A0A3Q0KL81_SCHMA Loading...

WWE domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KL81, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 151 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	46.5	Very low	250 Å²	250	130.4 Å²	130.4	100%	1.232	81%	0.805	S	S	*	*				0	141.6	0	-79	174.7	178.3	0	0	108.2
2	A	45.3	Very low	46.1	Very low	93 Å²	93	136.8 Å²	136.8	77%	0.769	80%	0.803	S	S	*	*			trans	-67.5	145.8	-160.6	0	0	0	0	0	114.2
3	A	47	Very low	46.5	Very low	98 Å²	98	133.5 Å²	133.5	81%	0.81	79%	0.792	S	S	*	*			trans	-80.2	113.1	166.8	0	0	0	0	0	108.7
4	C	56.5	Low	46.7	Very low	107 Å²	107	133 Å²	133	72%	0.723	78%	0.784	S	S	*	*			trans	-75	121.3	173.1	-30.6	0	0	0	0	108	D6	C4-D6 PolarHBondContact O-N 3.35Å
5	V	54.4	Low	47.2	Very low	137 Å²	137	133.4 Å²	133.4	83%	0.83	78%	0.781	S	S	*	*			trans	-82.9	104	169.5	171.1	0	0	0	0	107	A7	V5-A7 PolarHBondContact O-N 2.96Å
6	D	49.8	Very low	47.5	Very low	139 Å²	139	136.8 Å²	136.8	74%	0.743	78%	0.783	S	S	*	*			trans	-77.8	100.6	176.9	-74.5	-34	0	0	0	110.3	C4 N8	C4-D6 PolarHBondContact O-N 3.35Å; D6-N8 PolarHBondContact O-N 2.89Å
7	A	45.9	Very low	47.6	Very low	84 Å²	84	136.8 Å²	136.8	69%	0.694	78%	0.78	S	S	*	*			trans	-82.4	74.8	170.9	0	0	0	0	0	110.6	V5	V5-A7 PolarHBondContact O-N 2.96Å
8	N	45.3	Very low	47.5	Very low	141 Å²	141	139.7 Å²	139.7	75%	0.754	78%	0.783	S	S	*	*			trans	-120.7	78.6	163.3	-69.8	-48.8	0	0	0	107.2	D6	D6-N8 PolarHBondContact O-N 2.89Å
9	S	42.1	Very low	47.5	Very low	97 Å²	97	139.5 Å²	139.5	68%	0.678	78%	0.778	S	S	*	*				48.2	90.2	88.7	103.1	0	0	0	0	113.5
10	T	41.5	Very low	47.6	Very low	122 Å²	122	138.6 Å²	138.6	75%	0.748	78%	0.776	S	S	*	*			trans	51.7	74.6	130.2	-28.8	0	0	0	0	117.8	R12	T10-R12 HydrophobicContact CG2-CG 4.38Å
11	L	42.5	Very low	47.8	Very low	166 Å²	166	140.2 Å²	140.2	87%	0.869	78%	0.775	S	S	*	*			trans	-99.9	99.6	149.9	-106.6	158.5	0	0	0	108.9	S13	L11-S13 PolarHBondContact O-N 3.04Å
12	R	41.6	Very low	48.3	Very low	207 Å²	207	133.6 Å²	133.6	78%	0.781	75%	0.751	S	S	*	*			trans	-59.2	108.9	165.7	-71.4	-174.5	170.4	-155.5	-0.5	108.5	T10	T10-R12 HydrophobicContact CG2-CG 4.38Å
13	S	51.9	Low	48.4	Very low	95 Å²	95	136.3 Å²	136.3	66%	0.664	75%	0.752	S	S	*	*			trans	-96.9	88.7	158.4	-59.6	0	0	0	0	107.2	L11 D15	L11-S13 PolarHBondContact O-N 3.04Å; S13-D15 PolarHBondContact O-N 3.39Å
14	D	49.2	Very low	48.4	Very low	126 Å²	126	135.5 Å²	135.5	67%	0.674	74%	0.741	S	S	*	*			trans	-63.5	78.8	160.6	-108.6	-34.7	0	0	0	107.1	K16	D14-K16 PolarHBondContact O-N 3.37Å
15	D	53.6	Low	47.9	Very low	139 Å²	139	137.7 Å²	137.7	74%	0.743	74%	0.744	S	S	*	*			trans	-74	71.3	170.4	-87.7	-30.3	0	0	0	108.9	S13 N17	S13-D15 PolarHBondContact O-N 3.39Å; D15-N17 PolarHBondContact O-N 3.19Å
16	K	52.8	Low	47.6	Very low	187 Å²	187	136.8 Å²	136.8	81%	0.813	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	8.5	177.2	-139.8	172.5	-173.8	177.3	0	113	D14	D14-K16 PolarHBondContact O-N 3.37Å
17	N	49.7	Very low	47.3	Very low	138 Å²	138	133.4 Å²	133.4	74%	0.738	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.3	30.7	-177	-105	19.2	0	0	0	112.9	D15 I19	D15-N17 PolarHBondContact O-N 3.19Å; N17-I19 PolarHBondContact O-N 3.25Å
18	K	45.4	Very low	47.5	Very low	189 Å²	189	134.1 Å²	134.1	82%	0.822	72%	0.724	S	S	*	*			trans	-67.8	83.3	160.1	-153.9	-177	-166.7	-168.1	0	108	T20	K18-T20 VanDerWaalsContact C-N 3.26Å; K18-T20 PolarHBondContact O-N 3.13Å; K18-T20 PolarHBondContact O-OG1 2.67Å
19	I	48.1	Very low	47.6	Very low	136 Å²	136	133.3 Å²	133.3	70%	0.697	72%	0.719	S	S	*	*			trans	-55.7	99	169.5	-64.3	165.7	0	0	0	105.1	N17 K21	N17-I19 PolarHBondContact O-N 3.25Å; I19-K21 VanDerWaalsContact C-N 3.29Å; I19-K21 PolarHBondContact O-N 3.1Å
20	T	49.5	Very low	48	Very low	120 Å²	120	135 Å²	135	74%	0.736	72%	0.72	S	S	*	*			trans	-66.2	99.4	172	-61.1	0	0	0	0	104.3	K18 P22	K18-T20 VanDerWaalsContact C-N 3.26Å; K18-T20 PolarHBondContact O-N 3.13Å; K18-T20 PolarHBondContact O-OG1 2.67Å; T20-P22 VanDerWaalsContact O-CD 3.29Å; T20-P22 WeakPolarHBondContact O-CD 3.27Å; T20-P22 VanDerWaalsContact O-N 3.14Å
21	K	51.5	Low	48.5	Very low	174 Å²	174	131.1 Å²	131.1	76%	0.757	69%	0.694	S	S	*	*			trans	-58.1	117.6	170.6	-66.6	-173.8	178	-177.2	0	105.4	I19 D23	I19-K21 VanDerWaalsContact C-N 3.29Å; I19-K21 PolarHBondContact O-N 3.1Å; K21-D23 PolarHBondContact O-N 3.16Å; K21-D23 VanDerWaalsContact O-N 3.17Å
22	P	50.7	Low	49.1	Very low	111 Å²	111	130.7 Å²	130.7	72%	0.721	69%	0.685	S	S	*	*			trans	-63.9	123	176.4	25.8	-31	0	0	0	107.1	T20 S24	T20-P22 VanDerWaalsContact O-CD 3.29Å; T20-P22 WeakPolarHBondContact O-CD 3.27Å; T20-P22 VanDerWaalsContact O-N 3.14Å; P22-S24 PolarHBondContact O-N 3.5Å
23	D	47.5	Very low	50.2	Low	149 Å²	149	123.2 Å²	123.2	80%	0.797	66%	0.663	S	S	*	*			trans	-67.9	41.5	175.4	-70.1	-42.1	0	0	0	112.3	K21 I25	K21-D23 PolarHBondContact O-N 3.16Å; K21-D23 VanDerWaalsContact O-N 3.17Å; D23-I25 PolarHBondContact O-N 2.86Å
24	S	46.3	Very low	51.1	Low	82 Å²	82	123.3 Å²	123.3	57%	0.573	66%	0.664	S	S	*	*			trans	-83.1	66.8	168.7	-175.3	0	0	0	0	109	P22 N26	P22-S24 PolarHBondContact O-N 3.5Å; S24-N26 PolarHBondContact O-N 3.33Å
25	I	46.6	Very low	52.5	Low	152 Å²	152	119.9 Å²	119.9	78%	0.779	65%	0.645	S	S	*	*			trans	-82.1	29	164.1	-32	174.2	0	0	0	109.7	D23 G27	D23-I25 PolarHBondContact O-N 2.86Å; I25-G27 PolarHBondContact O-N 2.8Å
26	N	47.8	Very low	54	Low	119 Å²	119	114.9 Å²	114.9	64%	0.636	62%	0.616	S	S	*	*			trans	-71.4	118.4	158	-72.5	-27	0	0	0	105.1	S24 D28	S24-N26 PolarHBondContact O-N 3.33Å; N26-D28 PolarHBondContact O-N 3Å
27	G	43.2	Very low	55.5	Low	67 Å²	67	112.4 Å²	112.4	69%	0.691	61%	0.607	S	S	*	*			trans	-62.8	45.9	170.7	0	0	0	0	0	112.7	I25 I29	I25-G27 PolarHBondContact O-N 2.8Å; G27-I29 PolarHBondContact O-N 2.5Å
28	D	49.9	Very low	57.3	Low	99 Å²	99	106.8 Å²	106.8	53%	0.529	58%	0.581	S	S	.	*			trans	-66.5	73.8	152.4	-72.6	-41.3	0	0	0	106.3	N26 N30 K80	N26-D28 PolarHBondContact O-N 3Å; D28-N30 PolarHBondContact O-N 2.83Å; D28-K80 IonicContact OD1-NZ 2.93Å; D28-K80 PolarHBondContact OD1-NZ 2.85Å
29	I	48.6	Very low	59.4	Low	125 Å²	125	100.8 Å²	100.8	64%	0.641	56%	0.562	S	S	*	*			trans	-32.1	116.2	151.1	-60.3	159.4	0	0	0	104.3	G27 I31	G27-I29 PolarHBondContact O-N 2.5Å; I29-I31 HydrophobicContact CB-CD1 4.32Å; I29-I31 HydrophobicContact CB-CG1 3.83Å; I29-I31 HydrophobicContact CG2-CD1 4.3Å; I29-I31 HydrophobicContact CG2-CG1 3.47Å; I29-I31 VanDerWaalsContact CG2-CG1 3.47Å; I29-I31 WeakPolarHBondContact O-CG1 3.33Å; I29-I31 PolarHBondContact O-N 3.33Å
30	N	49.4	Very low	61.3	Low	132 Å²	132	94.3 Å²	94.3	71%	0.706	53%	0.529	S	S	*	.			trans	-60.8	67.9	171.7	-120.4	-61.1	0	0	0	106.8	D28 K32	D28-N30 PolarHBondContact O-N 2.83Å; N30-K32 PolarHBondContact O-N 3.37Å
31	I	52.8	Low	63.2	Low	41 Å²	41	89.9 Å²	89.9	21%	0.21	50%	0.498	C	S	.	.			trans	-72	84.2	177.6	-63.2	173.1	0	0	0	103.4	I29 T33 L79 K80	I29-I31 HydrophobicContact CB-CD1 4.32Å; I29-I31 HydrophobicContact CB-CG1 3.83Å; I29-I31 HydrophobicContact CG2-CD1 4.3Å; I29-I31 HydrophobicContact CG2-CG1 3.47Å; I29-I31 VanDerWaalsContact CG2-CG1 3.47Å; I29-I31 WeakPolarHBondContact O-CG1 3.33Å; I29-I31 PolarHBondContact O-N 3.33Å; I31-T33 PolarHBondContact O-N 2.85Å; I31-T33 VanDerWaalsContact O-N 3.1Å; I31-L79 HydrophobicContact CG2-CD1 4.32Å; I31-K80 HydrophobicContact CD1-CG 3.8Å
32	K	55.9	Low	65.1	Low	156 Å²	156	81.6 Å²	81.6	68%	0.678	46%	0.463	S	S	*	.			trans	37.1	63.1	162.3	-64.1	-179.4	172.8	-173.8	0	113.4	N30 S34 L35	N30-K32 PolarHBondContact O-N 3.37Å; K32-S34 PolarHBondContact O-N 3.42Å; K32-S34 VanDerWaalsContact O-N 3.09Å; K32-L35 PolarHBondContact O-N 3.04Å
33	T	64	Low	66.8	Low	50 Å²	50	76.3 Å²	76.3	31%	0.307	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-50.3	-24.8	159.3	55.9	0	0	0	0	111.2	I31 L35 Y36 E72 I76	I31-T33 PolarHBondContact O-N 2.85Å; I31-T33 VanDerWaalsContact O-N 3.1Å; T33-L35 PolarHBondContact O-N 3.29Å; T33-Y36 PolarHBondContact O-N 2.96Å; T33-E72 WeakPolarHBondContact CA-OE1 3.43Å; T33-E72 WeakPolarHBondContact CB-OE1 3.38Å; T33-E72 WeakPolarHBondContact CG2-OE1 3.44Å; T33-I76 HydrophobicContact CG2-CD1 4.48Å
34	S	70.6	Confident	68.7	Low	98 Å²	98	70.8 Å²	70.8	69%	0.685	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-54.1	-21	176.7	-42.3	0	0	0	0	115.8	K32	K32-S34 PolarHBondContact O-N 3.42Å; K32-S34 VanDerWaalsContact O-N 3.09Å
35	L	78	Confident	70.5	Confident	53 Å²	53	71.8 Å²	71.8	28%	0.277	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-91	-18.4	178.1	-170.5	55.5	0	0	0	112.8	K32 T33 H37 Y42 F75	K32-L35 PolarHBondContact O-N 3.04Å; T33-L35 PolarHBondContact O-N 3.29Å; L35-H37 PolarHBondContact O-CD2 3.14Å; L35-Y42 HydrophobicContact CD2-CE2 3.8Å; L35-Y42 HydrophobicContact CG-CE2 4.27Å; L35-F75 HydrophobicContact CB-CE1 4.16Å; L35-F75 HydrophobicContact CB-CZ 4.19Å; L35-F75 HydrophobicContact CD2-CZ 3.96Å; L35-F75 HydrophobicContact CG-CE1 4.45Å; L35-F75 HydrophobicContact CG-CZ 3.99Å
36	Y	84.7	Confident	72.3	Confident	35 Å²	35	69.3 Å²	69.3	14%	0.137	39%	0.393	C	S	.	.			trans	-84.4	116.5	176.6	-176.6	-100.2	0	0	0	109.4	T33 G38 W49 Q70 E72 F75	T33-Y36 PolarHBondContact O-N 2.96Å; Y36-G38 VanDerWaalsContact CE1-CA 3.46Å; Y36-G38 VanDerWaalsContact CZ-C 3.49Å; Y36-W49 AromaticContact CD2-CH2 3.28Å; Y36-W49 HydrophobicContact CD2-CH2 3.28Å; Y36-W49 AromaticContact CD2-CZ2 3.72Å; Y36-W49 HydrophobicContact CD2-CZ2 3.72Å; Y36-W49 AromaticContact CD2-CZ3 3.79Å; Y36-W49 HydrophobicContact CD2-CZ3 3.79Å; Y36-W49 AromaticContact CE2-CH2 3.48Å; Y36-W49 HydrophobicContact CE2-CH2 3.48Å; Y36-W49 VanDerWaalsContact CE2-CH2 3.48Å; Y36-W49 AromaticContact CE2-CZ2 3.68Å; Y36-W49 HydrophobicContact CE2-CZ2 3.68Å; Y36-W49 HydrophobicContact CE2-CZ3 4.41Å; Y36-W49 HydrophobicContact CG-CH2 4.45Å; Y36-Q70 PolarHBondContact OH-O 3.09Å; Y36-E72 HydrophobicContact CD1-CB 3.62Å; Y36-E72 HydrophobicContact CD1-CG 3.7Å; Y36-E72 HydrophobicContact CD2-CB 4.34Å; Y36-E72 HydrophobicContact CD2-CG 4.45Å; Y36-E72 HydrophobicContact CE1-CB 3.62Å; Y36-E72 HydrophobicContact CE1-CG 4.25Å; Y36-E72 HydrophobicContact CE2-CB 4.35Å; Y36-E72 HydrophobicContact CG-CB 3.99Å; Y36-E72 HydrophobicContact CG-CG 3.82Å; Y36-E72 PolarHBondContact OH-N 2.65Å; Y36-F75 HydrophobicContact CD2-CB 4.05Å; Y36-F75 HydrophobicContact CD2-CD1 4.12Å; Y36-F75 HydrophobicContact CD2-CG 4.23Å; Y36-F75 HydrophobicContact CG-CD1 4.44Å
37	H	85	Confident	74.1	Confident	134 Å²	134	71.9 Å²	71.9	62%	0.62	39%	0.393	S	S	*	.			trans	-108.8	28.1	-178.2	-66.7	-73.2	0	0	0	113	L35 W49	L35-H37 PolarHBondContact O-CD2 3.14Å; H37-W49 HydrophobicContact CB-CG 4.23Å
38	G	88.4	Confident	76.1	Confident	20 Å²	20	74.2 Å²	74.2	21%	0.206	38%	0.384	C	S	.	.	S	Bend	trans	92.4	-174.2	-173.3	0	0	0	0	0	112.4	Y36 G40 W49	Y36-G38 VanDerWaalsContact CE1-CA 3.46Å; Y36-G38 VanDerWaalsContact CZ-C 3.49Å; G38-G40 PolarHBondContact O-N 3.24Å; G38-W49 WeakPolarHBondContact O-CZ2 2.99Å; G38-W49 PolarHBondContact O-NE1 3.03Å
39	P	87.8	Confident	77.9	Confident	64 Å²	64	70.5 Å²	70.5	42%	0.416	36%	0.363	S	S	.	.	S	Bend	trans	-56.4	129	-179.4	-25.4	35.7	0	0	0	111.5	Y52 F69	P39-Y52 VanDerWaalsContact C-CE2 3.44Å; P39-Y52 HydrophobicContact CB-CE2 3.79Å; P39-Y52 WeakPolarHBondContact O-CE2 3.16Å; P39-F69 WeakPolarHBondContact CA-O 3.42Å
40	G	89.5	Confident	79.7	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175	-169.5	-173.9	0	0	0	0	0	112.8	G38 Y52 F69	G38-G40 PolarHBondContact O-N 3.24Å; G40-Y52 VanDerWaalsContact CA-CZ 3.46Å; G40-Y52 PolarHBondContact N-OH 2.87Å; G40-F69 PolarHBondContact N-O 3.22Å; G40-F69 PolarHBondContact O-N 3.1Å
41	W	88.8	Confident	81.5	Confident	26 Å²	26	61.7 Å²	61.7	10%	0.098	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	130.3	179.8	-59.9	96.1	0	0	0	110.6	V50 Y52 L58 P59 A66 I67 D68	W41-V50 HydrophobicContact CB-CB 4.25Å; W41-V50 HydrophobicContact CB-CG1 4.46Å; W41-V50 PolarHBondContact N-O 3.28Å; W41-V50 PolarHBondContact O-N 3.39Å; W41-Y52 AromaticContact CD1-CD1 3.41Å; W41-Y52 VanDerWaalsContact CD1-CD1 3.41Å; W41-Y52 AromaticContact CD1-CE1 3.48Å; W41-Y52 VanDerWaalsContact CD1-CE1 3.48Å; W41-Y52 HydrophobicContact CD2-CE1 4.31Å; W41-Y52 AromaticContact CE2-CE1 3.68Å; W41-Y52 HydrophobicContact CG-CD1 4.48Å; W41-Y52 HydrophobicContact CG-CE1 4.2Å; W41-Y52 HydrophobicContact CZ2-CE1 4.25Å; W41-Y52 AromaticContact NE1-CD1 3.14Å; W41-Y52 AromaticContact NE1-CE1 3.17Å; W41-L58 HydrophobicContact CZ2-CD2 4.02Å; W41-P59 HydrophobicContact CB-CG 3.93Å; W41-P59 HydrophobicContact CD2-CG 3.45Å; W41-P59 VanDerWaalsContact CD2-CG 3.45Å; W41-P59 HydrophobicContact CE3-CG 4.15Å; W41-P59 HydrophobicContact CG-CG 3.3Å; W41-A66 HydrophobicContact CE3-CB 4.3Å; W41-I67 CarbonylContact C-O 3.59Å; W41-I67 WeakPolarHBondContact CA-O 3.47Å; W41-D68 HydrophobicContact CD2-CB 4.46Å; W41-D68 HydrophobicContact CE3-CB 3.79Å; W41-D68 HydrophobicContact CH2-CB 3.74Å; W41-D68 HydrophobicContact CZ2-CB 4.44Å; W41-D68 HydrophobicContact CZ3-CB 3.41Å; W41-D68 VanDerWaalsContact CZ3-CB 3.41Å
42	Y	90.6	Very high	83.1	Confident	1 Å²	1	63.8 Å²	63.8	0%	0.004	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.8	167.8	-176.9	-114.8	0	0	0	109.9	L35 P44 R47 K48 W49 A66 I67 F69 F75 F78 R82	L35-Y42 HydrophobicContact CD2-CE2 3.8Å; L35-Y42 HydrophobicContact CG-CE2 4.27Å; Y42-P44 HydrophobicContact CD1-CG 4.05Å; Y42-P44 HydrophobicContact CE1-CB 4.23Å; Y42-P44 HydrophobicContact CE1-CG 4.17Å; Y42-P44 WeakPolarHBondContact O-CD 3.39Å; Y42-R47 WeakPolarHBondContact OH-CA 3.46Å; Y42-K48 WeakPolarHBondContact CD2-O 3.46Å; Y42-W49 AromaticContact CD2-CE3 3.78Å; Y42-W49 HydrophobicContact CD2-CE3 3.78Å; Y42-W49 HydrophobicContact CD2-CZ3 4.2Å; Y42-W49 HydrophobicContact CG-CE3 4.25Å; Y42-W49 HydrophobicContact CG-CZ3 4.27Å; Y42-A66 WeakPolarHBondContact O-CA 3.35Å; Y42-I67 PolarHBondContact N-O 3.19Å; Y42-I67 PolarHBondContact O-N 3.01Å; Y42-F69 HydrophobicContact CD1-CE2 4.21Å; Y42-F69 HydrophobicContact CG-CE2 4.3Å; Y42-F75 AromaticContact CD1-CE2 3.9Å; Y42-F75 HydrophobicContact CD1-CE2 3.9Å; Y42-F75 AromaticContact CD2-CE2 3.74Å; Y42-F75 HydrophobicContact CD2-CE2 3.74Å; Y42-F75 HydrophobicContact CD2-CZ 4.21Å; Y42-F75 HydrophobicContact CE1-CE2 4.09Å; Y42-F75 AromaticContact CE2-CE2 3.93Å; Y42-F75 HydrophobicContact CE2-CE2 3.93Å; Y42-F75 HydrophobicContact CE2-CZ 4.12Å; Y42-F75 HydrophobicContact CG-CD2 4.39Å; Y42-F75 AromaticContact CG-CE2 3.71Å; Y42-F75 HydrophobicContact CG-CE2 3.71Å; Y42-F78 HydrophobicContact CD1-CD1 4.48Å; Y42-F78 AromaticContact CD1-CE1 3.96Å; Y42-F78 HydrophobicContact CD1-CE1 3.96Å; Y42-F78 HydrophobicContact CE1-CD1 4.46Å; Y42-F78 AromaticContact CE1-CE1 3.75Å; Y42-F78 HydrophobicContact CE1-CE1 3.75Å; Y42-R82 PolarHBondContact OH-NH1 3.36Å
43	V	88	Confident	84.5	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	103.7	175.9	-175.6	0	0	0	0	108.5	S45 E46 R47 K48 V50 N63 A66	V43-S45 VanDerWaalsContact C-N 3.35Å; V43-S45 PolarHBondContact O-N 3.27Å; V43-E46 HydrophobicContact CB-CB 4.3Å; V43-E46 HydrophobicContact CG1-CB 4.01Å; V43-E46 HydrophobicContact CG1-CG 3.92Å; V43-E46 PolarHBondContact O-N 2.94Å; V43-R47 WeakPolarHBondContact O-CA 3.5Å; V43-R47 PolarHBondContact O-N 3.2Å; V43-K48 PolarHBondContact N-O 3.32Å; V43-K48 PolarHBondContact O-N 3.49Å; V43-V50 HydrophobicContact CG2-CG2 4.11Å; V43-N63 HydrophobicContact CG1-CB 4.24Å; V43-N63 HydrophobicContact CG2-CB 4.29Å; V43-A66 HydrophobicContact CG2-CB 4.23Å
44	P	87.1	Confident	85.3	Confident	33 Å²	33	63.3 Å²	63.3	21%	0.214	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-36.4	-175.3	-24.5	35.3	0	0	0	114	Y42 R47 D65 I67 F78	Y42-P44 HydrophobicContact CD1-CG 4.05Å; Y42-P44 HydrophobicContact CE1-CB 4.23Å; Y42-P44 HydrophobicContact CE1-CG 4.17Å; Y42-P44 WeakPolarHBondContact O-CD 3.39Å; P44-R47 WeakPolarHBondContact O-CG 3.24Å; P44-R47 PolarHBondContact O-N 2.77Å; P44-D65 WeakPolarHBondContact CD-O 3.35Å; P44-D65 WeakPolarHBondContact CD-OD2 3.46Å; P44-I67 HydrophobicContact CG-CD1 3.78Å; P44-I67 HydrophobicContact CG-CG1 4.21Å; P44-F78 HydrophobicContact CG-CZ 4.14Å
45	S	83.7	Confident	85.4	Confident	102 Å²	102	62.5 Å²	62.5	71%	0.713	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-39.2	-179.7	-59.5	0	0	0	0	112.4	V43 D65	V43-S45 VanDerWaalsContact C-N 3.35Å; V43-S45 PolarHBondContact O-N 3.27Å; S45-D65 WeakPolarHBondContact CB-OD2 3.16Å; S45-D65 PolarHBondContact N-OD2 3.35Å; S45-D65 PolarHBondContact OG-OD2 3Å
46	E	84.9	Confident	84.9	Confident	101 Å²	101	66.6 Å²	66.6	47%	0.472	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-11.3	177.6	-63.4	177.2	-148.4	0	0	112.7	V43 K48 N63	V43-E46 HydrophobicContact CB-CB 4.3Å; V43-E46 HydrophobicContact CG1-CB 4.01Å; V43-E46 HydrophobicContact CG1-CG 3.92Å; V43-E46 PolarHBondContact O-N 2.94Å; E46-K48 HydrophobicContact CB-CB 3.92Å; E46-K48 PolarHBondContact O-N 2.57Å; E46-N63 PolarHBondContact OE1-ND2 2.91Å
47	R	84.7	Confident	84.2	Confident	172 Å²	172	68.1 Å²	68.1	65%	0.649	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	34	-169.6	-60.8	178.1	168.8	164.1	-3.6	112.8	Y42 V43 P44	Y42-R47 WeakPolarHBondContact OH-CA 3.46Å; V43-R47 WeakPolarHBondContact O-CA 3.5Å; V43-R47 PolarHBondContact O-N 3.2Å; P44-R47 WeakPolarHBondContact O-CG 3.24Å; P44-R47 PolarHBondContact O-N 2.77Å
48	K	85.6	Confident	83.3	Confident	116 Å²	116	67 Å²	67	50%	0.504	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	145.3	-171.9	-175.9	177.1	173.4	-172.5	0	111	Y42 V43 E46	Y42-K48 WeakPolarHBondContact CD2-O 3.46Å; V43-K48 PolarHBondContact N-O 3.32Å; V43-K48 PolarHBondContact O-N 3.49Å; E46-K48 HydrophobicContact CB-CB 3.92Å; E46-K48 PolarHBondContact O-N 2.57Å
49	W	87.6	Confident	82.1	Confident	21 Å²	21	66.2 Å²	66.2	8%	0.08	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	137.8	168.8	-158.4	-91.5	0	0	0	110.5	Y36 H37 G38 Y42 F69 F75	Y36-W49 AromaticContact CD2-CH2 3.28Å; Y36-W49 HydrophobicContact CD2-CH2 3.28Å; Y36-W49 AromaticContact CD2-CZ2 3.72Å; Y36-W49 HydrophobicContact CD2-CZ2 3.72Å; Y36-W49 AromaticContact CD2-CZ3 3.79Å; Y36-W49 HydrophobicContact CD2-CZ3 3.79Å; Y36-W49 AromaticContact CE2-CH2 3.48Å; Y36-W49 HydrophobicContact CE2-CH2 3.48Å; Y36-W49 VanDerWaalsContact CE2-CH2 3.48Å; Y36-W49 AromaticContact CE2-CZ2 3.68Å; Y36-W49 HydrophobicContact CE2-CZ2 3.68Å; Y36-W49 HydrophobicContact CE2-CZ3 4.41Å; Y36-W49 HydrophobicContact CG-CH2 4.45Å; H37-W49 HydrophobicContact CB-CG 4.23Å; G38-W49 WeakPolarHBondContact O-CZ2 2.99Å; G38-W49 PolarHBondContact O-NE1 3.03Å; Y42-W49 AromaticContact CD2-CE3 3.78Å; Y42-W49 HydrophobicContact CD2-CE3 3.78Å; Y42-W49 HydrophobicContact CD2-CZ3 4.2Å; Y42-W49 HydrophobicContact CG-CE3 4.25Å; Y42-W49 HydrophobicContact CG-CZ3 4.27Å; W49-F69 HydrophobicContact CH2-CB 3.56Å; W49-F69 HydrophobicContact CH2-CD2 4.03Å; W49-F69 HydrophobicContact CH2-CG 4.14Å; W49-F69 HydrophobicContact CZ2-CB 4.23Å; W49-F69 HydrophobicContact CZ3-CB 4.48Å; W49-F69 HydrophobicContact CZ3-CD2 4.19Å; W49-F75 HydrophobicContact CE3-CE2 4.29Å; W49-F75 HydrophobicContact CE3-CZ 4.38Å; W49-F75 HydrophobicContact CH2-CD2 4.38Å; W49-F75 HydrophobicContact CH2-CG 4.41Å; W49-F75 HydrophobicContact CZ3-CD1 4.3Å; W49-F75 AromaticContact CZ3-CD2 3.62Å; W49-F75 HydrophobicContact CZ3-CD2 3.62Å; W49-F75 HydrophobicContact CZ3-CE1 4.38Å; W49-F75 AromaticContact CZ3-CE2 3.74Å; W49-F75 HydrophobicContact CZ3-CE2 3.74Å; W49-F75 AromaticContact CZ3-CG 3.89Å; W49-F75 HydrophobicContact CZ3-CG 3.89Å; W49-F75 HydrophobicContact CZ3-CZ 4.1Å
50	V	87.4	Confident	80.7	Confident	3 Å²	3	70.6 Å²	70.6	2%	0.018	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	125	179.9	165.6	0	0	0	0	107.8	W41 V43 Y55	W41-V50 HydrophobicContact CB-CB 4.25Å; W41-V50 HydrophobicContact CB-CG1 4.46Å; W41-V50 PolarHBondContact N-O 3.28Å; W41-V50 PolarHBondContact O-N 3.39Å; V43-V50 HydrophobicContact CG2-CG2 4.11Å; V50-Y55 HydrophobicContact CB-CE2 4.32Å; V50-Y55 HydrophobicContact CG1-CD2 3.35Å; V50-Y55 HydrophobicContact CG1-CE2 3.2Å; V50-Y55 HydrophobicContact CG2-CE2 4.17Å
51	N	86.9	Confident	79.4	Confident	70 Å²	70	75.3 Å²	75.3	37%	0.374	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	154.2	176.8	-161.8	-8.3	0	0	0	110.4	S53 D54	N51-S53 PolarHBondContact ND2-OG 3.38Å; N51-S53 PolarHBondContact O-N 3.39Å; N51-D54 PolarHBondContact N-OD2 3.38Å; N51-D54 PolarHBondContact O-N 2.93Å
52	Y	86.6	Confident	78.5	Confident	84 Å²	84	77.8 Å²	77.8	33%	0.329	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-59.3	-30.4	174.4	-61.5	-50.3	0	0	0	112.8	P39 G40 W41 D54 D68 Q70	P39-Y52 VanDerWaalsContact C-CE2 3.44Å; P39-Y52 HydrophobicContact CB-CE2 3.79Å; P39-Y52 WeakPolarHBondContact O-CE2 3.16Å; G40-Y52 VanDerWaalsContact CA-CZ 3.46Å; G40-Y52 PolarHBondContact N-OH 2.87Å; W41-Y52 AromaticContact CD1-CD1 3.41Å; W41-Y52 VanDerWaalsContact CD1-CD1 3.41Å; W41-Y52 AromaticContact CD1-CE1 3.48Å; W41-Y52 VanDerWaalsContact CD1-CE1 3.48Å; W41-Y52 HydrophobicContact CD2-CE1 4.31Å; W41-Y52 AromaticContact CE2-CE1 3.68Å; W41-Y52 HydrophobicContact CG-CD1 4.48Å; W41-Y52 HydrophobicContact CG-CE1 4.2Å; W41-Y52 HydrophobicContact CZ2-CE1 4.25Å; W41-Y52 AromaticContact NE1-CD1 3.14Å; W41-Y52 AromaticContact NE1-CE1 3.17Å; Y52-D54 VanDerWaalsContact C-N 3.26Å; Y52-D54 PolarHBondContact O-N 3.38Å; Y52-D68 WeakPolarHBondContact CE1-OD1 2.96Å; Y52-D68 PolarHBondContact OH-OD1 3.27Å; Y52-Q70 PolarHBondContact OH-NE2 2.9Å
53	S	84.2	Confident	77.7	Confident	88 Å²	88	79.1 Å²	79.1	62%	0.615	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-65.2	-27.1	178.8	52.7	0	0	0	0	114.1	N51 Y55	N51-S53 PolarHBondContact ND2-OG 3.38Å; N51-S53 PolarHBondContact O-N 3.39Å; S53-Y55 VanDerWaalsContact C-N 3.27Å; S53-Y55 PolarHBondContact O-N 3.15Å
54	D	80.9	Confident	77.4	Confident	108 Å²	108	89.9 Å²	89.9	58%	0.578	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-78.2	-17.4	-168.7	-58.1	-17.5	0	0	0	112	N51 Y52	N51-D54 PolarHBondContact N-OD2 3.38Å; N51-D54 PolarHBondContact O-N 2.93Å; Y52-D54 VanDerWaalsContact C-N 3.26Å; Y52-D54 PolarHBondContact O-N 3.38Å
55	Y	72.9	Confident	77.3	Confident	81 Å²	81	90.9 Å²	90.9	32%	0.318	46%	0.46	S	S	.	.			trans	-124.5	128	-177.9	-70.7	-97.2	0	0	0	111.3	V50 S53 S57 T62	V50-Y55 HydrophobicContact CB-CE2 4.32Å; V50-Y55 HydrophobicContact CG1-CD2 3.35Å; V50-Y55 HydrophobicContact CG1-CE2 3.2Å; V50-Y55 HydrophobicContact CG2-CE2 4.17Å; S53-Y55 VanDerWaalsContact C-N 3.27Å; S53-Y55 PolarHBondContact O-N 3.15Å; Y55-S57 VanDerWaalsContact CB-O 3.27Å; Y55-S57 WeakPolarHBondContact CB-O 3.5Å; Y55-S57 PolarHBondContact O-N 2.92Å; Y55-T62 HydrophobicContact CE1-CG2 4.19Å
56	S	68.3	Low	77.5	Confident	140 Å²	140	86.2 Å²	86.2	98%	0.979	43%	0.428	S	S	*	.	S	Bend	trans	-72.2	-14.6	172.1	-174.2	0	0	0	0	113.1
57	S	68.3	Low	77.8	Confident	66 Å²	66	84.1 Å²	84.1	46%	0.462	42%	0.419	S	S	.	.	S	Bend	trans	-134.9	161.4	179.7	71.2	0	0	0	0	110.7	Y55	Y55-S57 VanDerWaalsContact CB-O 3.27Å; Y55-S57 WeakPolarHBondContact CB-O 3.5Å; Y55-S57 PolarHBondContact O-N 2.92Å
58	L	66.5	Low	78	Confident	112 Å²	112	78.9 Å²	78.9	59%	0.586	40%	0.404	S	S	*	.			trans	-55.6	125.6	-178.3	-67.5	170.5	0	0	0	110.4	W41 R60 T61	W41-L58 HydrophobicContact CZ2-CD2 4.02Å; L58-R60 PolarHBondContact O-N 2.87Å; L58-T61 PolarHBondContact O-N 2.7Å; L58-T61 PolarHBondContact O-OG1 3.49Å
59	P	63.3	Low	78.3	Confident	3 Å²	3	74.1 Å²	74.1	2%	0.019	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-9	-177.2	22	-29.8	0	0	0	112.9	W41 T61 T62 N63 A66	W41-P59 HydrophobicContact CB-CG 3.93Å; W41-P59 HydrophobicContact CD2-CG 3.45Å; W41-P59 VanDerWaalsContact CD2-CG 3.45Å; W41-P59 HydrophobicContact CE3-CG 4.15Å; W41-P59 HydrophobicContact CG-CG 3.3Å; P59-T61 PolarHBondContact O-N 3.19Å; P59-T61 VanDerWaalsContact O-N 3.13Å; P59-T62 PolarHBondContact O-N 3.22Å; P59-T62 VanDerWaalsContact O-N 3.16Å; P59-T62 PolarHBondContact O-OG1 3.37Å; P59-T62 VanDerWaalsContact O-OG1 3.1Å; P59-N63 CarbonylContact O-C 3.27Å; P59-N63 VanDerWaalsContact O-C 3.27Å; P59-N63 WeakPolarHBondContact O-CA 3.38Å; P59-N63 PolarHBondContact O-N 2.97Å; P59-A66 HydrophobicContact CB-CB 4.24Å; P59-A66 HydrophobicContact CG-CB 4.32Å
60	R	58.7	Low	78.4	Confident	155 Å²	155	78.3 Å²	78.3	59%	0.585	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-23.2	169.5	-71.2	-177.6	173.2	-124.3	-0.6	113.6	L58	L58-R60 PolarHBondContact O-N 2.87Å
61	T	62.6	Low	78.5	Confident	100 Å²	100	80 Å²	80	61%	0.613	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-40.3	176.1	57.4	0	0	0	0	112	L58 P59	L58-T61 PolarHBondContact O-N 2.7Å; L58-T61 PolarHBondContact O-OG1 3.49Å; P59-T61 PolarHBondContact O-N 3.19Å; P59-T61 VanDerWaalsContact O-N 3.13Å
62	T	69.9	Low	78.5	Confident	77 Å²	77	80 Å²	80	47%	0.472	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-50.7	178.7	48	0	0	0	0	111.7	Y55 P59	Y55-T62 HydrophobicContact CE1-CG2 4.19Å; P59-T62 PolarHBondContact O-N 3.22Å; P59-T62 VanDerWaalsContact O-N 3.16Å; P59-T62 PolarHBondContact O-OG1 3.37Å; P59-T62 VanDerWaalsContact O-OG1 3.1Å
63	N	74.2	Confident	78.6	Confident	30 Å²	30	84.2 Å²	84.2	16%	0.16	43%	0.434	C	S	.	.			trans	-120.9	93.7	-177.8	-70.1	-9.7	0	0	0	110.3	V43 E46 P59 D65 A66	V43-N63 HydrophobicContact CG1-CB 4.24Å; V43-N63 HydrophobicContact CG2-CB 4.29Å; E46-N63 PolarHBondContact OE1-ND2 2.91Å; P59-N63 CarbonylContact O-C 3.27Å; P59-N63 VanDerWaalsContact O-C 3.27Å; P59-N63 WeakPolarHBondContact O-CA 3.38Å; P59-N63 PolarHBondContact O-N 2.97Å; N63-D65 PolarHBondContact O-N 2.94Å; N63-D65 VanDerWaalsContact O-N 3.14Å; N63-A66 HydrophobicContact CB-CB 4.28Å; N63-A66 VanDerWaalsContact O-CB 3.24Å; N63-A66 WeakPolarHBondContact O-CB 3.45Å; N63-A66 PolarHBondContact O-N 3.24Å
64	R	80.3	Confident	78.8	Confident	226 Å²	226	83.9 Å²	83.9	85%	0.853	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.8	-175.6	-67.6	-174.8	178.7	-174.5	0.2	114.1
65	D	85.8	Confident	79.1	Confident	54 Å²	54	78.8 Å²	78.8	29%	0.289	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	1.2	178.9	68.7	-39.7	0	0	0	113.4	P44 S45 N63 I67	P44-D65 WeakPolarHBondContact CD-O 3.35Å; P44-D65 WeakPolarHBondContact CD-OD2 3.46Å; S45-D65 WeakPolarHBondContact CB-OD2 3.16Å; S45-D65 PolarHBondContact N-OD2 3.35Å; S45-D65 PolarHBondContact OG-OD2 3Å; N63-D65 PolarHBondContact O-N 2.94Å; N63-D65 VanDerWaalsContact O-N 3.14Å; D65-I67 WeakPolarHBondContact O-CG1 3.35Å; D65-I67 PolarHBondContact O-N 3.28Å
66	A	88.6	Confident	79.7	Confident	4 Å²	4	76.6 Å²	76.6	3%	0.033	39%	0.392	C	S	.	.			trans	-61.7	130.9	178.1	0	0	0	0	0	111.8	W41 Y42 V43 P59 N63	W41-A66 HydrophobicContact CE3-CB 4.3Å; Y42-A66 WeakPolarHBondContact O-CA 3.35Å; V43-A66 HydrophobicContact CG2-CB 4.23Å; P59-A66 HydrophobicContact CB-CB 4.24Å; P59-A66 HydrophobicContact CG-CB 4.32Å; N63-A66 HydrophobicContact CB-CB 4.28Å; N63-A66 VanDerWaalsContact O-CB 3.24Å; N63-A66 WeakPolarHBondContact O-CB 3.45Å; N63-A66 PolarHBondContact O-N 3.24Å
67	I	89.8	Confident	80.5	Confident	56 Å²	56	72.2 Å²	72.2	29%	0.287	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.3	-178.4	-54.3	176.9	0	0	0	109	W41 Y42 P44 D65 F69 F78	W41-I67 CarbonylContact C-O 3.59Å; W41-I67 WeakPolarHBondContact CA-O 3.47Å; Y42-I67 PolarHBondContact N-O 3.19Å; Y42-I67 PolarHBondContact O-N 3.01Å; P44-I67 HydrophobicContact CG-CD1 3.78Å; P44-I67 HydrophobicContact CG-CG1 4.21Å; D65-I67 WeakPolarHBondContact O-CG1 3.35Å; D65-I67 PolarHBondContact O-N 3.28Å; I67-F69 HydrophobicContact CB-CD2 4.38Å; I67-F69 HydrophobicContact CB-CE2 3.77Å; I67-F69 HydrophobicContact CB-CZ 4.27Å; I67-F69 HydrophobicContact CG2-CD2 4.14Å; I67-F69 HydrophobicContact CG2-CE1 4.26Å; I67-F69 HydrophobicContact CG2-CE2 3.55Å; I67-F69 HydrophobicContact CG2-CZ 3.62Å; I67-F78 HydrophobicContact CD1-CD2 4.3Å; I67-F78 HydrophobicContact CD1-CE2 3.57Å; I67-F78 HydrophobicContact CD1-CZ 3.76Å
68	D	90.5	Very high	81.4	Confident	63 Å²	63	71.4 Å²	71.4	34%	0.337	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	134.4	175.7	-165.6	31.5	0	0	0	110.8	W41 Y52 Q70	W41-D68 HydrophobicContact CD2-CB 4.46Å; W41-D68 HydrophobicContact CE3-CB 3.79Å; W41-D68 HydrophobicContact CH2-CB 3.74Å; W41-D68 HydrophobicContact CZ2-CB 4.44Å; W41-D68 HydrophobicContact CZ3-CB 3.41Å; W41-D68 VanDerWaalsContact CZ3-CB 3.41Å; Y52-D68 WeakPolarHBondContact CE1-OD1 2.96Å; Y52-D68 PolarHBondContact OH-OD1 3.27Å; D68-Q70 PolarHBondContact OD1-NE2 3.16Å; D68-Q70 PolarHBondContact OD2-NE2 3.21Å
69	F	91.2	Very high	82.2	Confident	15 Å²	15	66.3 Å²	66.3	7%	0.066	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	119.6	175.1	-74.1	-70.9	0	0	0	110.1	P39 G40 Y42 W49 I67 D74 F75 F78	P39-F69 WeakPolarHBondContact CA-O 3.42Å; G40-F69 PolarHBondContact N-O 3.22Å; G40-F69 PolarHBondContact O-N 3.1Å; Y42-F69 HydrophobicContact CD1-CE2 4.21Å; Y42-F69 HydrophobicContact CG-CE2 4.3Å; W49-F69 HydrophobicContact CH2-CB 3.56Å; W49-F69 HydrophobicContact CH2-CD2 4.03Å; W49-F69 HydrophobicContact CH2-CG 4.14Å; W49-F69 HydrophobicContact CZ2-CB 4.23Å; W49-F69 HydrophobicContact CZ3-CB 4.48Å; W49-F69 HydrophobicContact CZ3-CD2 4.19Å; I67-F69 HydrophobicContact CB-CD2 4.38Å; I67-F69 HydrophobicContact CB-CE2 3.77Å; I67-F69 HydrophobicContact CB-CZ 4.27Å; I67-F69 HydrophobicContact CG2-CD2 4.14Å; I67-F69 HydrophobicContact CG2-CE1 4.26Å; I67-F69 HydrophobicContact CG2-CE2 3.55Å; I67-F69 HydrophobicContact CG2-CZ 3.62Å; F69-D74 HydrophobicContact CD1-CB 4.01Å; F69-D74 HydrophobicContact CE1-CB 4.38Å; F69-F75 HydrophobicContact CD1-CB 4.06Å; F69-F75 HydrophobicContact CD2-CD2 4.03Å; F69-F75 HydrophobicContact CE1-CB 4.39Å; F69-F75 AromaticContact CE2-CD2 3.92Å; F69-F75 HydrophobicContact CE2-CD2 3.92Å; F69-F75 HydrophobicContact CG-CB 4.17Å; F69-F75 HydrophobicContact CG-CD2 4.44Å; F69-F75 HydrophobicContact CZ-CD2 4.25Å; F69-F78 HydrophobicContact CE1-CB 3.9Å; F69-F78 HydrophobicContact CE1-CG 4.35Å; F69-F78 HydrophobicContact CE2-CD1 4.45Å; F69-F78 HydrophobicContact CZ-CB 3.66Å; F69-F78 AromaticContact CZ-CD1 3.93Å; F69-F78 HydrophobicContact CZ-CD1 3.93Å; F69-F78 HydrophobicContact CZ-CD2 4.12Å; F69-F78 AromaticContact CZ-CG 3.62Å; F69-F78 HydrophobicContact CZ-CG 3.62Å
70	Q	90.3	Very high	83	Confident	109 Å²	109	69.7 Å²	69.7	51%	0.509	34%	0.337	S	S	.	.	S	Bend	trans	-94.3	-24.4	178	-61.6	-59.8	-31.1	0	0	112.7	Y36 Y52 D68	Y36-Q70 PolarHBondContact OH-O 3.09Å; Y52-Q70 PolarHBondContact OH-NE2 2.9Å; D68-Q70 PolarHBondContact OD1-NE2 3.16Å; D68-Q70 PolarHBondContact OD2-NE2 3.21Å
71	S	88.1	Confident	84.2	Confident	40 Å²	40	69.6 Å²	69.6	28%	0.28	34%	0.34	S	S	.	.			trans	-129.6	144.6	-178.9	88.2	0	0	0	0	111.4	K73 D74 F75	S71-K73 PolarHBondContact O-N 3.28Å; S71-D74 PolarHBondContact O-N 3.04Å; S71-D74 PolarHBondContact OG-N 2.87Å; S71-D74 PolarHBondContact OG-OD2 3.4Å; S71-F75 PolarHBondContact O-N 3.41Å
72	E	87.2	Confident	84.9	Confident	70 Å²	70	69.1 Å²	69.1	33%	0.327	33%	0.328	S	S	.	.	H	α-helix	trans	-63	-34.8	176.2	-172.7	173	-170.6	0	0	111.7	T33 Y36 D74 F75 I76	T33-E72 WeakPolarHBondContact CA-OE1 3.43Å; T33-E72 WeakPolarHBondContact CB-OE1 3.38Å; T33-E72 WeakPolarHBondContact CG2-OE1 3.44Å; Y36-E72 HydrophobicContact CD1-CB 3.62Å; Y36-E72 HydrophobicContact CD1-CG 3.7Å; Y36-E72 HydrophobicContact CD2-CB 4.34Å; Y36-E72 HydrophobicContact CD2-CG 4.45Å; Y36-E72 HydrophobicContact CE1-CB 3.62Å; Y36-E72 HydrophobicContact CE1-CG 4.25Å; Y36-E72 HydrophobicContact CE2-CB 4.35Å; Y36-E72 HydrophobicContact CG-CB 3.99Å; Y36-E72 HydrophobicContact CG-CG 3.82Å; Y36-E72 PolarHBondContact OH-N 2.65Å; E72-D74 VanDerWaalsContact C-N 3.3Å; E72-D74 PolarHBondContact O-N 2.9Å; E72-F75 WeakPolarHBondContact O-CB 3.43Å; E72-F75 PolarHBondContact O-N 3.18Å; E72-I76 HydrophobicContact CG-CD1 3.92Å; E72-I76 HydrophobicContact CG-CG1 4.33Å; E72-I76 WeakPolarHBondContact O-CG1 2.96Å; E72-I76 PolarHBondContact O-N 2.87Å
73	K	88.3	Confident	84.8	Confident	172 Å²	172	69.9 Å²	69.9	75%	0.748	33%	0.329	S	S	*	.	H	α-helix	trans	-60.2	-41.5	179.1	-174.2	-179.8	178.9	-178.7	0	111.6	S71 I76 S77	S71-K73 PolarHBondContact O-N 3.28Å; K73-I76 PolarHBondContact O-N 3.1Å; K73-S77 WeakPolarHBondContact O-CB 3.5Å; K73-S77 PolarHBondContact O-N 3.18Å
74	D	88.3	Confident	84.6	Confident	81 Å²	81	73.4 Å²	73.4	43%	0.433	35%	0.346	S	S	.	.	H	α-helix	trans	-66	-43	177.7	-63.4	-36.8	0	0	0	110.7	F69 S71 E72 S77 F78	F69-D74 HydrophobicContact CD1-CB 4.01Å; F69-D74 HydrophobicContact CE1-CB 4.38Å; S71-D74 PolarHBondContact O-N 3.04Å; S71-D74 PolarHBondContact OG-N 2.87Å; S71-D74 PolarHBondContact OG-OD2 3.4Å; E72-D74 VanDerWaalsContact C-N 3.3Å; E72-D74 PolarHBondContact O-N 2.9Å; D74-S77 PolarHBondContact O-N 3.43Å; D74-S77 PolarHBondContact O-OG 3.45Å; D74-F78 PolarHBondContact O-N 3.49Å
75	F	87.9	Confident	83.6	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.5	-45.6	176.4	176.5	-115.6	0	0	0	112.4	L35 Y36 Y42 W49 F69 S71 E72 S77 F78 L79	L35-F75 HydrophobicContact CB-CE1 4.16Å; L35-F75 HydrophobicContact CB-CZ 4.19Å; L35-F75 HydrophobicContact CD2-CZ 3.96Å; L35-F75 HydrophobicContact CG-CE1 4.45Å; L35-F75 HydrophobicContact CG-CZ 3.99Å; Y36-F75 HydrophobicContact CD2-CB 4.05Å; Y36-F75 HydrophobicContact CD2-CD1 4.12Å; Y36-F75 HydrophobicContact CD2-CG 4.23Å; Y36-F75 HydrophobicContact CG-CD1 4.44Å; Y42-F75 AromaticContact CD1-CE2 3.9Å; Y42-F75 HydrophobicContact CD1-CE2 3.9Å; Y42-F75 AromaticContact CD2-CE2 3.74Å; Y42-F75 HydrophobicContact CD2-CE2 3.74Å; Y42-F75 HydrophobicContact CD2-CZ 4.21Å; Y42-F75 HydrophobicContact CE1-CE2 4.09Å; Y42-F75 AromaticContact CE2-CE2 3.93Å; Y42-F75 HydrophobicContact CE2-CE2 3.93Å; Y42-F75 HydrophobicContact CE2-CZ 4.12Å; Y42-F75 HydrophobicContact CG-CD2 4.39Å; Y42-F75 AromaticContact CG-CE2 3.71Å; Y42-F75 HydrophobicContact CG-CE2 3.71Å; W49-F75 HydrophobicContact CE3-CE2 4.29Å; W49-F75 HydrophobicContact CE3-CZ 4.38Å; W49-F75 HydrophobicContact CH2-CD2 4.38Å; W49-F75 HydrophobicContact CH2-CG 4.41Å; W49-F75 HydrophobicContact CZ3-CD1 4.3Å; W49-F75 AromaticContact CZ3-CD2 3.62Å; W49-F75 HydrophobicContact CZ3-CD2 3.62Å; W49-F75 HydrophobicContact CZ3-CE1 4.38Å; W49-F75 AromaticContact CZ3-CE2 3.74Å; W49-F75 HydrophobicContact CZ3-CE2 3.74Å; W49-F75 AromaticContact CZ3-CG 3.89Å; W49-F75 HydrophobicContact CZ3-CG 3.89Å; W49-F75 HydrophobicContact CZ3-CZ 4.1Å; F69-F75 HydrophobicContact CD1-CB 4.06Å; F69-F75 HydrophobicContact CD2-CD2 4.03Å; F69-F75 HydrophobicContact CE1-CB 4.39Å; F69-F75 AromaticContact CE2-CD2 3.92Å; F69-F75 HydrophobicContact CE2-CD2 3.92Å; F69-F75 HydrophobicContact CG-CB 4.17Å; F69-F75 HydrophobicContact CG-CD2 4.44Å; F69-F75 HydrophobicContact CZ-CD2 4.25Å; S71-F75 PolarHBondContact O-N 3.41Å; E72-F75 WeakPolarHBondContact O-CB 3.43Å; E72-F75 PolarHBondContact O-N 3.18Å; F75-S77 VanDerWaalsContact C-N 3.31Å; F75-S77 PolarHBondContact O-N 2.95Å; F75-F78 WeakPolarHBondContact O-CB 3.39Å; F75-F78 PolarHBondContact O-N 3.34Å; F75-F78 VanDerWaalsContact O-N 3.15Å; F75-L79 HydrophobicContact CD1-CD1 4.18Å; F75-L79 HydrophobicContact CD2-CG 4.46Å; F75-L79 HydrophobicContact CE1-CD1 3.55Å; F75-L79 HydrophobicContact CE1-CG 4.19Å; F75-L79 HydrophobicContact CE2-CD1 4.23Å; F75-L79 HydrophobicContact CE2-CD2 4.1Å; F75-L79 HydrophobicContact CE2-CG 4.03Å; F75-L79 HydrophobicContact CZ-CD1 3.59Å; F75-L79 HydrophobicContact CZ-CD2 4.09Å; F75-L79 HydrophobicContact CZ-CG 3.9Å; F75-L79 PolarHBondContact O-N 3.46Å
76	I	84.6	Confident	82.5	Confident	36 Å²	36	70.7 Å²	70.7	19%	0.185	35%	0.354	C	S	.	.	H	α-helix	trans	-61	-42.3	175.2	-67.4	167.8	0	0	0	110.5	T33 E72 K73 F78 L79 K80	T33-I76 HydrophobicContact CG2-CD1 4.48Å; E72-I76 HydrophobicContact CG-CD1 3.92Å; E72-I76 HydrophobicContact CG-CG1 4.33Å; E72-I76 WeakPolarHBondContact O-CG1 2.96Å; E72-I76 PolarHBondContact O-N 2.87Å; K73-I76 PolarHBondContact O-N 3.1Å; I76-F78 VanDerWaalsContact C-N 3.26Å; I76-F78 PolarHBondContact O-N 3.13Å; I76-L79 PolarHBondContact O-N 3.09Å; I76-K80 HydrophobicContact CG2-CD 4.22Å; I76-K80 HydrophobicContact CG2-CG 4.41Å; I76-K80 WeakPolarHBondContact O-CB 3.25Å; I76-K80 WeakPolarHBondContact O-CG 3.33Å; I76-K80 PolarHBondContact O-N 2.94Å
77	S	85.4	Confident	80.9	Confident	47 Å²	47	78 Å²	78	33%	0.329	38%	0.381	S	S	.	.	H	α-helix	trans	-62.4	-36.5	177.6	85.5	0	0	0	0	112	K73 D74 F75 K81	K73-S77 WeakPolarHBondContact O-CB 3.5Å; K73-S77 PolarHBondContact O-N 3.18Å; D74-S77 PolarHBondContact O-N 3.43Å; D74-S77 PolarHBondContact O-OG 3.45Å; F75-S77 VanDerWaalsContact C-N 3.31Å; F75-S77 PolarHBondContact O-N 2.95Å; S77-K81 WeakPolarHBondContact O-CG 3.24Å; S77-K81 PolarHBondContact O-N 2.96Å
78	F	87.3	Confident	79.4	Confident	49 Å²	49	83.4 Å²	83.4	22%	0.215	40%	0.403	C	S	.	.	H	α-helix	trans	-66.8	-46.9	175.1	170.4	-94.1	0	0	0	111.3	Y42 P44 I67 F69 D74 F75 I76 K80 K81 R82	Y42-F78 HydrophobicContact CD1-CD1 4.48Å; Y42-F78 AromaticContact CD1-CE1 3.96Å; Y42-F78 HydrophobicContact CD1-CE1 3.96Å; Y42-F78 HydrophobicContact CE1-CD1 4.46Å; Y42-F78 AromaticContact CE1-CE1 3.75Å; Y42-F78 HydrophobicContact CE1-CE1 3.75Å; P44-F78 HydrophobicContact CG-CZ 4.14Å; I67-F78 HydrophobicContact CD1-CD2 4.3Å; I67-F78 HydrophobicContact CD1-CE2 3.57Å; I67-F78 HydrophobicContact CD1-CZ 3.76Å; F69-F78 HydrophobicContact CE1-CB 3.9Å; F69-F78 HydrophobicContact CE1-CG 4.35Å; F69-F78 HydrophobicContact CE2-CD1 4.45Å; F69-F78 HydrophobicContact CZ-CB 3.66Å; F69-F78 AromaticContact CZ-CD1 3.93Å; F69-F78 HydrophobicContact CZ-CD1 3.93Å; F69-F78 HydrophobicContact CZ-CD2 4.12Å; F69-F78 AromaticContact CZ-CG 3.62Å; F69-F78 HydrophobicContact CZ-CG 3.62Å; D74-F78 PolarHBondContact O-N 3.49Å; F75-F78 WeakPolarHBondContact O-CB 3.39Å; F75-F78 PolarHBondContact O-N 3.34Å; F75-F78 VanDerWaalsContact O-N 3.15Å; I76-F78 VanDerWaalsContact C-N 3.26Å; I76-F78 PolarHBondContact O-N 3.13Å; F78-K80 PolarHBondContact O-N 3.49Å; F78-K81 PolarHBondContact O-N 3.25Å; F78-R82 PolarHBondContact O-N 3.18Å
79	L	83.5	Confident	77.8	Confident	6 Å²	6	87.5 Å²	87.5	3%	0.031	42%	0.418	C	S	.	.	H	α-helix	trans	-60.7	-43.8	175.8	-69.9	-175.7	0	0	0	111.8	I31 F75 I76 K81 R82 D83	I31-L79 HydrophobicContact CG2-CD1 4.32Å; F75-L79 HydrophobicContact CD1-CD1 4.18Å; F75-L79 HydrophobicContact CD2-CG 4.46Å; F75-L79 HydrophobicContact CE1-CD1 3.55Å; F75-L79 HydrophobicContact CE1-CG 4.19Å; F75-L79 HydrophobicContact CE2-CD1 4.23Å; F75-L79 HydrophobicContact CE2-CD2 4.1Å; F75-L79 HydrophobicContact CE2-CG 4.03Å; F75-L79 HydrophobicContact CZ-CD1 3.59Å; F75-L79 HydrophobicContact CZ-CD2 4.09Å; F75-L79 HydrophobicContact CZ-CG 3.9Å; F75-L79 PolarHBondContact O-N 3.46Å; I76-L79 PolarHBondContact O-N 3.09Å; L79-K81 VanDerWaalsContact C-N 3.32Å; L79-K81 PolarHBondContact O-N 3.46Å; L79-R82 PolarHBondContact O-N 2.88Å; L79-D83 WeakPolarHBondContact O-CB 3.4Å; L79-D83 PolarHBondContact O-N 3.45Å
80	K	81.5	Confident	76.2	Confident	73 Å²	73	92.9 Å²	92.9	32%	0.317	45%	0.446	S	S	.	.	H	α-helix	trans	-55.3	-48.6	173.8	-74.7	179.1	179.8	179.3	0	110.2	D28 I31 I76 F78 R82 I84	D28-K80 IonicContact OD1-NZ 2.93Å; D28-K80 PolarHBondContact OD1-NZ 2.85Å; I31-K80 HydrophobicContact CD1-CG 3.8Å; I76-K80 HydrophobicContact CG2-CD 4.22Å; I76-K80 HydrophobicContact CG2-CG 4.41Å; I76-K80 WeakPolarHBondContact O-CB 3.25Å; I76-K80 WeakPolarHBondContact O-CG 3.33Å; I76-K80 PolarHBondContact O-N 2.94Å; F78-K80 PolarHBondContact O-N 3.49Å; K80-R82 PolarHBondContact O-N 3.26Å; K80-I84 WeakPolarHBondContact O-CB 3.44Å; K80-I84 VanDerWaalsContact O-CD1 3.22Å; K80-I84 WeakPolarHBondContact O-CD1 3.42Å; K80-I84 WeakPolarHBondContact O-CG1 3.38Å; K80-I84 PolarHBondContact O-N 2.93Å
81	K	82.2	Confident	74.6	Confident	153 Å²	153	94.1 Å²	94.1	67%	0.665	46%	0.461	S	S	*	.	H	α-helix	trans	-62.8	-37.9	177.8	-72.8	171.6	-176.7	173.7	0	113.7	S77 F78 L79	S77-K81 WeakPolarHBondContact O-CG 3.24Å; S77-K81 PolarHBondContact O-N 2.96Å; F78-K81 PolarHBondContact O-N 3.25Å; L79-K81 VanDerWaalsContact C-N 3.32Å; L79-K81 PolarHBondContact O-N 3.46Å
82	R	77.3	Confident	73.2	Confident	91 Å²	91	95.1 Å²	95.1	34%	0.343	47%	0.472	S	S	.	.	H	α-helix	trans	-71.2	-43.6	-179.6	-170.4	-168.9	71.5	-176	-5.5	112	Y42 F78 L79 K80	Y42-R82 PolarHBondContact OH-NH1 3.36Å; F78-R82 PolarHBondContact O-N 3.18Å; L79-R82 PolarHBondContact O-N 2.88Å; K80-R82 PolarHBondContact O-N 3.26Å
83	D	69.3	Low	72.2	Confident	93 Å²	93	100.7 Å²	100.7	50%	0.497	49%	0.491	S	S	.	.	H	α-helix	trans	-85.5	-14.3	-175.6	-63.8	-5.6	0	0	0	111.8	L79 P85	L79-D83 WeakPolarHBondContact O-CB 3.4Å; L79-D83 PolarHBondContact O-N 3.45Å; D83-P85 WeakPolarHBondContact O-CD 3.45Å; D83-P85 VanDerWaalsContact O-N 3.11Å
84	I	68.5	Low	71.1	Confident	103 Å²	103	100.7 Å²	100.7	53%	0.528	49%	0.491	S	S	.	.	S	Bend	trans	-60.7	115.8	164.5	-74.9	157.1	0	0	0	106.5	K80 N86	K80-I84 WeakPolarHBondContact O-CB 3.44Å; K80-I84 VanDerWaalsContact O-CD1 3.22Å; K80-I84 WeakPolarHBondContact O-CD1 3.42Å; K80-I84 WeakPolarHBondContact O-CG1 3.38Å; K80-I84 PolarHBondContact O-N 2.93Å; I84-N86 PolarHBondContact O-N 2.68Å
85	P	59.8	Low	70.1	Confident	88 Å²	88	100.3 Å²	100.3	57%	0.571	49%	0.493	S	S	*	.			trans	-59.5	109	168.8	23.8	-29.3	0	0	0	105.5	D83 Y87	D83-P85 WeakPolarHBondContact O-CD 3.45Å; D83-P85 VanDerWaalsContact O-N 3.11Å; P85-Y87 HydrophobicContact CB-CD1 4.08Å; P85-Y87 HydrophobicContact CG-CD1 3.94Å; P85-Y87 HydrophobicContact CG-CE1 4.47Å; P85-Y87 WeakPolarHBondContact O-CD1 3.22Å; P85-Y87 PolarHBondContact O-N 2.61Å
86	N	62.3	Low	69.5	Low	135 Å²	135	104.5 Å²	104.5	72%	0.722	52%	0.522	S	S	*	.			trans	-70.9	61.9	162.9	-171.9	7	0	0	0	106.6	I84 K88	I84-N86 PolarHBondContact O-N 2.68Å; N86-K88 PolarHBondContact O-N 2.72Å; N86-K88 PolarHBondContact OD1-N 2.97Å
87	Y	55.7	Low	69	Low	157 Å²	157	109.3 Å²	109.3	62%	0.616	54%	0.544	S	S	*	.			trans	-66.9	83.3	157.4	75.2	-90.1	0	0	0	103.5	P85 K89	P85-Y87 HydrophobicContact CB-CD1 4.08Å; P85-Y87 HydrophobicContact CG-CD1 3.94Å; P85-Y87 HydrophobicContact CG-CE1 4.47Å; P85-Y87 WeakPolarHBondContact O-CD1 3.22Å; P85-Y87 PolarHBondContact O-N 2.61Å; Y87-K89 HydrophobicContact CD2-CB 4.37Å; Y87-K89 HydrophobicContact CD2-CD 4.31Å; Y87-K89 HydrophobicContact CD2-CG 3.33Å; Y87-K89 HydrophobicContact CE2-CD 4.32Å; Y87-K89 HydrophobicContact CE2-CG 3.76Å; Y87-K89 HydrophobicContact CG-CG 4.48Å; Y87-K89 PolarHBondContact O-N 3.49Å
88	K	57.8	Low	68.3	Low	170 Å²	170	112.6 Å²	112.6	74%	0.739	56%	0.564	S	S	*	*				-54.6	98.1	125.2	-66.3	-172	179	-176.8	0	101.5	N86 I90	N86-K88 PolarHBondContact O-N 2.72Å; N86-K88 PolarHBondContact OD1-N 2.97Å; K88-I90 PolarHBondContact O-N 2.82Å
89	K	56.7	Low	67.4	Low	149 Å²	149	115.7 Å²	115.7	65%	0.648	59%	0.589	S	S	*	*			trans	-43.1	119.4	170.8	-68.4	-170.3	178.2	176.2	0	102.1	Y87 T91	Y87-K89 HydrophobicContact CD2-CB 4.37Å; Y87-K89 HydrophobicContact CD2-CD 4.31Å; Y87-K89 HydrophobicContact CD2-CG 3.33Å; Y87-K89 HydrophobicContact CE2-CD 4.32Å; Y87-K89 HydrophobicContact CE2-CG 3.76Å; Y87-K89 HydrophobicContact CG-CG 4.48Å; Y87-K89 PolarHBondContact O-N 3.49Å; K89-T91 HydrophobicContact CB-CG2 4.37Å; K89-T91 PolarHBondContact O-N 2.9Å
90	I	57.3	Low	66.7	Low	129 Å²	129	120 Å²	120	66%	0.662	62%	0.62	S	S	*	*			trans	-60.5	97.7	169.9	-60	178.1	0	0	0	101.3	K88 A92	K88-I90 PolarHBondContact O-N 2.82Å; I90-A92 HydrophobicContact CG2-CB 3.37Å; I90-A92 PolarHBondContact O-N 2.85Å; I90-A92 VanDerWaalsContact O-N 3.11Å
91	T	57.7	Low	66	Low	134 Å²	134	123.6 Å²	123.6	82%	0.822	64%	0.641	S	S	*	*			trans	-74.4	12.4	174.5	52.1	0	0	0	0	109	K89 Y93	K89-T91 HydrophobicContact CB-CG2 4.37Å; K89-T91 PolarHBondContact O-N 2.9Å; T91-Y93 VanDerWaalsContact C-N 3.31Å; T91-Y93 PolarHBondContact O-N 2.77Å
92	A	59.2	Low	65.3	Low	61 Å²	61	123.6 Å²	123.6	50%	0.504	64%	0.641	S	S	.	*	S	Bend	trans	-54.9	109.8	158.9	0	0	0	0	0	105.6	I90 F94	I90-A92 HydrophobicContact CG2-CB 3.37Å; I90-A92 PolarHBondContact O-N 2.85Å; I90-A92 VanDerWaalsContact O-N 3.11Å; A92-F94 PolarHBondContact O-N 2.79Å
93	Y	65.4	Low	64.5	Low	188 Å²	188	123.6 Å²	123.6	74%	0.737	66%	0.655	S	S	*	*			trans	-39.7	107.2	163.9	177.7	-99.8	0	0	0	108	T91 P95	T91-Y93 VanDerWaalsContact C-N 3.31Å; T91-Y93 PolarHBondContact O-N 2.77Å; Y93-P95 HydrophobicContact CD1-CB 4.38Å; Y93-P95 HydrophobicContact CE1-CB 4.14Å; Y93-P95 WeakPolarHBondContact O-CD 3.14Å
94	F	64.5	Low	64.1	Low	172 Å²	172	126.5 Å²	126.5	75%	0.754	67%	0.665	S	S	*	*			trans	-69.2	110.3	167.9	-75.5	-87.4	0	0	0	105.1	A92 S96	A92-F94 PolarHBondContact O-N 2.79Å; F94-S96 PolarHBondContact O-N 2.97Å
95	P	68.8	Low	63.4	Low	73 Å²	73	125.4 Å²	125.4	47%	0.474	67%	0.667	S	S	.	*			trans	-62.5	128.5	177.8	29	-33.5	0	0	0	107.2	Y93 H97	Y93-P95 HydrophobicContact CD1-CB 4.38Å; Y93-P95 HydrophobicContact CE1-CB 4.14Å; Y93-P95 WeakPolarHBondContact O-CD 3.14Å; P95-H97 WeakPolarHBondContact CB-O 3.2Å; P95-H97 PolarHBondContact O-N 2.84Å
96	S	75	Confident	63.1	Low	87 Å²	87	129.1 Å²	129.1	61%	0.608	67%	0.674	S	S	*	*	S	Bend	trans	-58.3	-16.1	175.9	52.4	0	0	0	0	112.7	F94	F94-S96 PolarHBondContact O-N 2.97Å
97	H	73.8	Confident	62.8	Low	138 Å²	138	131.8 Å²	131.8	64%	0.639	68%	0.675	S	S	*	*	S	Bend	trans	-124.7	142.1	-179.5	-54	-53.9	0	0	0	109.6	P95	P95-H97 WeakPolarHBondContact CB-O 3.2Å; P95-H97 PolarHBondContact O-N 2.84Å
98	P	71.3	Confident	62.5	Low	116 Å²	116	135.2 Å²	135.2	75%	0.753	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-55.3	140.2	171.3	24.7	-32.8	0	0	0	109	S100	P98-S100 PolarHBondContact O-N 2.86Å; P98-S100 VanDerWaalsContact O-N 3.12Å
99	P	66.7	Low	62.5	Low	113 Å²	113	134.3 Å²	134.3	73%	0.734	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-57.2	122.8	178.3	23.2	-32.2	0	0	0	109.1	I101	P99-I101 PolarHBondContact O-N 3.28Å
100	S	69.6	Low	62.3	Low	97 Å²	97	132.1 Å²	132.1	68%	0.678	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-71.8	123.5	170.2	54.2	0	0	0	0	108.3	P98 K102	P98-S100 PolarHBondContact O-N 2.86Å; P98-S100 VanDerWaalsContact O-N 3.12Å; S100-K102 PolarHBondContact O-N 3.12Å
101	I	66.9	Low	62	Low	148 Å²	148	131.3 Å²	131.3	76%	0.759	69%	0.693	S	S	*	*			trans	-67.6	103.4	170.5	-69.9	170.2	0	0	0	106.6	P99 S103	P99-I101 PolarHBondContact O-N 3.28Å; I101-S103 PolarHBondContact O-N 3.4Å
102	K	66.9	Low	61.4	Low	154 Å²	154	134 Å²	134	67%	0.67	69%	0.694	S	S	*	*			trans	-74.2	108	162.5	-62	-170.2	-179.2	-172.3	0	106.6	S100 E104	S100-K102 PolarHBondContact O-N 3.12Å; K102-E104 PolarHBondContact O-N 3.36Å; K102-E104 VanDerWaalsContact O-N 3.16Å
103	S	61.9	Low	60.8	Low	91 Å²	91	139.5 Å²	139.5	64%	0.636	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-69.3	-2	-179.9	49.5	0	0	0	0	113.6	I101 S105	I101-S103 PolarHBondContact O-N 3.4Å; S103-S105 VanDerWaalsContact C-N 3.25Å; S103-S105 PolarHBondContact O-N 3.22Å; S103-S105 VanDerWaalsContact O-N 3.16Å
104	E	60.4	Low	59.5	Low	153 Å²	153	135 Å²	135	72%	0.715	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-69.2	-12.5	-169.1	-78.3	144.7	170.6	0	0	115.3	K102	K102-E104 PolarHBondContact O-N 3.36Å; K102-E104 VanDerWaalsContact O-N 3.16Å
105	S	54.6	Low	58.3	Low	80 Å²	80	130 Å²	130	56%	0.559	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-114.6	2.7	-177.3	-49.5	0	0	0	0	115.3	S103 Y107	S103-S105 VanDerWaalsContact C-N 3.25Å; S103-S105 PolarHBondContact O-N 3.22Å; S103-S105 VanDerWaalsContact O-N 3.16Å; S105-Y107 PolarHBondContact O-N 3.43Å
106	F	53.4	Low	56.9	Low	166 Å²	166	132.7 Å²	132.7	73%	0.728	73%	0.728	S	S	*	*			trans	-80.3	78.2	163.6	-62.7	-72.6	0	0	0	107.9	R108	F106-R108 PolarHBondContact O-N 2.83Å
107	Y	54.5	Low	55.1	Low	191 Å²	191	131.8 Å²	131.8	75%	0.749	73%	0.732	S	S	*	*			trans	-57.3	103.6	152.5	-25.8	-75.6	0	0	0	104.5	S105 I109	S105-Y107 PolarHBondContact O-N 3.43Å; Y107-I109 VanDerWaalsContact C-N 3.32Å; Y107-I109 PolarHBondContact O-N 3.45Å
108	R	50.9	Low	53.6	Low	229 Å²	229	129.7 Å²	129.7	86%	0.864	73%	0.733	S	S	*	*			trans	-59.7	103.8	172.1	-172.2	-178.3	-126.9	-179.8	1.3	104.7	F106 P110	F106-R108 PolarHBondContact O-N 2.83Å; R108-P110 VanDerWaalsContact O-CD 3.25Å; R108-P110 WeakPolarHBondContact O-CD 3.03Å
109	I	57.1	Low	52.2	Low	152 Å²	152	131.8 Å²	131.8	78%	0.779	74%	0.738	S	S	*	*			trans	-53.6	115.7	172.9	-62.2	171.9	0	0	0	104.6	Y107	Y107-I109 VanDerWaalsContact C-N 3.32Å; Y107-I109 PolarHBondContact O-N 3.45Å
110	P	53.2	Low	51.1	Low	102 Å²	102	133.3 Å²	133.3	66%	0.662	74%	0.74	S	S	*	*			trans	-57.7	131.3	-178.1	20.7	-29.6	0	0	0	107	R108 F112	R108-P110 VanDerWaalsContact O-CD 3.25Å; R108-P110 WeakPolarHBondContact O-CD 3.03Å; P110-F112 PolarHBondContact O-N 3.25Å
111	P	51.4	Low	49.6	Very low	112 Å²	112	132.2 Å²	132.2	73%	0.727	74%	0.744	S	S	*	*			trans	-56.9	115.6	175.8	22.7	-30.7	0	0	0	107	Q113	P111-Q113 PolarHBondContact O-N 2.9Å; P111-Q113 VanDerWaalsContact O-N 3.1Å
112	F	44.4	Very low	48.2	Very low	192 Å²	192	131.7 Å²	131.7	84%	0.842	75%	0.748	S	S	*	*			trans	-48.7	120.6	176.2	172.6	-102.5	0	0	0	108.2	P110 A114	P110-F112 PolarHBondContact O-N 3.25Å; F112-A114 PolarHBondContact O-N 2.95Å
113	Q	46.3	Very low	47	Very low	176 Å²	176	133.3 Å²	133.3	82%	0.822	76%	0.755	S	S	*	*			trans	-65	120.4	-174.3	-65.8	-179.1	9.6	0	0	109.5	P111	P111-Q113 PolarHBondContact O-N 2.9Å; P111-Q113 VanDerWaalsContact O-N 3.1Å
114	A	37.6	Very low	46.4	Very low	94 Å²	94	134.2 Å²	134.2	78%	0.777	76%	0.759	S	S	*	*			trans	57.6	63.5	144.8	0	0	0	0	0	117.1	F112 S116	F112-A114 PolarHBondContact O-N 2.95Å; A114-S116 VanDerWaalsContact C-N 3.34Å; A114-S116 PolarHBondContact O-N 3.49Å
115	G	40	Very low	45.5	Very low	66 Å²	66	132.8 Å²	132.8	68%	0.68	76%	0.764	S	S	*	*			trans	-80.2	89.4	138.9	0	0	0	0	0	108.3	G117	G115-G117 PolarHBondContact O-N 2.93Å
116	S	39.5	Very low	45	Very low	130 Å²	130	134 Å²	134	91%	0.909	77%	0.768	S	S	*	*			trans	-52	99.5	178.5	178.4	0	0	0	0	111.2	A114	A114-S116 VanDerWaalsContact C-N 3.34Å; A114-S116 PolarHBondContact O-N 3.49Å
117	G	37.5	Very low	44.5	Very low	67 Å²	67	133.5 Å²	133.5	69%	0.691	77%	0.772	S	S	*	*			trans	-153.4	79.9	-173.8	0	0	0	0	0	112.4	G115	G115-G117 PolarHBondContact O-N 2.93Å
118	S	41.9	Very low	43.9	Very low	95 Å²	95	132.5 Å²	132.5	66%	0.664	77%	0.767	S	S	*	*			trans	48.5	92	149.5	-161.3	0	0	0	0	118.3	N120	S118-N120 PolarHBondContact O-N 3.02Å
119	N	41.3	Very low	43.4	Very low	160 Å²	160	131.9 Å²	131.9	86%	0.856	76%	0.764	S	S	*	*			trans	7.7	74.9	133.6	-49.9	-18.9	0	0	0	117.2
120	N	44.3	Very low	42.6	Very low	144 Å²	144	128.2 Å²	128.2	77%	0.77	76%	0.764	S	S	*	*			trans	-113.1	100.9	149.2	-71	-32.6	0	0	0	106.1	S118 T122	S118-N120 PolarHBondContact O-N 3.02Å; N120-T122 PolarHBondContact O-N 2.78Å; N120-T122 VanDerWaalsContact O-N 3.09Å
121	G	36.9	Very low	42.4	Very low	74 Å²	74	127.4 Å²	127.4	76%	0.763	77%	0.766	S	S	*	*			trans	-47.9	115.3	-172.1	0	0	0	0	0	111.6	K123	G121-K123 VanDerWaalsContact C-N 3.33Å; G121-K123 PolarHBondContact O-N 2.99Å
122	T	38.8	Very low	42.2	Very low	137 Å²	137	127 Å²	127	84%	0.84	76%	0.758	S	S	*	*			trans	-69.3	95.8	170.5	-55.5	0	0	0	0	106.5	N120	N120-T122 PolarHBondContact O-N 2.78Å; N120-T122 VanDerWaalsContact O-N 3.09Å
123	K	41.8	Very low	42.5	Very low	189 Å²	189	121.7 Å²	121.7	82%	0.822	74%	0.736	S	S	*	*			trans	-60	127.1	169.3	-75	-175.3	177.5	-178.6	0	107.3	G121 C125	G121-K123 VanDerWaalsContact C-N 3.33Å; G121-K123 PolarHBondContact O-N 2.99Å; K123-C125 PolarHBondContact O-N 3.17Å
124	P	47.7	Very low	42.7	Very low	110 Å²	110	122 Å²	122	71%	0.714	73%	0.73	S	S	*	*			trans	-58	129.1	178.7	22.4	-31.2	0	0	0	108.9	T126	P124-T126 VanDerWaalsContact C-N 3.28Å; P124-T126 PolarHBondContact O-N 2.91Å
125	C	42.9	Very low	43.6	Very low	123 Å²	123	123.9 Å²	123.9	83%	0.831	72%	0.723	S	S	*	*			trans	-69.3	90.6	173.8	-153.6	0	0	0	0	106.9	K123 I127	K123-C125 PolarHBondContact O-N 3.17Å; C125-I127 PolarHBondContact O-N 2.8Å; C125-I127 VanDerWaalsContact O-N 3.13Å
126	T	43.5	Very low	44.7	Very low	105 Å²	105	127.4 Å²	127.4	64%	0.644	72%	0.717	S	S	*	*			trans	-64.5	116.3	-179.8	-6	0	0	0	0	108.1	P124 W128	P124-T126 VanDerWaalsContact C-N 3.28Å; P124-T126 PolarHBondContact O-N 2.91Å; T126-W128 PolarHBondContact O-N 2.75Å
127	I	43.2	Very low	45.9	Very low	155 Å²	155	128.1 Å²	128.1	80%	0.795	70%	0.701	S	S	*	*			trans	-51.1	110.9	170.1	-62	160.2	0	0	0	106.6	C125 R129	C125-I127 PolarHBondContact O-N 2.8Å; C125-I127 VanDerWaalsContact O-N 3.13Å; I127-R129 PolarHBondContact O-N 3.25Å
128	W	42.6	Very low	47.2	Very low	170 Å²	170	130.2 Å²	130.2	64%	0.644	69%	0.693	S	S	*	*			trans	-69.5	74.1	-178	-60.6	104.7	0	0	0	110.5	T126 G130 H133	T126-W128 PolarHBondContact O-N 2.75Å; W128-G130 PolarHBondContact O-N 3.3Å; W128-H133 AromaticContact CD1-CE1 3.75Å; W128-H133 AromaticContact CD2-CE1 2.87Å; W128-H133 AromaticContact CD2-ND1 3.3Å; W128-H133 VanDerWaalsContact CD2-ND1 3.3Å; W128-H133 AromaticContact CD2-NE2 3.71Å; W128-H133 AromaticContact CE2-CE1 3.26Å; W128-H133 AromaticContact CE2-NE2 3.71Å; W128-H133 AromaticContact CE3-CE1 3.03Å; W128-H133 AromaticContact CE3-CG 3.74Å; W128-H133 AromaticContact CE3-ND1 3.02Å; W128-H133 AromaticContact CE3-NE2 3.71Å; W128-H133 AromaticContact CG-CE1 3.19Å; W128-H133 AromaticContact CG-ND1 3.6Å; W128-H133 AromaticContact CH2-CE1 3.8Å; W128-H133 AromaticContact CH2-NE2 3.65Å; W128-H133 AromaticContact CZ2-CE1 3.72Å; W128-H133 AromaticContact CZ2-NE2 3.71Å; W128-H133 AromaticContact CZ3-CD2 3.87Å; W128-H133 AromaticContact CZ3-CE1 3.48Å; W128-H133 VanDerWaalsContact CZ3-CE1 3.48Å; W128-H133 WeakPolarHBondContact CZ3-CE1 3.42Å; W128-H133 AromaticContact CZ3-CG 3.86Å; W128-H133 AromaticContact CZ3-ND1 3.58Å; W128-H133 AromaticContact CZ3-NE2 3.65Å; W128-H133 AromaticContact NE1-CE1 3.8Å
129	R	40.3	Very low	48.6	Very low	216 Å²	216	132 Å²	132	82%	0.815	69%	0.69	S	S	*	*			trans	-70.9	117.3	168	178.9	169.3	-79.6	-115.8	-1.9	106.1	I127 A131	I127-R129 PolarHBondContact O-N 3.25Å; R129-A131 PolarHBondContact O-N 2.76Å
130	G	40.1	Very low	50.1	Low	76 Å²	76	127.2 Å²	127.2	78%	0.784	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	124.8	-166.7	0	0	0	0	0	114.6	W128	W128-G130 PolarHBondContact O-N 3.3Å
131	A	47.6	Very low	51.5	Low	85 Å²	85	124.8 Å²	124.8	70%	0.702	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-178.1	-23.1	138	0	0	0	0	0	110.1	R129	R129-A131 PolarHBondContact O-N 2.76Å
132	D	47.6	Very low	53.5	Low	102 Å²	102	125.8 Å²	125.8	55%	0.545	64%	0.639	S	S	.	*	S	Bend	trans	-102.5	-5.6	-161.5	-4.6	-29.1	0	0	0	113.3	Y134 E135	D132-Y134 PolarHBondContact O-N 2.81Å; D132-Y134 VanDerWaalsContact O-N 3.11Å; D132-E135 PolarHBondContact O-N 2.88Å; D132-E135 VanDerWaalsContact O-N 3.1Å
133	H	50.4	Low	55.3	Low	82 Å²	82	126.2 Å²	126.2	38%	0.38	63%	0.631	S	S	.	*	H	α-helix	trans	-67.2	-14.5	-176.9	-121.9	120.8	0	0	0	114.3	W128	W128-H133 AromaticContact CD1-CE1 3.75Å; W128-H133 AromaticContact CD2-CE1 2.87Å; W128-H133 AromaticContact CD2-ND1 3.3Å; W128-H133 VanDerWaalsContact CD2-ND1 3.3Å; W128-H133 AromaticContact CD2-NE2 3.71Å; W128-H133 AromaticContact CE2-CE1 3.26Å; W128-H133 AromaticContact CE2-NE2 3.71Å; W128-H133 AromaticContact CE3-CE1 3.03Å; W128-H133 AromaticContact CE3-CG 3.74Å; W128-H133 AromaticContact CE3-ND1 3.02Å; W128-H133 AromaticContact CE3-NE2 3.71Å; W128-H133 AromaticContact CG-CE1 3.19Å; W128-H133 AromaticContact CG-ND1 3.6Å; W128-H133 AromaticContact CH2-CE1 3.8Å; W128-H133 AromaticContact CH2-NE2 3.65Å; W128-H133 AromaticContact CZ2-CE1 3.72Å; W128-H133 AromaticContact CZ2-NE2 3.71Å; W128-H133 AromaticContact CZ3-CD2 3.87Å; W128-H133 AromaticContact CZ3-CE1 3.48Å; W128-H133 VanDerWaalsContact CZ3-CE1 3.48Å; W128-H133 WeakPolarHBondContact CZ3-CE1 3.42Å; W128-H133 AromaticContact CZ3-CG 3.86Å; W128-H133 AromaticContact CZ3-ND1 3.58Å; W128-H133 AromaticContact CZ3-NE2 3.65Å; W128-H133 AromaticContact NE1-CE1 3.8Å
134	Y	51.1	Low	57	Low	182 Å²	182	123.2 Å²	123.2	71%	0.714	62%	0.621	S	S	*	*	H	α-helix	trans	-86.9	-18	176	-83.8	-83.5	0	0	0	113.1	D132 Y136 Q138	D132-Y134 PolarHBondContact O-N 2.81Å; D132-Y134 VanDerWaalsContact O-N 3.11Å; Y134-Y136 VanDerWaalsContact C-N 3.35Å; Y134-Y136 PolarHBondContact O-N 2.89Å; Y134-Q138 PolarHBondContact O-N 3.03Å
135	E	56.4	Low	58.4	Low	134 Å²	134	124.2 Å²	124.2	63%	0.626	61%	0.614	S	S	*	*	H	α-helix	trans	-68.3	-36.6	178.8	-63.8	-171.1	163.7	0	0	111.5	D132 Y137 Q138 E139	D132-E135 PolarHBondContact O-N 2.88Å; D132-E135 VanDerWaalsContact O-N 3.1Å; E135-Y137 PolarHBondContact O-N 3.11Å; E135-Q138 WeakPolarHBondContact O-CA 3.38Å; E135-Q138 VanDerWaalsContact O-CB 3.3Å; E135-Q138 WeakPolarHBondContact O-CB 3.41Å; E135-Q138 PolarHBondContact O-N 3.13Å; E135-E139 PolarHBondContact O-N 2.89Å
136	Y	63.3	Low	60	Low	140 Å²	140	120.5 Å²	120.5	55%	0.549	59%	0.593	S	S	.	*	H	α-helix	trans	-61.8	-41.8	179.2	-177.4	-109.1	0	0	0	113	Y134 Q138 I140	Y134-Y136 VanDerWaalsContact C-N 3.35Å; Y134-Y136 PolarHBondContact O-N 2.89Å; Y136-Q138 VanDerWaalsContact C-N 3.3Å; Y136-I140 HydrophobicContact CD1-CD1 4.19Å; Y136-I140 HydrophobicContact CE1-CD1 3.59Å; Y136-I140 HydrophobicContact CE2-CD1 4.3Å; Y136-I140 WeakPolarHBondContact O-CG1 3.2Å; Y136-I140 PolarHBondContact O-N 2.65Å
137	Y	63.9	Low	61.3	Low	145 Å²	145	118.2 Å²	118.2	57%	0.569	58%	0.584	S	S	*	*	H	α-helix	trans	-70.7	-31	175.3	-71.8	-76.7	0	0	0	111.7	E135 L141	E135-Y137 PolarHBondContact O-N 3.11Å; Y137-L141 WeakPolarHBondContact O-CB 3.5Å; Y137-L141 WeakPolarHBondContact O-CG 3.47Å; Y137-L141 PolarHBondContact O-N 3.16Å; Y137-L141 VanDerWaalsContact O-N 3.12Å
138	Q	66.2	Low	62.6	Low	111 Å²	111	117.2 Å²	117.2	52%	0.519	58%	0.581	S	S	.	*	H	α-helix	trans	-64.9	-45.8	176.5	-134.2	81.2	33.8	0	0	111.4	Y134 E135 Y136 I140 L141 D142	Y134-Q138 PolarHBondContact O-N 3.03Å; E135-Q138 WeakPolarHBondContact O-CA 3.38Å; E135-Q138 VanDerWaalsContact O-CB 3.3Å; E135-Q138 WeakPolarHBondContact O-CB 3.41Å; E135-Q138 PolarHBondContact O-N 3.13Å; Y136-Q138 VanDerWaalsContact C-N 3.3Å; Q138-I140 PolarHBondContact O-N 3.11Å; Q138-L141 PolarHBondContact O-N 2.88Å; Q138-D142 PolarHBondContact O-N 2.92Å
139	E	70.2	Confident	63.8	Low	131 Å²	131	119.3 Å²	119.3	61%	0.612	59%	0.589	S	S	*	*	H	α-helix	trans	-59.4	-45.6	178.1	-73.7	-176.5	165.3	0	0	111.8	E135 L141 D142 E143	E135-E139 PolarHBondContact O-N 2.89Å; E139-L141 VanDerWaalsContact C-N 3.32Å; E139-L141 PolarHBondContact O-N 3.17Å; E139-D142 PolarHBondContact O-N 3.49Å; E139-E143 WeakPolarHBondContact O-CB 3.3Å; E139-E143 PolarHBondContact O-N 3.1Å
140	I	74.2	Confident	64.8	Low	60 Å²	60	119.8 Å²	119.8	31%	0.308	59%	0.59	S	S	.	*	H	α-helix	trans	-62.5	-42	178.2	-64.8	178.6	0	0	0	110.7	Y136 Q138 D142 E143 M144	Y136-I140 HydrophobicContact CD1-CD1 4.19Å; Y136-I140 HydrophobicContact CE1-CD1 3.59Å; Y136-I140 HydrophobicContact CE2-CD1 4.3Å; Y136-I140 WeakPolarHBondContact O-CG1 3.2Å; Y136-I140 PolarHBondContact O-N 2.65Å; Q138-I140 PolarHBondContact O-N 3.11Å; I140-D142 VanDerWaalsContact C-N 3.34Å; I140-D142 PolarHBondContact O-N 3.21Å; I140-E143 PolarHBondContact O-N 3.06Å; I140-M144 HydrophobicContact CG2-CG 4.43Å; I140-M144 HydrophobicContact CG2-SD 4.16Å; I140-M144 WeakPolarHBondContact O-CB 3.48Å; I140-M144 VanDerWaalsContact O-CG 3.24Å; I140-M144 WeakPolarHBondContact O-CG 3.15Å; I140-M144 PolarHBondContact O-N 3.29Å
141	L	73.2	Confident	65.4	Low	94 Å²	94	126 Å²	126	49%	0.492	61%	0.606	S	S	.	*	H	α-helix	trans	-65.7	-37.2	178.3	-71.4	172.4	0	0	0	112.3	Y137 Q138 E139 K145	Y137-L141 WeakPolarHBondContact O-CB 3.5Å; Y137-L141 WeakPolarHBondContact O-CG 3.47Å; Y137-L141 PolarHBondContact O-N 3.16Å; Y137-L141 VanDerWaalsContact O-N 3.12Å; Q138-L141 PolarHBondContact O-N 2.88Å; E139-L141 VanDerWaalsContact C-N 3.32Å; E139-L141 PolarHBondContact O-N 3.17Å; L141-K145 WeakPolarHBondContact O-CG 3.29Å; L141-K145 PolarHBondContact O-N 3.19Å; L141-K145 VanDerWaalsContact O-N 3.13Å
142	D	78	Confident	66.3	Low	95 Å²	95	128.1 Å²	128.1	51%	0.508	60%	0.601	S	S	.	*	H	α-helix	trans	-73.8	-37.6	177.3	-77.7	-14.8	0	0	0	112	Q138 E139 I140 K145 A146	Q138-D142 PolarHBondContact O-N 2.92Å; E139-D142 PolarHBondContact O-N 3.49Å; I140-D142 VanDerWaalsContact C-N 3.34Å; I140-D142 PolarHBondContact O-N 3.21Å; D142-K145 PolarHBondContact O-N 3.02Å; D142-A146 WeakPolarHBondContact O-CB 3.48Å; D142-A146 PolarHBondContact O-N 3Å
143	E	77.1	Confident	67.2	Low	146 Å²	146	129.5 Å²	129.5	68%	0.682	60%	0.604	S	S	*	*	H	α-helix	trans	-64.6	-43.5	174.3	-168.3	174.9	-160.1	0	0	111.3	E139 I140 K145 A146 A147	E139-E143 WeakPolarHBondContact O-CB 3.3Å; E139-E143 PolarHBondContact O-N 3.1Å; I140-E143 PolarHBondContact O-N 3.06Å; E143-K145 VanDerWaalsContact C-N 3.34Å; E143-K145 PolarHBondContact O-N 3.12Å; E143-A146 PolarHBondContact O-N 3.39Å; E143-A147 WeakPolarHBondContact O-CB 3.37Å; E143-A147 PolarHBondContact O-N 3.16Å
144	M	77.4	Confident	68.2	Low	125 Å²	125	132.1 Å²	132.1	62%	0.616	62%	0.617	S	S	*	*	H	α-helix	trans	-61	-42.1	174.6	-72.3	-177.7	90	0	0	111.8	I140 A146 A147 D148	I140-M144 HydrophobicContact CG2-CG 4.43Å; I140-M144 HydrophobicContact CG2-SD 4.16Å; I140-M144 WeakPolarHBondContact O-CB 3.48Å; I140-M144 VanDerWaalsContact O-CG 3.24Å; I140-M144 WeakPolarHBondContact O-CG 3.15Å; I140-M144 PolarHBondContact O-N 3.29Å; M144-A146 VanDerWaalsContact C-N 3.34Å; M144-A146 PolarHBondContact O-N 2.72Å; M144-A147 PolarHBondContact O-N 3.42Å; M144-D148 PolarHBondContact O-N 3.34Å
145	K	76.3	Confident	69.2	Low	131 Å²	131	129.2 Å²	129.2	57%	0.57	61%	0.611	S	S	*	*	H	α-helix	trans	-66.7	-33.7	175	-80.5	177	-177.3	169.8	0	113.2	L141 D142 E143	L141-K145 WeakPolarHBondContact O-CG 3.29Å; L141-K145 PolarHBondContact O-N 3.19Å; L141-K145 VanDerWaalsContact O-N 3.13Å; D142-K145 PolarHBondContact O-N 3.02Å; E143-K145 VanDerWaalsContact C-N 3.34Å; E143-K145 PolarHBondContact O-N 3.12Å
146	A	76.5	Confident	70	Confident	45 Å²	45	128.9 Å²	128.9	37%	0.372	61%	0.61	S	S	.	*	H	α-helix	trans	-75.2	-35.3	178.3	0	0	0	0	0	112	D142 E143 M144 R149	D142-A146 WeakPolarHBondContact O-CB 3.48Å; D142-A146 PolarHBondContact O-N 3Å; E143-A146 PolarHBondContact O-N 3.39Å; M144-A146 VanDerWaalsContact C-N 3.34Å; M144-A146 PolarHBondContact O-N 2.72Å; A146-R149 PolarHBondContact O-N 3.17Å
147	A	71.2	Confident	70.4	Confident	57 Å²	57	128.1 Å²	128.1	47%	0.471	61%	0.614	S	S	.	*	H	α-helix	trans	-63.3	-41.9	175.9	0	0	0	0	0	111.8	E143 M144 R149 R150	E143-A147 WeakPolarHBondContact O-CB 3.37Å; E143-A147 PolarHBondContact O-N 3.16Å; M144-A147 PolarHBondContact O-N 3.42Å; A147-R149 PolarHBondContact O-N 3.19Å; A147-R150 PolarHBondContact O-N 3.41Å; A147-R150 VanDerWaalsContact O-N 3.16Å
148	D	70.4	Confident	70.9	Confident	135 Å²	135	126.9 Å²	126.9	72%	0.722	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-22	176.5	-97.9	-10	0	0	0	113.6	M144	M144-D148 PolarHBondContact O-N 3.34Å
149	R	69.4	Low	71.3	Confident	214 Å²	214	128.2 Å²	128.2	81%	0.808	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-10.6	178	-67.2	-175.2	-171	-173.6	3.5	114.3	A146 A147	A146-R149 PolarHBondContact O-N 3.17Å; A147-R149 PolarHBondContact O-N 3.19Å
150	R	60.8	Low	71.3	Confident	225 Å²	225	127.9 Å²	127.9	85%	0.849	63%	0.626	S	S	*	*			trans	-98.4	-5.5	-178.7	-74.8	-170.4	-169.3	156.2	5.2	114	A147	A147-R150 PolarHBondContact O-N 3.41Å; A147-R150 VanDerWaalsContact O-N 3.16Å
151	N	51.7	Low	71.1	Confident	208 Å²	208	134.1 Å²	134.1	100%	1.112	66%	0.655	S	S	*	*			trans	-96.7	0	164.2	-82	-40.2	0	0	0	110.1

Retrieved 151 of 151 residues in 226.5 ms (Link to these results)

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