	S	S	.	.	H	α-helix	trans	-52.5	-40.2	-173.7	177.9	-100.3	0	0	0	112.4	W80 Q117 D121 A122 V123	W80-Y119 HydrophobicContact CD2-CD2 4.15Å; W80-Y119 HydrophobicContact CG-CD2 4.17Å; Q117-Y119 PolarHBondContact O-N 3.15Å; Y119-D121 VanDerWaalsContact C-N 3.33Å; Y119-D121 PolarHBondContact O-N 2.96Å; Y119-A122 PolarHBondContact O-N 3.43Å; Y119-V123 HydrophobicContact CD1-CG2 4.12Å; Y119-V123 HydrophobicContact CD2-CG2 4.43Å; Y119-V123 HydrophobicContact CE1-CG2 3.67Å; Y119-V123 HydrophobicContact CE2-CG2 4.02Å; Y119-V123 HydrophobicContact CG-CG2 4.48Å; Y119-V123 WeakPolarHBondContact O-CB 3.12Å; Y119-V123 VanDerWaalsContact O-CG2 3.27Å; Y119-V123 WeakPolarHBondContact O-CG2 3.03Å; Y119-V123 PolarHBondContact O-N 2.95Å
120	T	86.5	Confident	88.4	Confident	88 Å²	88	55.1 Å²	55.1	54%	0.54	28%	0.277	S	S	.	.	H	α-helix	trans	-59.9	-40.9	175.5	49.3	0	0	0	0	112.9	L118 N124	L118-T120 PolarHBondContact O-N 2.94Å; L118-T120 VanDerWaalsContact O-N 3.09Å; T120-N124 VanDerWaalsContact O-CG 3.27Å; T120-N124 PolarHBondContact O-N 3.17Å; T120-N124 VanDerWaalsContact O-N 3.07Å; T120-N124 PolarHBondContact O-ND2 2.79Å
121	D	89.2	Confident	88.1	Confident	68 Å²	68	60.2 Å²	60.2	36%	0.364	30%	0.301	S	S	.	.	H	α-helix	trans	-73.2	-41.3	178.8	-61.7	-27.5	0	0	0	110.8	Q117 L118 Y119 V123 N124 N125	Q117-D121 HydrophobicContact CB-CB 3.92Å; L118-D121 WeakPolarHBondContact O-CA 3.32Å; L118-D121 WeakPolarHBondContact O-CB 3.43Å; L118-D121 PolarHBondContact O-N 3.3Å; Y119-D121 VanDerWaalsContact C-N 3.33Å; Y119-D121 PolarHBondContact O-N 2.96Å; D121-V123 VanDerWaalsContact C-N 3.33Å; D121-V123 PolarHBondContact O-N 3.32Å; D121-N124 PolarHBondContact O-N 3.49Å; D121-N124 VanDerWaalsContact O-N 3.15Å; D121-N125 WeakPolarHBondContact O-CB 3.41Å; D121-N125 PolarHBondContact O-N 2.74Å; D121-N125 PolarHBondContact O-ND2 2.81Å
122	A	85.9	Confident	87.9	Confident	3 Å²	3	61.5 Å²	61.5	3%	0.025	31%	0.31	C	S	.	.	H	α-helix	trans	-61.9	-40.3	175.5	0	0	0	0	0	112.2	W80 W111 L118 Y119 N125 T126	W80-A122 HydrophobicContact CG-CB 4.35Å; W111-A122 HydrophobicContact CZ3-CB 4.46Å; L118-A122 PolarHBondContact O-N 3.1Å; Y119-A122 PolarHBondContact O-N 3.43Å; A122-N125 WeakPolarHBondContact O-CB 3.25Å; A122-N125 PolarHBondContact O-N 2.83Å; A122-T126 WeakPolarHBondContact O-CG2 3.48Å; A122-T126 PolarHBondContact O-N 2.81Å
123	V	84.3	Confident	87.6	Confident	44 Å²	44	60.6 Å²	60.6	27%	0.267	31%	0.305	S	S	.	.	H	α-helix	trans	-61.6	-44	172.1	169.1	0	0	0	0	110.8	Y119 D121 N125 T126	Y119-V123 HydrophobicContact CD1-CG2 4.12Å; Y119-V123 HydrophobicContact CD2-CG2 4.43Å; Y119-V123 HydrophobicContact CE1-CG2 3.67Å; Y119-V123 HydrophobicContact CE2-CG2 4.02Å; Y119-V123 HydrophobicContact CG-CG2 4.48Å; Y119-V123 WeakPolarHBondContact O-CB 3.12Å; Y119-V123 VanDerWaalsContact O-CG2 3.27Å; Y119-V123 WeakPolarHBondContact O-CG2 3.03Å; Y119-V123 PolarHBondContact O-N 2.95Å; D121-V123 VanDerWaalsContact C-N 3.33Å; D121-V123 PolarHBondContact O-N 3.32Å; V123-N125 VanDerWaalsContact C-N 3.29Å; V123-N125 PolarHBondContact O-N 2.01Å; V123-T126 WeakPolarHBondContact O-CB 3.41Å; V123-T126 WeakPolarHBondContact O-CG2 3.35Å; V123-T126 PolarHBondContact O-N 3.26Å; V123-T126 PolarHBondContact O-OG1 3.25Å
124	N	86.1	Confident	87.2	Confident	112 Å²	112	58.1 Å²	58.1	60%	0.599	29%	0.29	S	S	*	.	H	α-helix	trans	-64.7	-35.2	176.1	-71.5	-28.1	0	0	0	112.3	T120 D121 T126 R127	T120-N124 VanDerWaalsContact O-CG 3.27Å; T120-N124 PolarHBondContact O-N 3.17Å; T120-N124 VanDerWaalsContact O-N 3.07Å; T120-N124 PolarHBondContact O-ND2 2.79Å; D121-N124 PolarHBondContact O-N 3.49Å; D121-N124 VanDerWaalsContact O-N 3.15Å; N124-T126 PolarHBondContact O-N 2.8Å; N124-R127 PolarHBondContact O-N 3.43Å
125	N	88.1	Confident	87	Confident	35 Å²	35	64.3 Å²	64.3	19%	0.187	31%	0.312	C	S	.	.	H	α-helix	trans	-67.3	-21.7	178.7	-70.1	-27.5	0	0	0	112.8	L114 D121 A122 V123 R127 V128 V129	L114-N125 HydrophobicContact CB-CB 4.1Å; L114-N125 PolarHBondContact O-ND2 3.29Å; L114-N125 VanDerWaalsContact O-ND2 3.08Å; D121-N125 WeakPolarHBondContact O-CB 3.41Å; D121-N125 PolarHBondContact O-N 2.74Å; D121-N125 PolarHBondContact O-ND2 2.81Å; A122-N125 WeakPolarHBondContact O-CB 3.25Å; A122-N125 PolarHBondContact O-N 2.83Å; V123-N125 VanDerWaalsContact C-N 3.29Å; V123-N125 PolarHBondContact O-N 2.01Å; N125-R127 PolarHBondContact O-N 3.36Å; N125-R127 VanDerWaalsContact O-N 3.1Å; N125-V128 WeakPolarHBondContact O-CB 3.43Å; N125-V128 PolarHBondContact O-N 2.87Å; N125-V129 WeakPolarHBondContact O-CG2 3.43Å; N125-V129 PolarHBondContact O-N 2.9Å
126	T	83.4	Confident	86.9	Confident	6 Å²	6	64.3 Å²	64.3	4%	0.037	31%	0.312	C	S	.	.	H	α-helix	trans	-58.8	-26.9	178.6	69.3	0	0	0	0	112.6	A122 V123 N124 V129 G130 S168 M171 N172	A122-T126 WeakPolarHBondContact O-CG2 3.48Å; A122-T126 PolarHBondContact O-N 2.81Å; V123-T126 WeakPolarHBondContact O-CB 3.41Å; V123-T126 WeakPolarHBondContact O-CG2 3.35Å; V123-T126 PolarHBondContact O-N 3.26Å; V123-T126 PolarHBondContact O-OG1 3.25Å; N124-T126 PolarHBondContact O-N 2.8Å; T126-V129 PolarHBondContact O-N 3.28Å; T126-G130 PolarHBondContact O-N 2.81Å; T126-S168 PolarHBondContact O-OG 3.35Å; T126-M171 HydrophobicContact CG2-CB 4.13Å; T126-M171 HydrophobicContact CG2-CE 4.23Å; T126-N172 PolarHBondContact OG1-OD1 2.95Å
127	R	83.8	Confident	86.6	Confident	202 Å²	202	61.6 Å²	61.6	76%	0.762	30%	0.301	S	S	*	.	H	α-helix	trans	-65.3	-44.6	173.8	-172.9	179.7	179	-157.5	-0.3	111.6	N124 N125 H131	N124-R127 PolarHBondContact O-N 3.43Å; N125-R127 PolarHBondContact O-N 3.36Å; N125-R127 VanDerWaalsContact O-N 3.1Å; R127-H131 PolarHBondContact O-N 3.12Å; R127-H131 VanDerWaalsContact O-N 3.07Å
128	V	87.4	Confident	86.3	Confident	80 Å²	80	60.4 Å²	60.4	49%	0.485	30%	0.297	S	S	.	.	H	α-helix	trans	-67.7	-41.4	177.3	-179.5	0	0	0	0	110.1	N125 H131 S132	N125-V128 WeakPolarHBondContact O-CB 3.43Å; N125-V128 PolarHBondContact O-N 2.87Å; V128-H131 PolarHBondContact O-N 3.37Å; V128-S132 PolarHBondContact O-N 3.17Å; V128-S132 PolarHBondContact O-OG 2.7Å
129	V	87.3	Confident	86.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-46.8	176.9	179.4	0	0	0	0	111.4	V37 W111 L114 N125 T126 H131 S132 I133 M171	V37-V129 HydrophobicContact CG2-CB 4.29Å; V37-V129 HydrophobicContact CG2-CG1 4.4Å; V37-V129 HydrophobicContact CG2-CG2 3.83Å; W111-V129 HydrophobicContact CB-CG1 4.34Å; W111-V129 HydrophobicContact CB-CG2 3.8Å; W111-V129 HydrophobicContact CD2-CG1 4.41Å; W111-V129 HydrophobicContact CD2-CG2 3.77Å; W111-V129 HydrophobicContact CE3-CG2 3.6Å; W111-V129 HydrophobicContact CG-CG1 4.11Å; W111-V129 HydrophobicContact CG-CG2 3.87Å; W111-V129 HydrophobicContact CZ3-CG2 4.46Å; L114-V129 HydrophobicContact CD1-CG2 4.14Å; N125-V129 WeakPolarHBondContact O-CG2 3.43Å; N125-V129 PolarHBondContact O-N 2.9Å; T126-V129 PolarHBondContact O-N 3.28Å; V129-H131 VanDerWaalsContact C-N 3.31Å; V129-H131 PolarHBondContact O-N 3.36Å; V129-S132 PolarHBondContact O-N 3.27Å; V129-I133 HydrophobicContact CG1-CD1 3.78Å; V129-I133 HydrophobicContact CG1-CG1 4.42Å; V129-I133 WeakPolarHBondContact O-CG1 3.43Å; V129-I133 PolarHBondContact O-N 2.79Å; V129-M171 HydrophobicContact CB-CE 4.38Å; V129-M171 HydrophobicContact CG1-CE 3.96Å
130	G	84	Confident	86.1	Confident	3 Å²	3	51.6 Å²	51.6	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-57.9	-42.4	175.5	0	0	0	0	0	112.5	T126 I133 A134	T126-G130 PolarHBondContact O-N 2.81Å; G130-I133 PolarHBondContact O-N 2.78Å; G130-A134 WeakPolarHBondContact O-CB 3.42Å; G130-A134 PolarHBondContact O-N 3.42Å
131	H	86.1	Confident	85.9	Confident	110 Å²	110	51.5 Å²	51.5	51%	0.509	25%	0.249	S	C	.	.	H	α-helix	trans	-65.7	-40.1	176.5	-170.6	73.4	0	0	0	112.8	R127 V128 V129 A134 R135	R127-H131 PolarHBondContact O-N 3.12Å; R127-H131 VanDerWaalsContact O-N 3.07Å; V128-H131 PolarHBondContact O-N 3.37Å; V129-H131 VanDerWaalsContact C-N 3.31Å; V129-H131 PolarHBondContact O-N 3.36Å; H131-A134 WeakPolarHBondContact O-CB 2.99Å; H131-A134 PolarHBondContact O-N 3.31Å; H131-R135 PolarHBondContact NE2-NH2 3.44Å; H131-R135 VanDerWaalsContact NE2-NH2 3.13Å; H131-R135 PolarHBondContact O-N 3.36Å
132	S	89.4	Confident	85.5	Confident	32 Å²	32	52 Å²	52	22%	0.224	26%	0.255	C	S	.	.	H	α-helix	trans	-63.6	-44.2	175.9	-64	0	0	0	0	111.8	F39 V128 V129 R135 M136	F39-S132 WeakPolarHBondContact CZ-O 3.42Å; V128-S132 PolarHBondContact O-N 3.17Å; V128-S132 PolarHBondContact O-OG 2.7Å; V129-S132 PolarHBondContact O-N 3.27Å; S132-R135 PolarHBondContact O-N 3.23Å; S132-M136 PolarHBondContact O-N 2.96Å; S132-M136 VanDerWaalsContact O-N 3.07Å
133	I	86.4	Confident	85.3	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.036	26%	0.263	C	S	.	.	H	α-helix	trans	-62.1	-46.3	176.5	-65.9	163.3	0	0	0	110.2	F39 I77 V109 V129 G130 R135 M136 L137	F39-I133 HydrophobicContact CE1-CG1 4.12Å; F39-I133 HydrophobicContact CZ-CG1 4.42Å; I77-I133 HydrophobicContact CD1-CD1 3.66Å; I77-I133 HydrophobicContact CG1-CD1 4.07Å; V109-I133 HydrophobicContact CG1-CD1 4.15Å; V109-I133 HydrophobicContact CG1-CG1 4.03Å; V109-I133 HydrophobicContact CG2-CG1 4.36Å; V129-I133 HydrophobicContact CG1-CD1 3.78Å; V129-I133 HydrophobicContact CG1-CG1 4.42Å; V129-I133 WeakPolarHBondContact O-CG1 3.43Å; V129-I133 PolarHBondContact O-N 2.79Å; G130-I133 PolarHBondContact O-N 2.78Å; I133-R135 VanDerWaalsContact C-N 3.3Å; I133-R135 PolarHBondContact O-N 2.93Å; I133-M136 PolarHBondContact O-N 3.44Å; I133-L137 HydrophobicContact CG2-CD1 3.8Å; I133-L137 HydrophobicContact CG2-CG 4.25Å; I133-L137 VanDerWaalsContact O-CG 3.31Å; I133-L137 WeakPolarHBondContact O-CG 3.35Å; I133-L137 PolarHBondContact O-N 3.44Å
134	A	84.3	Confident	84.8	Confident	6 Å²	6	52.7 Å²	52.7	5%	0.05	26%	0.261	C	S	.	.	H	α-helix	trans	-53.8	-50	177.2	0	0	0	0	0	111.2	G130 H131 M136 L137 D138 F160 A164	G130-A134 WeakPolarHBondContact O-CB 3.42Å; G130-A134 PolarHBondContact O-N 3.42Å; H131-A134 WeakPolarHBondContact O-CB 2.99Å; H131-A134 PolarHBondContact O-N 3.31Å; A134-M136 VanDerWaalsContact C-N 3.35Å; A134-M136 PolarHBondContact O-N 2.92Å; A134-L137 PolarHBondContact O-N 3.25Å; A134-D138 WeakPolarHBondContact O-CB 3.4Å; A134-D138 PolarHBondContact O-N 2.86Å; A134-F160 HydrophobicContact CB-CE1 3.93Å; A134-F160 HydrophobicContact CB-CZ 4.41Å; A134-F160 VanDerWaalsContact O-CE1 3.31Å; A134-F160 WeakPolarHBondContact O-CE1 3.39Å; A134-F160 WeakPolarHBondContact O-CZ 3.29Å; A134-A164 HydrophobicContact CB-CB 3.5Å
135	R	87.6	Confident	84.1	Confident	144 Å²	144	50.2 Å²	50.2	54%	0.543	25%	0.248	S	C	.	.	H	α-helix	trans	-61.9	-39.4	-179.9	-166	-172.1	-66.2	-171.3	-3.5	113.2	V56 H131 S132 I133 W139	V56-R135 HydrophobicContact CG1-CG 4.07Å; H131-R135 PolarHBondContact NE2-NH2 3.44Å; H131-R135 VanDerWaalsContact NE2-NH2 3.13Å; H131-R135 PolarHBondContact O-N 3.36Å; S132-R135 PolarHBondContact O-N 3.23Å; I133-R135 VanDerWaalsContact C-N 3.3Å; I133-R135 PolarHBondContact O-N 2.93Å; R135-W139 VanDerWaalsContact O-CB 3.31Å; R135-W139 WeakPolarHBondContact O-CB 3.48Å; R135-W139 PolarHBondContact O-N 3.45Å
136	M	87.7	Confident	82.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.8	-46.5	176.3	173.5	60.3	82.5	0	0	111.3	F39 L54 V56 F75 S132 I133 A134 W139 L140	F39-M136 HydrophobicContact CB-CE 3.75Å; F39-M136 HydrophobicContact CD1-CB 4.37Å; F39-M136 HydrophobicContact CD1-CE 4.24Å; F39-M136 HydrophobicContact CD1-CG 3.99Å; F39-M136 HydrophobicContact CD2-CB 4.41Å; F39-M136 HydrophobicContact CD2-CE 3.24Å; F39-M136 HydrophobicContact CD2-CG 4.33Å; F39-M136 HydrophobicContact CE1-CB 3.81Å; F39-M136 HydrophobicContact CE1-CG 3.92Å; F39-M136 HydrophobicContact CE2-CB 3.87Å; F39-M136 HydrophobicContact CE2-CE 3.84Å; F39-M136 HydrophobicContact CE2-CG 4.27Å; F39-M136 HydrophobicContact CG-CE 3.47Å; F39-M136 VanDerWaalsContact CG-CE 3.47Å; F39-M136 HydrophobicContact CG-CG 4.19Å; F39-M136 HydrophobicContact CZ-CB 3.53Å; F39-M136 HydrophobicContact CZ-CG 4.07Å; L54-M136 HydrophobicContact CB-CE 3.8Å; V56-M136 HydrophobicContact CG2-CB 3.98Å; V56-M136 HydrophobicContact CG2-CE 3.72Å; V56-M136 HydrophobicContact CG2-SD 3.99Å; F75-M136 HydrophobicContact CE1-CG 4.11Å; F75-M136 HydrophobicContact CZ-CG 4.13Å; S132-M136 PolarHBondContact O-N 2.96Å; S132-M136 VanDerWaalsContact O-N 3.07Å; I133-M136 PolarHBondContact O-N 3.44Å; A134-M136 VanDerWaalsContact C-N 3.35Å; A134-M136 PolarHBondContact O-N 2.92Å; M136-W139 HydrophobicContact CE-CZ3 4.45Å; M136-W139 PolarHBondContact O-N 2.87Å; M136-W139 HydrophobicContact SD-CE3 3.62Å; M136-W139 HydrophobicContact SD-CZ3 3.85Å; M136-L140 HydrophobicContact CG-CD1 4.25Å; M136-L140 WeakPolarHBondContact O-CG 3.38Å; M136-L140 PolarHBondContact O-N 3.17Å; M136-L140 HydrophobicContact SD-CD1 4.24Å; M136-L140 HydrophobicContact SD-CG 4.2Å
137	L	86.1	Confident	81.9	Confident	31 Å²	31	64 Å²	64	16%	0.162	30%	0.303	C	S	.	.	H	α-helix	trans	-66.6	-40.9	178.9	-67.7	175	0	0	0	112.3	F75 I133 A134 W139 L140 Q141 F160 I182	F75-L137 HydrophobicContact CD2-CD2 4.19Å; F75-L137 HydrophobicContact CE2-CD2 3.8Å; F75-L137 HydrophobicContact CZ-CD2 4.03Å; I133-L137 HydrophobicContact CG2-CD1 3.8Å; I133-L137 HydrophobicContact CG2-CG 4.25Å; I133-L137 VanDerWaalsContact O-CG 3.31Å; I133-L137 WeakPolarHBondContact O-CG 3.35Å; I133-L137 PolarHBondContact O-N 3.44Å; A134-L137 PolarHBondContact O-N 3.25Å; L137-W139 VanDerWaalsContact C-N 3.3Å; L137-W139 PolarHBondContact O-N 3.14Å; L137-L140 PolarHBondContact O-N 3.08Å; L137-Q141 WeakPolarHBondContact O-CG 3.46Å; L137-Q141 PolarHBondContact O-N 3.26Å; L137-Q141 PolarHBondContact O-NE2 3.41Å; L137-F160 HydrophobicContact CB-CE1 4.42Å; L137-F160 HydrophobicContact CB-CE2 3.59Å; L137-F160 HydrophobicContact CB-CZ 3.33Å; L137-F160 HydrophobicContact CD1-CE2 3.9Å; L137-F160 HydrophobicContact CD1-CZ 3.77Å; L137-F160 HydrophobicContact CG-CE2 4.39Å; L137-F160 HydrophobicContact CG-CZ 4.18Å; L137-I182 HydrophobicContact CD2-CD1 3.31Å; L137-I182 HydrophobicContact CD2-CG1 4.17Å
138	D	84.1	Confident	80.4	Confident	63 Å²	63	60.6 Å²	60.6	34%	0.337	30%	0.296	S	S	.	.	H	α-helix	trans	-57.1	-46.5	172.5	-78.4	-35	0	0	0	110.7	A134 Q141 V142 F160	A134-D138 WeakPolarHBondContact O-CB 3.4Å; A134-D138 PolarHBondContact O-N 2.86Å; D138-Q141 PolarHBondContact O-N 2.74Å; D138-V142 WeakPolarHBondContact O-CG2 3.38Å; D138-V142 PolarHBondContact O-N 2.79Å; D138-F160 HydrophobicContact CB-CE1 4.47Å; D138-F160 WeakPolarHBondContact OD1-CD1 3.31Å; D138-F160 WeakPolarHBondContact OD1-CE1 3.35Å; D138-F160 WeakPolarHBondContact OD1-CG 3.3Å; D138-F160 WeakPolarHBondContact OD2-CE1 3.35Å
139	W	85.4	Confident	78.5	Confident	34 Å²	34	60.6 Å²	60.6	13%	0.129	30%	0.299	C	S	.	.	H	α-helix	trans	-64.7	-42.5	179.5	177	61.9	0	0	0	112.8	S55 V56 H58 L62 R135 M136 L137 Q141 V142 L143	S55-W139 WeakPolarHBondContact O-CH2 3.33Å; S55-W139 WeakPolarHBondContact O-CZ3 3.49Å; V56-W139 HydrophobicContact CG1-CB 3.84Å; V56-W139 HydrophobicContact CG1-CD2 4.16Å; V56-W139 HydrophobicContact CG1-CG 3.87Å; H58-W139 VanDerWaalsContact C-CZ2 3.48Å; H58-W139 WeakPolarHBondContact O-CH2 3.36Å; H58-W139 VanDerWaalsContact O-CZ2 3.25Å; H58-W139 WeakPolarHBondContact O-CZ2 3.35Å; L62-W139 HydrophobicContact CD1-CH2 3.26Å; L62-W139 HydrophobicContact CD1-CZ2 3.86Å; L62-W139 HydrophobicContact CD1-CZ3 3.64Å; L62-W139 HydrophobicContact CD2-CH2 4.48Å; L62-W139 HydrophobicContact CD2-CZ3 4.31Å; L62-W139 HydrophobicContact CG-CH2 3.67Å; L62-W139 HydrophobicContact CG-CZ3 3.99Å; R135-W139 VanDerWaalsContact O-CB 3.31Å; R135-W139 WeakPolarHBondContact O-CB 3.48Å; R135-W139 PolarHBondContact O-N 3.45Å; M136-W139 HydrophobicContact CE-CZ3 4.45Å; M136-W139 PolarHBondContact O-N 2.87Å; M136-W139 HydrophobicContact SD-CE3 3.62Å; M136-W139 HydrophobicContact SD-CZ3 3.85Å; L137-W139 VanDerWaalsContact C-N 3.3Å; L137-W139 PolarHBondContact O-N 3.14Å; W139-Q141 VanDerWaalsContact C-N 3.33Å; W139-Q141 PolarHBondContact O-N 3.2Å; W139-V142 PolarHBondContact O-N 3.02Å; W139-L143 HydrophobicContact CD2-CD1 3.92Å; W139-L143 VanDerWaalsContact CE2-CD1 3.41Å; W139-L143 HydrophobicContact CE3-CD1 4.39Å; W139-L143 HydrophobicContact CG-CD1 4.49Å; W139-L143 HydrophobicContact CH2-CD1 4.07Å; W139-L143 HydrophobicContact CZ2-CD1 3.5Å; W139-L143 VanDerWaalsContact CZ2-CD1 3.5Å; W139-L143 HydrophobicContact CZ3-CD1 4.47Å; W139-L143 WeakPolarHBondContact O-CG 3.48Å; W139-L143 PolarHBondContact O-N 3.07Å
140	L	85.3	Confident	76.9	Confident	15 Å²	15	65.2 Å²	65.2	8%	0.079	33%	0.329	C	S	.	.	H	α-helix	trans	-63.5	-37.5	174.8	-70.8	174	0	0	0	112.3	L62 F67 M69 F75 M136 L137 G144	L62-L140 HydrophobicContact CD1-CD2 4.08Å; L62-L140 HydrophobicContact CD2-CD2 3.83Å; F67-L140 HydrophobicContact CE1-CD2 4.1Å; F67-L140 HydrophobicContact CZ-CD1 4.28Å; F67-L140 HydrophobicContact CZ-CD2 4.28Å; M69-L140 WeakPolarHBondContact CE-O 3.4Å; M69-L140 HydrophobicContact SD-CD2 4.3Å; F75-L140 HydrophobicContact CE2-CD1 4.32Å; F75-L140 HydrophobicContact CZ-CD1 3.92Å; M136-L140 HydrophobicContact CG-CD1 4.25Å; M136-L140 WeakPolarHBondContact O-CG 3.38Å; M136-L140 PolarHBondContact O-N 3.17Å; M136-L140 HydrophobicContact SD-CD1 4.24Å; M136-L140 HydrophobicContact SD-CG 4.2Å; L137-L140 PolarHBondContact O-N 3.08Å; L140-G144 PolarHBondContact O-N 3.44Å
141	Q	81.8	Confident	75.3	Confident	86 Å²	86	71 Å²	71	40%	0.402	36%	0.364	S	S	.	.	H	α-helix	trans	-64.3	-49.2	175.7	-76.4	166.7	100	0	0	111.3	L137 D138 W139 L143 G144 D145 F160	L137-Q141 WeakPolarHBondContact O-CG 3.46Å; L137-Q141 PolarHBondContact O-N 3.26Å; L137-Q141 PolarHBondContact O-NE2 3.41Å; D138-Q141 PolarHBondContact O-N 2.74Å; W139-Q141 VanDerWaalsContact C-N 3.33Å; W139-Q141 PolarHBondContact O-N 3.2Å; Q141-L143 VanDerWaalsContact C-N 3.29Å; Q141-L143 PolarHBondContact O-N 3.15Å; Q141-G144 WeakPolarHBondContact O-CA 3.45Å; Q141-G144 PolarHBondContact O-N 2.81Å; Q141-D145 PolarHBondContact O-N 2.88Å; Q141-F160 VanDerWaalsContact NE2-CD2 3.3Å
142	V	82.1	Confident	73.5	Confident	80 Å²	80	70.2 Å²	70.2	49%	0.485	37%	0.367	S	S	.	.	H	α-helix	trans	-58.3	-42.9	178.1	172.1	0	0	0	0	111.3	D138 W139 G144 D145 E146	D138-V142 WeakPolarHBondContact O-CG2 3.38Å; D138-V142 PolarHBondContact O-N 2.79Å; W139-V142 PolarHBondContact O-N 3.02Å; V142-G144 VanDerWaalsContact C-N 3.29Å; V142-G144 PolarHBondContact O-N 2.64Å; V142-D145 PolarHBondContact O-N 2.99Å; V142-E146 WeakPolarHBondContact O-CG 3.39Å; V142-E146 PolarHBondContact O-N 3.39Å
143	L	80.2	Confident	71.4	Confident	39 Å²	39	70.5 Å²	70.5	20%	0.204	37%	0.369	C	S	.	.	H	α-helix	trans	-65.9	-30.7	176	-72.5	178.5	0	0	0	113.5	L62 M69 W139 Q141	L62-L143 HydrophobicContact CD1-CD1 3.39Å; M69-L143 HydrophobicContact CE-CB 4.02Å; W139-L143 HydrophobicContact CD2-CD1 3.92Å; W139-L143 VanDerWaalsContact CE2-CD1 3.41Å; W139-L143 HydrophobicContact CE3-CD1 4.39Å; W139-L143 HydrophobicContact CG-CD1 4.49Å; W139-L143 HydrophobicContact CH2-CD1 4.07Å; W139-L143 HydrophobicContact CZ2-CD1 3.5Å; W139-L143 VanDerWaalsContact CZ2-CD1 3.5Å; W139-L143 HydrophobicContact CZ3-CD1 4.47Å; W139-L143 WeakPolarHBondContact O-CG 3.48Å; W139-L143 PolarHBondContact O-N 3.07Å; Q141-L143 VanDerWaalsContact C-N 3.29Å; Q141-L143 PolarHBondContact O-N 3.15Å
144	G	74.6	Confident	69.4	Low	21 Å²	21	81 Å²	81	22%	0.216	41%	0.408	C	S	.	.	H	α-helix	trans	-70	-46.8	173.5	0	0	0	0	0	111.7	L140 Q141 V142 E146 R147 E148	L140-G144 PolarHBondContact O-N 3.44Å; Q141-G144 WeakPolarHBondContact O-CA 3.45Å; Q141-G144 PolarHBondContact O-N 2.81Å; V142-G144 VanDerWaalsContact C-N 3.29Å; V142-G144 PolarHBondContact O-N 2.64Å; G144-E146 PolarHBondContact O-N 2.78Å; G144-R147 WeakPolarHBondContact O-CA 3.2Å; G144-R147 WeakPolarHBondContact O-CB 3.1Å; G144-R147 PolarHBondContact O-N 2.85Å; G144-E148 PolarHBondContact O-N 3.32Å
145	D	70.1	Confident	67.6	Low	60 Å²	60	87.1 Å²	87.1	32%	0.321	44%	0.438	S	S	.	.	H	α-helix	trans	-64.5	-35.2	-179.6	-78.8	-0	0	0	0	112.6	Q141 V142 R147 E148	Q141-D145 PolarHBondContact O-N 2.88Å; V142-D145 PolarHBondContact O-N 2.99Å; D145-R147 PolarHBondContact O-N 3.24Å; D145-E148 PolarHBondContact O-N 3.26Å
146	E	64.6	Low	65.5	Low	155 Å²	155	84.6 Å²	84.6	72%	0.724	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-20.8	173.7	-73.9	-172.3	160.5	0	0	112.9	V142 G144	V142-E146 WeakPolarHBondContact O-CG 3.39Å; V142-E146 PolarHBondContact O-N 3.39Å; G144-E146 PolarHBondContact O-N 2.78Å
147	R	61.3	Low	63.6	Low	177 Å²	177	88.9 Å²	88.9	67%	0.668	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-14.5	179.8	-161.4	174.8	-103.3	179.1	-3.7	112.3	G144 D145	G144-R147 WeakPolarHBondContact O-CA 3.2Å; G144-R147 WeakPolarHBondContact O-CB 3.1Å; G144-R147 PolarHBondContact O-N 2.85Å; D145-R147 PolarHBondContact O-N 3.24Å
148	E	53.8	Low	61.6	Low	129 Å²	129	93 Å²	93	60%	0.603	50%	0.495	S	S	*	.	S	Bend	trans	-102.7	151.3	169.6	-67.6	-163	165.8	0	0	111.6	G144 D145	G144-E148 PolarHBondContact O-N 3.32Å; D145-E148 PolarHBondContact O-N 3.26Å
149	S	46.7	Very low	60	Low	80 Å²	80	94 Å²	94	56%	0.559	50%	0.499	S	S	*	.			trans	-53.7	144.1	-173.5	175.8	0	0	0	0	113.8	V151 T152	S149-V151 PolarHBondContact O-N 3.07Å; S149-T152 PolarHBondContact O-N 3.44Å; S149-T152 PolarHBondContact O-OG1 2.74Å
150	P	52.6	Low	58.1	Low	98 Å²	98	94 Å²	94	64%	0.636	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	6.9	-171.1	24.3	-34.8	0	0	0	117
151	V	51.6	Low	56.1	Low	124 Å²	124	99.9 Å²	99.9	75%	0.752	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-25.6	-178	-177.3	0	0	0	0	112	S149	S149-V151 PolarHBondContact O-N 3.07Å
152	T	48.5	Very low	54.5	Low	93 Å²	93	104.4 Å²	104.4	57%	0.571	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-21.5	179.1	37.1	0	0	0	0	113.9	S149 R154	S149-T152 PolarHBondContact O-N 3.44Å; S149-T152 PolarHBondContact O-OG1 2.74Å; T152-R154 VanDerWaalsContact C-N 3.28Å; T152-R154 PolarHBondContact O-N 3.08Å
153	S	44.8	Very low	52.6	Low	38 Å²	38	102.9 Å²	102.9	27%	0.266	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-73.2	-6	-173.5	57.7	0	0	0	0	116.1	S156	S153-S156 PolarHBondContact O-OG 3.4Å
154	R	43.7	Very low	51	Low	228 Å²	228	101.9 Å²	101.9	86%	0.86	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-90.5	2.7	179.5	-70	-170.2	-166.1	-177.8	4.5	115.1	T152	T152-R154 VanDerWaalsContact C-N 3.28Å; T152-R154 PolarHBondContact O-N 3.08Å
155	I	47.7	Very low	49.7	Very low	134 Å²	134	102.4 Å²	102.4	69%	0.687	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-111.6	30.1	178.6	-39.5	-176.4	0	0	0	111.4	N157	I155-N157 PolarHBondContact O-N 3Å
156	S	43.6	Very low	48.8	Very low	91 Å²	91	104.1 Å²	104.1	64%	0.636	54%	0.542	S	S	*	.			trans	-83.4	111.9	176.3	43.5	0	0	0	0	111.7	S153	S153-S156 PolarHBondContact O-OG 3.4Å
157	N	46.9	Very low	47.9	Very low	91 Å²	91	97 Å²	97	49%	0.487	51%	0.51	S	S	.	.			trans	-77.3	155.8	-162.9	-83.5	-54.2	0	0	0	116.1	I155 I159	I155-N157 PolarHBondContact O-N 3Å; N157-I159 HydrophobicContact CB-CB 4.05Å; N157-I159 HydrophobicContact CB-CD1 3.78Å; N157-I159 HydrophobicContact CB-CG1 3.9Å; N157-I159 PolarHBondContact O-N 2.66Å
158	P	43.5	Very low	47.2	Very low	118 Å²	118	89.6 Å²	89.6	77%	0.766	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	10.5	165.7	26.8	-33.8	0	0	0	115.5
159	I	51.1	Low	46.7	Very low	83 Å²	83	87.9 Å²	87.9	43%	0.426	48%	0.483	S	S	.	.	H	α-helix	trans	-74.3	-26.4	-176.2	-72.3	167.8	0	0	0	112	N157 R162 N163	N157-I159 HydrophobicContact CB-CB 4.05Å; N157-I159 HydrophobicContact CB-CD1 3.78Å; N157-I159 HydrophobicContact CB-CG1 3.9Å; N157-I159 PolarHBondContact O-N 2.66Å; I159-R162 VanDerWaalsContact O-CB 3.28Å; I159-R162 WeakPolarHBondContact O-CB 3.49Å; I159-R162 PolarHBondContact O-N 3.03Å; I159-N163 PolarHBondContact O-N 2.75Å
160	F	45.7	Very low	46.4	Very low	35 Å²	35	86.1 Å²	86.1	15%	0.154	47%	0.473	C	S	.	.	H	α-helix	trans	-68.9	-44.5	-171	-172.6	-93.1	0	0	0	114	A134 L137 D138 Q141 R162 N163 A164	A134-F160 HydrophobicContact CB-CE1 3.93Å; A134-F160 HydrophobicContact CB-CZ 4.41Å; A134-F160 VanDerWaalsContact O-CE1 3.31Å; A134-F160 WeakPolarHBondContact O-CE1 3.39Å; A134-F160 WeakPolarHBondContact O-CZ 3.29Å; L137-F160 HydrophobicContact CB-CE1 4.42Å; L137-F160 HydrophobicContact CB-CE2 3.59Å; L137-F160 HydrophobicContact CB-CZ 3.33Å; L137-F160 HydrophobicContact CD1-CE2 3.9Å; L137-F160 HydrophobicContact CD1-CZ 3.77Å; L137-F160 HydrophobicContact CG-CE2 4.39Å; L137-F160 HydrophobicContact CG-CZ 4.18Å; D138-F160 HydrophobicContact CB-CE1 4.47Å; D138-F160 WeakPolarHBondContact OD1-CD1 3.31Å; D138-F160 WeakPolarHBondContact OD1-CE1 3.35Å; D138-F160 WeakPolarHBondContact OD1-CG 3.3Å; D138-F160 WeakPolarHBondContact OD2-CE1 3.35Å; Q141-F160 VanDerWaalsContact NE2-CD2 3.3Å; F160-R162 PolarHBondContact O-N 3.5Å; F160-N163 PolarHBondContact O-N 2.96Å; F160-A164 PolarHBondContact O-N 3.29Å
161	L	43.8	Very low	46.3	Very low	138 Å²	138	82.8 Å²	82.8	72%	0.723	45%	0.45	S	S	*	.	H	α-helix	trans	-60.1	-30.6	175	-72.8	170.8	0	0	0	112.3	G165	L161-G165 PolarHBondContact O-N 3.36Å; L161-G165 VanDerWaalsContact O-N 3.11Å
162	R	47.2	Very low	46	Very low	181 Å²	181	80.1 Å²	80.1	68%	0.683	43%	0.431	S	S	*	.	H	α-helix	trans	-68	-38.7	176.5	-144.5	174.5	-162.8	-103.5	1.5	111.4	I159 F160 G165 H166	I159-R162 VanDerWaalsContact O-CB 3.28Å; I159-R162 WeakPolarHBondContact O-CB 3.49Å; I159-R162 PolarHBondContact O-N 3.03Å; F160-R162 PolarHBondContact O-N 3.5Å; R162-G165 PolarHBondContact O-N 3.23Å; R162-H166 VanDerWaalsContact O-CG 3.28Å; R162-H166 PolarHBondContact O-N 3.4Å; R162-H166 PolarHBondContact O-ND1 3.04Å
163	N	43.4	Very low	45.4	Very low	47 Å²	47	83.8 Å²	83.8	25%	0.251	44%	0.44	S	S	.	.	H	α-helix	trans	-78.4	-35	-179.1	-70.9	-21.2	0	0	0	113.3	I159 F160 G165 H166 A167 F185	I159-N163 PolarHBondContact O-N 2.75Å; F160-N163 PolarHBondContact O-N 2.96Å; N163-G165 VanDerWaalsContact C-N 3.28Å; N163-G165 PolarHBondContact O-N 2.85Å; N163-H166 CarbonylContact O-C 3.57Å; N163-H166 WeakPolarHBondContact O-CB 3.34Å; N163-H166 PolarHBondContact O-N 3.34Å; N163-H166 VanDerWaalsContact O-N 3.17Å; N163-H166 PolarHBondContact OD1-ND1 3.25Å; N163-A167 WeakPolarHBondContact O-CB 3.47Å; N163-A167 PolarHBondContact O-N 3.42Å; N163-F185 WeakPolarHBondContact ND2-CE1 3.45Å
164	A	46	Very low	45.1	Very low	18 Å²	18	91.8 Å²	91.8	15%	0.149	46%	0.464	C	S	.	.	H	α-helix	trans	-60.8	-40.5	167.1	0	0	0	0	0	111.7	A134 F160 A167 S168	A134-A164 HydrophobicContact CB-CB 3.5Å; F160-A164 PolarHBondContact O-N 3.29Å; A164-A167 PolarHBondContact O-N 2.82Å; A164-S168 PolarHBondContact O-N 2.87Å
165	G	48.1	Very low	45.2	Very low	33 Å²	33	84.5 Å²	84.5	34%	0.34	45%	0.448	S	S	.	.	H	α-helix	trans	-56	-48.8	168.7	0	0	0	0	0	112.1	L161 R162 N163 A167 S168 V169	L161-G165 PolarHBondContact O-N 3.36Å; L161-G165 VanDerWaalsContact O-N 3.11Å; R162-G165 PolarHBondContact O-N 3.23Å; N163-G165 VanDerWaalsContact C-N 3.28Å; N163-G165 PolarHBondContact O-N 2.85Å; G165-A167 PolarHBondContact O-N 3.43Å; G165-S168 PolarHBondContact O-N 2.85Å; G165-V169 WeakPolarHBondContact O-CB 3.5Å; G165-V169 WeakPolarHBondContact O-CG2 3.41Å; G165-V169 PolarHBondContact O-N 3.09Å
166	H	50.9	Low	45.2	Very low	96 Å²	96	83 Å²	83	44%	0.444	44%	0.441	S	S	.	.	H	α-helix	trans	-63.9	-36.7	175.8	-64.2	152.6	0	0	0	113.7	R162 N163 V169 A170	R162-H166 VanDerWaalsContact O-CG 3.28Å; R162-H166 PolarHBondContact O-N 3.4Å; R162-H166 PolarHBondContact O-ND1 3.04Å; N163-H166 CarbonylContact O-C 3.57Å; N163-H166 WeakPolarHBondContact O-CB 3.34Å; N163-H166 PolarHBondContact O-N 3.34Å; N163-H166 VanDerWaalsContact O-N 3.17Å; N163-H166 PolarHBondContact OD1-ND1 3.25Å; H166-V169 PolarHBondContact O-N 3.21Å; H166-A170 PolarHBondContact O-N 2.89Å
167	A	44.8	Very low	45.6	Very low	6 Å²	6	82.7 Å²	82.7	5%	0.05	43%	0.431	C	S	.	.	H	α-helix	trans	-62.9	-45.7	176	0	0	0	0	0	110.9	N163 A164 G165 M171 K178 F180	N163-A167 WeakPolarHBondContact O-CB 3.47Å; N163-A167 PolarHBondContact O-N 3.42Å; A164-A167 PolarHBondContact O-N 2.82Å; G165-A167 PolarHBondContact O-N 3.43Å; A167-M171 VanDerWaalsContact O-CG 3.25Å; A167-M171 WeakPolarHBondContact O-CG 3.45Å; A167-M171 PolarHBondContact O-N 3.49Å; A167-K178 PolarHBondContact O-NZ 2.96Å; A167-F180 HydrophobicContact CB-CE2 4.11Å; A167-F180 HydrophobicContact CB-CZ 3.68Å
168	S	46.3	Very low	46.2	Very low	20 Å²	20	79.7 Å²	79.7	14%	0.14	41%	0.414	C	S	.	.	H	α-helix	trans	-65.7	-44.6	174.8	-159.6	0	0	0	0	111.8	T126 A164 G165 M171 N172	T126-S168 PolarHBondContact O-OG 3.35Å; A164-S168 PolarHBondContact O-N 2.87Å; G165-S168 PolarHBondContact O-N 2.85Å; S168-M171 PolarHBondContact O-N 3.2Å; S168-N172 PolarHBondContact O-N 2.83Å; S168-N172 PolarHBondContact O-ND2 3.48Å
169	V	44.7	Very low	46.8	Very low	93 Å²	93	77.8 Å²	77.8	56%	0.564	40%	0.396	S	S	*	.	H	α-helix	trans	-62.5	-47.2	179.7	169.3	0	0	0	0	112.3	G165 H166 M171 N172	G165-V169 WeakPolarHBondContact O-CB 3.5Å; G165-V169 WeakPolarHBondContact O-CG2 3.41Å; G165-V169 PolarHBondContact O-N 3.09Å; H166-V169 PolarHBondContact O-N 3.21Å; V169-M171 VanDerWaalsContact C-N 3.27Å; V169-M171 PolarHBondContact O-N 2.95Å; V169-N172 WeakPolarHBondContact O-CB 3.27Å; V169-N172 PolarHBondContact O-N 2.92Å; V169-N172 VanDerWaalsContact O-N 3.11Å
170	A	40.7	Very low	47.1	Very low	43 Å²	43	77.5 Å²	77.5	36%	0.355	39%	0.392	S	S	.	.	H	α-helix	trans	-78.7	-7.9	-179.3	0	0	0	0	0	113.3	H166 N172 K178	H166-A170 PolarHBondContact O-N 2.89Å; A170-N172 VanDerWaalsContact C-N 3.27Å; A170-K178 WeakPolarHBondContact O-CE 3.29Å; A170-K178 PolarHBondContact O-NZ 3.11Å
171	M	49	Very low	47.2	Very low	28 Å²	28	79.1 Å²	79.1	14%	0.138	40%	0.4	C	S	.	.	H	α-helix	trans	-75.9	-21.1	166.7	-76.7	172.7	76.3	0	0	111.1	I77 W111 T126 V129 A167 S168 V169 K178	I77-M171 HydrophobicContact CG2-CE 3.77Å; I77-M171 HydrophobicContact CG2-SD 4.17Å; W111-M171 HydrophobicContact CZ2-CE 4.06Å; T126-M171 HydrophobicContact CG2-CB 4.13Å; T126-M171 HydrophobicContact CG2-CE 4.23Å; V129-M171 HydrophobicContact CB-CE 4.38Å; V129-M171 HydrophobicContact CG1-CE 3.96Å; A167-M171 VanDerWaalsContact O-CG 3.25Å; A167-M171 WeakPolarHBondContact O-CG 3.45Å; A167-M171 PolarHBondContact O-N 3.49Å; S168-M171 PolarHBondContact O-N 3.2Å; V169-M171 VanDerWaalsContact C-N 3.27Å; V169-M171 PolarHBondContact O-N 2.95Å; M171-K178 HydrophobicContact CG-CD 4.17Å
172	N	45.1	Very low	47.5	Very low	69 Å²	69	75 Å²	75	37%	0.369	38%	0.378	S	S	.	.	S	Bend	trans	-85.4	-10.4	176	-62.4	-29.5	0	0	0	112.9	T126 S168 V169 A170	T126-N172 PolarHBondContact OG1-OD1 2.95Å; S168-N172 PolarHBondContact O-N 2.83Å; S168-N172 PolarHBondContact O-ND2 3.48Å; V169-N172 WeakPolarHBondContact O-CB 3.27Å; V169-N172 PolarHBondContact O-N 2.92Å; V169-N172 VanDerWaalsContact O-N 3.11Å; A170-N172 VanDerWaalsContact C-N 3.27Å
173	F	37	Very low	46.9	Very low	170 Å²	170	71.3 Å²	71.3	75%	0.746	37%	0.367	S	S	*	.	S	Bend	trans	-104.2	87.2	178.2	-120.2	-96	0	0	0	109.3
174	W	38.9	Very low	46.3	Very low	205 Å²	205	73.1 Å²	73.1	78%	0.777	38%	0.383	S	S	*	.	S	Bend	trans	65.3	147.3	-176.4	-98.1	17.8	0	0	0	115.4	L176	W174-L176 HydrophobicContact CB-CD1 4.01Å; W174-L176 HydrophobicContact CB-CG 3.95Å; W174-L176 HydrophobicContact CE3-CD2 4.45Å; W174-L176 PolarHBondContact O-N 3.12Å
175	S	44.5	Very low	45.9	Very low	75 Å²	75	78.9 Å²	78.9	52%	0.524	41%	0.405	S	S	.	.	S	Bend	trans	-64.4	55.8	177.4	-52.4	0	0	0	0	112.9
176	L	47.5	Very low	45	Very low	104 Å²	104	84.2 Å²	84.2	55%	0.545	43%	0.425	S	S	.	.			trans	-97.3	140.2	-171.7	-70.4	170	0	0	0	111.9	W174 K178	W174-L176 HydrophobicContact CB-CD1 4.01Å; W174-L176 HydrophobicContact CB-CG 3.95Å; W174-L176 HydrophobicContact CE3-CD2 4.45Å; W174-L176 PolarHBondContact O-N 3.12Å; L176-K178 PolarHBondContact O-N 2.98Å
177	I	52.7	Low	43.8	Very low	83 Å²	83	88.1 Å²	88.1	43%	0.426	44%	0.443	S	S	.	.			trans	-56.9	124.5	166.7	-60.7	167.6	0	0	0	108.1	W89 L93 I179	W89-I177 HydrophobicContact CD2-CD1 3.55Å; W89-I177 HydrophobicContact CD2-CG1 3.98Å; W89-I177 HydrophobicContact CE3-CD1 3.47Å; W89-I177 VanDerWaalsContact CE3-CD1 3.47Å; W89-I177 HydrophobicContact CE3-CG1 3.85Å; W89-I177 HydrophobicContact CE3-CG2 4.3Å; W89-I177 HydrophobicContact CG-CD1 4.06Å; W89-I177 HydrophobicContact CH2-CB 4.47Å; W89-I177 HydrophobicContact CH2-CD1 4.37Å; W89-I177 HydrophobicContact CH2-CG1 3.8Å; W89-I177 HydrophobicContact CH2-CG2 4.15Å; W89-I177 HydrophobicContact CZ2-CD1 4.4Å; W89-I177 HydrophobicContact CZ2-CG1 3.88Å; W89-I177 HydrophobicContact CZ3-CB 4.35Å; W89-I177 HydrophobicContact CZ3-CD1 3.91Å; W89-I177 HydrophobicContact CZ3-CG1 3.77Å; W89-I177 HydrophobicContact CZ3-CG2 3.73Å; L93-I177 HydrophobicContact CD2-CG2 4.1Å; I177-I179 HydrophobicContact CG2-CG1 4.25Å
178	K	59.3	Low	43.2	Very low	28 Å²	28	98.8 Å²	98.8	12%	0.122	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.5	169.5	-72.3	-171.9	176.6	-171.9	0	110.8	I77 A167 A170 M171 L176 F180	I77-K178 HydrophobicContact CD1-CB 4.45Å; I77-K178 PolarHBondContact N-O 3.41Å; A167-K178 PolarHBondContact O-NZ 2.96Å; A170-K178 WeakPolarHBondContact O-CE 3.29Å; A170-K178 PolarHBondContact O-NZ 3.11Å; M171-K178 HydrophobicContact CG-CD 4.17Å; L176-K178 PolarHBondContact O-N 2.98Å; K178-F180 HydrophobicContact CB-CD2 4.5Å; K178-F180 HydrophobicContact CB-CE2 4.1Å; K178-F180 HydrophobicContact CD-CE2 3.99Å; K178-F180 HydrophobicContact CD-CZ 4.31Å
179	I	56.4	Low	43	Very low	78 Å²	78	102.8 Å²	102.8	40%	0.4	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	120.9	172.1	-55.2	170.6	0	0	0	106.7	F74 F75 L93 I177	F74-I179 HydrophobicContact CD1-CG2 4.04Å; F75-I179 WeakPolarHBondContact O-CA 3.41Å; L93-I179 HydrophobicContact CD1-CD1 3.68Å; L93-I179 HydrophobicContact CD2-CD1 3.62Å; L93-I179 HydrophobicContact CD2-CG1 3.92Å; L93-I179 HydrophobicContact CG-CD1 4.21Å; I177-I179 HydrophobicContact CG2-CG1 4.25Å
180	F	58	Low	42.9	Very low	78 Å²	78	103.3 Å²	103.3	34%	0.342	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	124.1	170.2	-72.8	-86.8	0	0	0	109	F74 F75 I77 A167 K178	F74-F180 WeakPolarHBondContact CA-O 3.31Å; F75-F180 HydrophobicContact CB-CB 4.43Å; F75-F180 PolarHBondContact N-O 3.24Å; F75-F180 PolarHBondContact O-N 3.4Å; F75-F180 VanDerWaalsContact O-N 3.09Å; I77-F180 HydrophobicContact CD1-CD2 3.76Å; I77-F180 HydrophobicContact CD1-CE2 3.69Å; A167-F180 HydrophobicContact CB-CE2 4.11Å; A167-F180 HydrophobicContact CB-CZ 3.68Å; K178-F180 HydrophobicContact CB-CD2 4.5Å; K178-F180 HydrophobicContact CB-CE2 4.1Å; K178-F180 HydrophobicContact CD-CE2 3.99Å; K178-F180 HydrophobicContact CD-CZ 4.31Å
181	E	46.7	Very low	43.1	Very low	69 Å²	69	106.6 Å²	106.6	32%	0.322	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	121.3	169.5	-177.3	174.4	176.5	0	0	109.1	K72 F74	K72-E181 WeakPolarHBondContact CD-OE1 3.23Å; K72-E181 VanDerWaalsContact CE-OE1 3.23Å; K72-E181 WeakPolarHBondContact CE-OE1 3.43Å; K72-E181 IonicContact NZ-OE1 3.02Å; K72-E181 PolarHBondContact NZ-OE1 2.8Å; F74-E181 HydrophobicContact CD1-CB 3.98Å; F74-E181 HydrophobicContact CD1-CG 4.19Å; F74-E181 HydrophobicContact CE1-CB 3.71Å; F74-E181 HydrophobicContact CE1-CG 3.58Å; F74-E181 HydrophobicContact CZ-CG 4.11Å
182	I	49.8	Very low	42.7	Very low	50 Å²	50	111.2 Å²	111.2	26%	0.256	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-78.3	-25.9	-175.5	-64.7	-177.8	0	0	0	112.8	T73 F75 L137 S184 F185	T73-I182 HydrophobicContact CG2-CD1 4.14Å; T73-I182 PolarHBondContact O-N 3Å; F75-I182 HydrophobicContact CD2-CD1 3.67Å; F75-I182 HydrophobicContact CD2-CG1 4.31Å; F75-I182 HydrophobicContact CE2-CD1 3.34Å; F75-I182 HydrophobicContact CE2-CG1 4.42Å; F75-I182 HydrophobicContact CZ-CD1 4.44Å; L137-I182 HydrophobicContact CD2-CD1 3.31Å; L137-I182 HydrophobicContact CD2-CG1 4.17Å; I182-S184 PolarHBondContact O-N 3.06Å; I182-S184 VanDerWaalsContact O-N 3.12Å; I182-F185 PolarHBondContact O-N 2.97Å
183	K	34.2	Very low	42.6	Very low	105 Å²	105	113.9 Å²	113.9	46%	0.457	56%	0.556	S	S	.	*	G	3₁₀ helix	trans	-67.7	-13.9	-174.7	-94.3	-155.5	-166	176.3	0	115.7	T70 A71 K72 F185	T70-K183 WeakPolarHBondContact O-CE 3.36Å; T70-K183 PolarHBondContact O-NZ 3.38Å; A71-K183 VanDerWaalsContact C-CE 3.42Å; K72-K183 HydrophobicContact CB-CD 4.38Å; K72-K183 HydrophobicContact CB-CG 4.38Å; K72-K183 HydrophobicContact CD-CD 4.41Å; K72-K183 HydrophobicContact CG-CB 3.91Å; K72-K183 HydrophobicContact CG-CD 3.35Å; K72-K183 HydrophobicContact CG-CG 3.67Å; K183-F185 VanDerWaalsContact C-N 3.29Å; K183-F185 PolarHBondContact O-N 3Å
184	S	31.6	Very low	42.9	Very low	84 Å²	84	110.1 Å²	110.1	59%	0.587	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-84.7	7.3	176.7	-68.2	0	0	0	0	114.5	I182	I182-S184 PolarHBondContact O-N 3.06Å; I182-S184 VanDerWaalsContact O-N 3.12Å
185	F	36.8	Very low	43.2	Very low	139 Å²	139	103.4 Å²	103.4	61%	0.61	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-117.6	2.3	-176.1	-91	-85.2	0	0	0	115.6	N163 I182 K183	N163-F185 WeakPolarHBondContact ND2-CE1 3.45Å; I182-F185 PolarHBondContact O-N 2.97Å; K183-F185 VanDerWaalsContact C-N 3.29Å; K183-F185 PolarHBondContact O-N 3Å
186	I	29.4	Very low	43.1	Very low	146 Å²	146	105.5 Å²	105.5	75%	0.749	53%	0.527	S	S	*	.	S	Bend	trans	-96.3	-10.8	173.9	-63.4	-178.3	0	0	0	112.1
187	E	26.4	Very low	42.8	Very low	177 Å²	177	105.7 Å²	105.7	83%	0.827	53%	0.526	S	S	*	.			trans	-114.9	77.3	171.1	-70.1	-166.7	171.2	0	0	111.4
188	L	31.9	Very low	41.9	Very low	231 Å²	231	107.7 Å²	107.7	100%	1.209	54%	0.535	S	S	*	.			trans	-155.7	0	151.7	-90.6	-178.5	0	0	0	110.2

Retrieved 188 of 188 residues in 122.4 ms (Link to these results)

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