A0A913JUH9_SCHMA Loading...

Holocytochrome c-type synthase AlphaSync

Lyase that catalyzes the covalent linking of the heme group to the cytochrome C apoprotein to produce the mature functional cytochrome.

AlphaFold DB , UniProt , Accession A0A913JUH9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 176 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	42.6	Very low	38.5	Very low	245 Å²	245	157.7 Å²	157.7	100%	1.207	86%	0.864	S	S	*	*				0	89.6	0	-79.8	171.7	170.1	0	0	108.4
2	G	35.7	Very low	38.3	Very low	74 Å²	74	155.9 Å²	155.9	76%	0.763	86%	0.861	S	S	*	*			trans	-104.4	101.7	176.5	0	0	0	0	0	109.5	I4	G2-I4 PolarHBondContact O-N 3.33Å
3	L	39.6	Very low	37.7	Very low	179 Å²	179	157.3 Å²	157.3	94%	0.937	86%	0.857	S	S	*	*			trans	-87.6	83.9	173	-69	171.7	0	0	0	108.4
4	I	40.4	Very low	37.1	Very low	168 Å²	168	159.1 Å²	159.1	86%	0.862	86%	0.857	S	S	*	*			trans	-91.4	107	166.7	24.7	173.1	0	0	0	108.2	G2	G2-I4 PolarHBondContact O-N 3.33Å
5	S	46.4	Very low	36.8	Very low	115 Å²	115	161.4 Å²	161.4	80%	0.804	86%	0.856	S	S	*	*			trans	-54.9	125.2	-178.1	-176.9	0	0	0	0	112.5	R7	S5-R7 PolarHBondContact O-N 3.04Å
6	S	38.1	Very low	36.3	Very low	114 Å²	114	162.6 Å²	162.6	80%	0.797	86%	0.855	S	S	*	*			trans	-60.7	99.6	172.5	-58.4	0	0	0	0	110.7	S8	S6-S8 PolarHBondContact O-N 3.1Å
7	R	38.6	Very low	36.3	Very low	237 Å²	237	161.7 Å²	161.7	89%	0.894	85%	0.849	S	S	*	*			trans	-80.1	96.9	168.1	-163.5	172.5	-174.8	-160.4	0.9	108.5	S5 Q9	S5-R7 PolarHBondContact O-N 3.04Å; R7-Q9 PolarHBondContact O-N 3.17Å; R7-Q9 VanDerWaalsContact O-N 3.1Å
8	S	37.4	Very low	36	Very low	103 Å²	103	161.6 Å²	161.6	72%	0.72	85%	0.848	S	S	*	*			trans	-47.3	108.9	168.9	9.5	0	0	0	0	110.5	S6 Q10	S6-S8 PolarHBondContact O-N 3.1Å; S8-Q10 PolarHBondContact O-N 3.17Å; S8-Q10 VanDerWaalsContact O-N 3.07Å
9	Q	35.7	Very low	35.7	Very low	188 Å²	188	164.7 Å²	164.7	88%	0.879	85%	0.848	S	S	*	*			trans	-69.9	95.8	164.1	-71.3	175.9	-39.5	0	0	107.3	R7 V11	R7-Q9 PolarHBondContact O-N 3.17Å; R7-Q9 VanDerWaalsContact O-N 3.1Å; Q9-V11 PolarHBondContact O-N 3.07Å
10	Q	33.2	Very low	35.5	Very low	178 Å²	178	164.3 Å²	164.3	83%	0.832	84%	0.842	S	S	*	*			trans	-71.2	106.5	162.2	-78.7	-178.1	-32.1	0	0	107.5	S8 V12	S8-Q10 PolarHBondContact O-N 3.17Å; S8-Q10 VanDerWaalsContact O-N 3.07Å; Q10-V12 PolarHBondContact O-N 3.11Å
11	V	35.4	Very low	35.4	Very low	134 Å²	134	162.4 Å²	162.4	81%	0.812	84%	0.842	S	S	*	*			trans	-54.1	103.3	167.5	176	0	0	0	0	107.5	Q9 Q13	Q9-V11 PolarHBondContact O-N 3.07Å; V11-Q13 PolarHBondContact O-N 3.03Å; V11-Q13 VanDerWaalsContact O-N 3.11Å
12	V	37.1	Very low	35	Very low	136 Å²	136	155.1 Å²	155.1	82%	0.824	81%	0.813	S	S	*	*			trans	-69.7	108.1	169.4	177.2	0	0	0	0	106	Q10 E14	Q10-V12 PolarHBondContact O-N 3.11Å; V12-E14 PolarHBondContact O-N 2.88Å
13	Q	29.5	Very low	35	Very low	174 Å²	174	159.2 Å²	159.2	81%	0.813	82%	0.816	S	S	*	*			trans	-55.6	106.4	175.3	-154.4	170.5	3.9	0	0	108.2	V11 K15	V11-Q13 PolarHBondContact O-N 3.03Å; V11-Q13 VanDerWaalsContact O-N 3.11Å; Q13-K15 PolarHBondContact O-N 2.98Å
14	E	29.4	Very low	34.8	Very low	182 Å²	182	158.1 Å²	158.1	85%	0.85	81%	0.806	S	S	*	*			trans	-54.7	98.6	172.8	-169.2	168.7	-163.1	0	0	107.5	V12 E16	V12-E14 PolarHBondContact O-N 2.88Å; E14-E16 VanDerWaalsContact C-N 3.29Å; E14-E16 PolarHBondContact O-N 2.95Å
15	K	32.8	Very low	34.4	Very low	194 Å²	194	159.6 Å²	159.6	84%	0.843	81%	0.806	S	S	*	*			trans	-67	100	167.4	-80.3	-176.5	177.3	-179.1	0	105.5	Q13 I17	Q13-K15 PolarHBondContact O-N 2.98Å; K15-I17 PolarHBondContact O-N 3.01Å
16	E	29.7	Very low	33.8	Very low	180 Å²	180	158.1 Å²	158.1	84%	0.841	81%	0.808	S	S	*	*			trans	-34.6	114.1	163.3	-91.4	-174.8	140.9	0	0	108.8	E14 L18	E14-E16 VanDerWaalsContact C-N 3.29Å; E14-E16 PolarHBondContact O-N 2.95Å; E16-L18 PolarHBondContact O-N 2.7Å
17	I	35.4	Very low	33.2	Very low	148 Å²	148	155.5 Å²	155.5	76%	0.759	80%	0.799	S	S	*	*			trans	-53.9	107.8	170	-62.1	173.7	0	0	0	105	K15 R19	K15-I17 PolarHBondContact O-N 3.01Å; I17-R19 WeakPolarHBondContact O-CG 3.47Å; I17-R19 PolarHBondContact O-N 2.9Å
18	L	30.6	Very low	32.9	Very low	159 Å²	159	147.7 Å²	147.7	83%	0.832	79%	0.793	S	S	*	*			trans	-59.2	88.5	-179.2	-152.3	100.3	0	0	0	108.1	E16 E20	E16-L18 PolarHBondContact O-N 2.7Å; L18-E20 PolarHBondContact O-N 3.05Å
19	R	30.4	Very low	32.9	Very low	222 Å²	222	148.2 Å²	148.2	84%	0.838	80%	0.795	S	S	*	*			trans	-79.1	72.2	174.5	-72.8	-171.5	178.7	-155.4	1.7	107.8	I17	I17-R19 WeakPolarHBondContact O-CG 3.47Å; I17-R19 PolarHBondContact O-N 2.9Å
20	E	32.3	Very low	33.2	Very low	155 Å²	155	145.3 Å²	145.3	72%	0.724	79%	0.793	S	S	*	*			trans	-157.7	84.1	170.7	-106.5	158.3	-127.3	0	0	109.3	L18 P22	L18-E20 PolarHBondContact O-N 3.05Å; E20-P22 VanDerWaalsContact O-CD 3.26Å; E20-P22 WeakPolarHBondContact O-CD 3.26Å
21	C	32.8	Very low	33.9	Very low	125 Å²	125	140.7 Å²	140.7	85%	0.845	78%	0.776	S	S	*	*			trans	-81.9	101.7	140.1	-69	0	0	0	0	104.7	I23	C21-I23 PolarHBondContact O-N 2.98Å
22	P	35	Very low	34.3	Very low	92 Å²	92	141 Å²	141	60%	0.597	77%	0.774	S	S	*	*			trans	-62.4	115.7	-179.1	26.4	-32.1	0	0	0	106.8	E20 Q24	E20-P22 VanDerWaalsContact O-CD 3.26Å; E20-P22 WeakPolarHBondContact O-CD 3.26Å; P22-Q24 HydrophobicContact CB-CG 4.49Å; P22-Q24 PolarHBondContact O-N 2.74Å
23	I	36.3	Very low	34.9	Very low	161 Å²	161	139.7 Å²	139.7	83%	0.826	76%	0.758	S	S	*	*			trans	-68	76.4	165.1	-61.4	167.6	0	0	0	105.2	C21 K25	C21-I23 PolarHBondContact O-N 2.98Å; I23-K25 VanDerWaalsContact C-N 3.27Å; I23-K25 PolarHBondContact O-N 2.98Å
24	Q	34.8	Very low	36	Very low	155 Å²	155	134.3 Å²	134.3	72%	0.724	75%	0.749	S	S	*	*			trans	-67.6	100.2	159.9	-76.5	-169.2	5.5	0	0	105.7	P22 G26	P22-Q24 HydrophobicContact CB-CG 4.49Å; P22-Q24 PolarHBondContact O-N 2.74Å; Q24-G26 PolarHBondContact O-N 2.95Å
25	K	32.7	Very low	37.2	Very low	200 Å²	200	130.9 Å²	130.9	87%	0.87	73%	0.73	S	S	*	*	S	Bend	trans	-47.8	103.6	159	-73	179.7	172.3	177.8	0	107.5	I23	I23-K25 VanDerWaalsContact C-N 3.27Å; I23-K25 PolarHBondContact O-N 2.98Å
26	G	32.9	Very low	38.7	Very low	83 Å²	83	131.1 Å²	131.1	86%	0.856	73%	0.73	S	S	*	*	S	Bend	trans	92.7	68.3	171.8	0	0	0	0	0	115.4	Q24	Q24-G26 PolarHBondContact O-N 2.95Å
27	G	25.7	Very low	40.9	Very low	59 Å²	59	128.3 Å²	128.3	61%	0.608	72%	0.721	S	S	*	*			trans	-153.6	104.9	163.9	0	0	0	0	0	109.3	C29	G27-C29 PolarHBondContact O-N 2.83Å
28	G	31.9	Very low	43.2	Very low	73 Å²	73	125.1 Å²	125.1	75%	0.753	71%	0.705	S	S	*	*			trans	-54.3	139.3	173.5	0	0	0	0	0	110
29	C	36.5	Very low	45.8	Very low	115 Å²	115	119.3 Å²	119.3	78%	0.777	68%	0.678	S	S	*	*			trans	-48.2	126.6	171	-54.1	0	0	0	0	108.4	G27 V31	G27-C29 PolarHBondContact O-N 2.83Å; C29-V31 PolarHBondContact O-N 2.94Å
30	P	42.8	Very low	48.4	Very low	126 Å²	126	113 Å²	113	82%	0.818	67%	0.666	S	S	*	*	S	Bend	trans	-78.2	68	-171.5	32.1	-35.2	0	0	0	110
31	V	47.5	Very low	51	Low	81 Å²	81	108.7 Å²	108.7	49%	0.491	65%	0.646	S	S	.	*			trans	-141.7	42.5	166.1	-144.3	0	0	0	0	109.1	C29	C29-V31 PolarHBondContact O-N 2.94Å
32	D	44.1	Very low	53.6	Low	142 Å²	142	104.7 Å²	104.7	76%	0.759	62%	0.616	S	S	*	*			trans	-93.8	69.4	149.8	-168	27.8	0	0	0	106.9	G34	D32-G34 VanDerWaalsContact C-N 3.26Å; D32-G34 PolarHBondContact O-N 3.08Å
33	H	50.3	Low	56	Low	107 Å²	107	104.3 Å²	104.3	50%	0.495	61%	0.609	S	S	.	*			trans	-64.2	105.5	155.1	-70.8	-52.4	0	0	0	104	Y35	H33-Y35 HydrophobicContact CB-CD2 3.61Å; H33-Y35 HydrophobicContact CB-CE2 3.48Å; H33-Y35 VanDerWaalsContact CB-CE2 3.48Å; H33-Y35 VanDerWaalsContact O-CD2 3.27Å; H33-Y35 WeakPolarHBondContact O-CD2 3.13Å; H33-Y35 PolarHBondContact O-N 3.22Å
34	G	51.6	Low	58.3	Low	61 Å²	61	99.1 Å²	99.1	63%	0.629	58%	0.581	S	S	*	*			trans	-61.7	60.9	-176.6	0	0	0	0	0	113.4	D32 K36	D32-G34 VanDerWaalsContact C-N 3.26Å; D32-G34 PolarHBondContact O-N 3.08Å; G34-K36 PolarHBondContact O-N 3.27Å; G34-K36 VanDerWaalsContact O-N 3.13Å
35	Y	55.3	Low	60.8	Low	111 Å²	111	92.8 Å²	92.8	44%	0.435	55%	0.553	S	S	.	*			trans	-69	104.9	170.7	-77.8	-76.3	0	0	0	106.9	H33 D37 L38 P45 R93	H33-Y35 HydrophobicContact CB-CD2 3.61Å; H33-Y35 HydrophobicContact CB-CE2 3.48Å; H33-Y35 VanDerWaalsContact CB-CE2 3.48Å; H33-Y35 VanDerWaalsContact O-CD2 3.27Å; H33-Y35 WeakPolarHBondContact O-CD2 3.13Å; H33-Y35 PolarHBondContact O-N 3.22Å; Y35-D37 PolarHBondContact O-N 3Å; Y35-L38 HydrophobicContact CG-CD2 4.45Å; Y35-P45 HydrophobicContact CD1-CB 4.15Å; Y35-P45 HydrophobicContact CE1-CB 4.31Å; Y35-R93 WeakPolarHBondContact OH-CD 3.46Å
36	K	63.9	Low	63.4	Low	198 Å²	198	87 Å²	87	86%	0.861	54%	0.536	S	S	*	.	S	Bend	trans	-70.9	-20.9	176.8	-64.4	-175.3	178.6	-179.5	0	112.3	G34	G34-K36 PolarHBondContact O-N 3.27Å; G34-K36 VanDerWaalsContact O-N 3.13Å
37	D	76.8	Confident	66	Low	122 Å²	122	87.4 Å²	87.4	65%	0.652	52%	0.524	S	S	*	.			trans	-116.4	50.9	-169.7	-54.3	-32.7	0	0	0	112.2	Y35 P46	Y35-D37 PolarHBondContact O-N 3Å; D37-P46 HydrophobicContact CB-CG 4.39Å; D37-P46 WeakPolarHBondContact O-CD 3.45Å
38	L	83.2	Confident	69.1	Low	80 Å²	80	88.5 Å²	88.5	42%	0.419	52%	0.516	S	S	.	.			trans	-76.8	134	168.9	-63.9	179.8	0	0	0	109.7	Y35 P45	Y35-L38 HydrophobicContact CG-CD2 4.45Å; L38-P45 HydrophobicContact CD2-CB 4.08Å
39	S	84.4	Confident	72.1	Confident	37 Å²	37	88 Å²	88	26%	0.259	49%	0.494	S	S	.	.			trans	-62.4	129.8	173	172.2	0	0	0	0	110.2	E41 N42 L43 M44	S39-E41 PolarHBondContact O-N 3.45Å; S39-E41 PolarHBondContact OG-N 2.91Å; S39-N42 VanDerWaalsContact CB-OD1 3.32Å; S39-N42 WeakPolarHBondContact CB-OD1 3.49Å; S39-N42 PolarHBondContact OG-OD1 3.46Å; S39-L43 WeakPolarHBondContact O-CA 3.44Å; S39-L43 PolarHBondContact O-N 3.25Å; S39-M44 PolarHBondContact N-O 3.49Å
40	P	86.6	Confident	74.8	Confident	90 Å²	90	88.3 Å²	88.3	58%	0.584	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-22.3	177.4	27.2	-34.3	0	0	0	112.3	R144	P40-R144 PolarHBondContact O-NE 3.27Å; P40-R144 PolarHBondContact O-NH2 3.11Å
41	E	86.2	Confident	77.3	Confident	65 Å²	65	86.5 Å²	86.5	30%	0.304	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-40.7	-176.1	-75.6	177	-152.8	0	0	113.3	S39 K70 W79 R144 F145	S39-E41 PolarHBondContact O-N 3.45Å; S39-E41 PolarHBondContact OG-N 2.91Å; E41-K70 IonicContact OE2-NZ 2.75Å; E41-W79 HydrophobicContact CB-CH2 3.89Å; E41-W79 HydrophobicContact CB-CZ3 4.18Å; E41-W79 HydrophobicContact CG-CH2 4.49Å; E41-R144 CarbonylContact O-C 3.43Å; E41-R144 VanDerWaalsContact O-CA 3.26Å; E41-R144 WeakPolarHBondContact O-CA 3.45Å; E41-R144 WeakPolarHBondContact O-CB 3.24Å; E41-F145 PolarHBondContact O-N 2.94Å
42	N	86.6	Confident	79.4	Confident	40 Å²	40	83.3 Å²	83.3	21%	0.214	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141.1	5.6	-171.4	63.3	5.3	0	0	0	114.3	S39 M44 W79 F145	S39-N42 VanDerWaalsContact CB-OD1 3.32Å; S39-N42 WeakPolarHBondContact CB-OD1 3.49Å; S39-N42 PolarHBondContact OG-OD1 3.46Å; N42-M44 HydrophobicContact CB-CG 4.41Å; N42-M44 PolarHBondContact ND2-SD 3.17Å; N42-M44 VanDerWaalsContact ND2-SD 3.45Å; N42-M44 PolarHBondContact O-N 3.42Å; N42-M44 WeakPolarHBondContact OD1-CB 3.33Å; N42-M44 PolarHBondContact OD1-N 3.11Å; N42-M44 VanDerWaalsContact OD1-N 3.1Å; N42-W79 HydrophobicContact CB-CZ3 4.21Å; N42-F145 WeakPolarHBondContact CA-O 3.47Å; N42-F145 HydrophobicContact CB-CB 4.11Å; N42-F145 WeakPolarHBondContact CB-O 3.39Å
43	L	85.5	Confident	81.6	Confident	85 Å²	85	82.9 Å²	82.9	45%	0.445	46%	0.462	S	S	.	.			trans	55.4	23.2	-178.6	-52.7	177.3	0	0	0	113.4	S39 A146	S39-L43 WeakPolarHBondContact O-CA 3.44Å; S39-L43 PolarHBondContact O-N 3.25Å; L43-A146 HydrophobicContact CD1-CB 3.96Å; L43-A146 HydrophobicContact CG-CB 3.98Å
44	M	85.9	Confident	83.5	Confident	52 Å²	52	80.6 Å²	80.6	26%	0.256	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-83.6	141.1	173.5	-70.4	-177.1	54.2	0	0	110.3	S39 N42 P82 M86	S39-M44 PolarHBondContact N-O 3.49Å; N42-M44 HydrophobicContact CB-CG 4.41Å; N42-M44 PolarHBondContact ND2-SD 3.17Å; N42-M44 VanDerWaalsContact ND2-SD 3.45Å; N42-M44 PolarHBondContact O-N 3.42Å; N42-M44 WeakPolarHBondContact OD1-CB 3.33Å; N42-M44 PolarHBondContact OD1-N 3.11Å; N42-M44 VanDerWaalsContact OD1-N 3.1Å; M44-P82 HydrophobicContact CE-CB 4.35Å; M44-M86 HydrophobicContact CE-CE 3.56Å
45	P	86.3	Confident	85.4	Confident	21 Å²	21	79 Å²	79	14%	0.136	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-67.6	169.4	164.8	31.8	-34.9	0	0	0	110.3	Y35 L38	Y35-P45 HydrophobicContact CD1-CB 4.15Å; Y35-P45 HydrophobicContact CE1-CB 4.31Å; L38-P45 HydrophobicContact CD2-CB 4.08Å
46	P	87.1	Confident	86.9	Confident	79 Å²	79	77.2 Å²	77.2	51%	0.513	45%	0.445	S	S	.	.	S	Bend	trans	-52.8	144.1	175.1	-25.6	35.8	0	0	0	111.5	D37 N48	D37-P46 HydrophobicContact CB-CG 4.39Å; D37-P46 WeakPolarHBondContact O-CD 3.45Å; P46-N48 PolarHBondContact O-N 2.91Å; P46-N48 VanDerWaalsContact O-N 3.09Å
47	P	87.9	Confident	88.3	Confident	91 Å²	91	69.5 Å²	69.5	59%	0.591	41%	0.412	S	S	*	.			trans	-63.8	115.5	-174.8	25.6	-33.6	0	0	0	110.9	M86	P47-M86 HydrophobicContact CB-CE 3.73Å; P47-M86 HydrophobicContact CB-SD 4.16Å
48	N	91.8	Very high	89	Confident	82 Å²	82	69.4 Å²	69.4	44%	0.439	42%	0.418	S	S	.	.			trans	-109.9	109.4	170.9	-179	9.7	0	0	0	109.8	P46 L50 N89	P46-N48 PolarHBondContact O-N 2.91Å; P46-N48 VanDerWaalsContact O-N 3.09Å; N48-L50 WeakPolarHBondContact OD1-CB 3.46Å; N48-L50 PolarHBondContact OD1-N 3.47Å; N48-N89 PolarHBondContact O-ND2 3.01Å
49	Q	93.6	Very high	89.5	Confident	62 Å²	62	66.5 Å²	66.5	29%	0.29	40%	0.403	S	S	.	.			trans	-103.8	8.7	-180	-59.1	-128.2	56.4	0	0	112.7	T61 S83 Q85 M86	Q49-T61 HydrophobicContact CB-CG2 4.09Å; Q49-T61 PolarHBondContact NE2-O 3.35Å; Q49-T61 VanDerWaalsContact NE2-O 3.12Å; Q49-T61 PolarHBondContact OE1-O 2.93Å; Q49-S83 PolarHBondContact OE1-OG 3.26Å; Q49-Q85 VanDerWaalsContact O-CG 3.29Å; Q49-Q85 WeakPolarHBondContact O-CG 3.26Å; Q49-M86 HydrophobicContact CG-CG 3.94Å; Q49-M86 HydrophobicContact CG-SD 4.19Å
50	L	94.5	Very high	90	Very high	123 Å²	123	67 Å²	67	64%	0.644	41%	0.406	S	S	*	.	S	Bend	trans	-75.7	141.8	174.9	-62.7	177	0	0	0	110.1	N48 N89	N48-L50 WeakPolarHBondContact OD1-CB 3.46Å; N48-L50 PolarHBondContact OD1-N 3.47Å; L50-N89 PolarHBondContact O-ND2 2.81Å
51	P	94	Very high	90.4	Very high	87 Å²	87	66.3 Å²	66.3	57%	0.565	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-56.4	140.2	169	-25.1	34.8	0	0	0	111.5
52	S	91.8	Very high	90.8	Very high	15 Å²	15	70.5 Å²	70.5	11%	0.105	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-74.4	153.2	175.7	62.8	0	0	0	0	111.6	G54 Q55 W88 L92	S52-G54 PolarHBondContact O-N 2.79Å; S52-Q55 VanDerWaalsContact O-CB 3.26Å; S52-Q55 WeakPolarHBondContact O-CB 3.37Å; S52-Q55 PolarHBondContact O-N 2.84Å; S52-Q55 VanDerWaalsContact O-N 3.1Å; S52-Q55 PolarHBondContact OG-OE1 3.09Å; S52-W88 PolarHBondContact OG-NE1 3.3Å; S52-L92 VanDerWaalsContact OG-CD1 3.31Å; S52-L92 WeakPolarHBondContact OG-CD1 3.35Å
53	P	91.2	Very high	91.2	Very high	133 Å²	133	73.3 Å²	73.3	86%	0.864	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	126.6	176.5	-24.8	34.3	0	0	0	112.2	Q55	P53-Q55 VanDerWaalsContact C-N 3.3Å; P53-Q55 PolarHBondContact O-N 3.06Å
54	G	89	Confident	91.7	Very high	59 Å²	59	74.1 Å²	74.1	61%	0.608	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	17.3	-179.9	0	0	0	0	0	114.6	S52	S52-G54 PolarHBondContact O-N 2.79Å
55	Q	91	Very high	92.2	Very high	28 Å²	28	77.3 Å²	77.3	13%	0.131	45%	0.447	C	S	.	.			trans	-59.7	124.4	171.8	-172.3	175.2	-47.4	0	0	110.1	S52 P53 F57 W88	S52-Q55 VanDerWaalsContact O-CB 3.26Å; S52-Q55 WeakPolarHBondContact O-CB 3.37Å; S52-Q55 PolarHBondContact O-N 2.84Å; S52-Q55 VanDerWaalsContact O-N 3.1Å; S52-Q55 PolarHBondContact OG-OE1 3.09Å; P53-Q55 VanDerWaalsContact C-N 3.3Å; P53-Q55 PolarHBondContact O-N 3.06Å; Q55-F57 WeakPolarHBondContact CG-O 3.49Å; Q55-F57 PolarHBondContact NE2-O 3.39Å; Q55-F57 PolarHBondContact O-N 3.2Å; Q55-W88 HydrophobicContact CG-CZ2 4.08Å
56	P	88.6	Confident	92.7	Very high	73 Å²	73	76.5 Å²	76.5	47%	0.474	44%	0.441	S	S	.	.	S	Bend	trans	-74.4	-25	-169.6	26	-33.5	0	0	0	114.3	W88 W98	P56-W88 HydrophobicContact CG-CH2 4.39Å; P56-W98 HydrophobicContact CG-CD2 4.39Å; P56-W98 HydrophobicContact CG-CE3 4.26Å
57	F	91.6	Very high	93.1	Very high	36 Å²	36	75.2 Å²	75.2	16%	0.158	43%	0.434	C	S	.	.	S	Bend	trans	-143.8	151.9	-179.3	48.7	-100.9	0	0	0	111.5	Q55 L59 W88 I103 P105	Q55-F57 WeakPolarHBondContact CG-O 3.49Å; Q55-F57 PolarHBondContact NE2-O 3.39Å; Q55-F57 PolarHBondContact O-N 3.2Å; F57-L59 HydrophobicContact CD2-CD2 4.08Å; F57-L59 HydrophobicContact CD2-CG 4.17Å; F57-L59 HydrophobicContact CE2-CD1 4.45Å; F57-L59 HydrophobicContact CE2-CD2 3.73Å; F57-L59 HydrophobicContact CE2-CG 4.03Å; F57-W88 HydrophobicContact CE2-CZ3 4.23Å; F57-W88 HydrophobicContact CZ-CH2 4.28Å; F57-W88 AromaticContact CZ-CZ3 3.84Å; F57-W88 HydrophobicContact CZ-CZ3 3.84Å; F57-I103 WeakPolarHBondContact CE1-O 3.26Å; F57-P105 HydrophobicContact CD1-CG 4.5Å; F57-P105 HydrophobicContact CD2-CB 3.75Å; F57-P105 HydrophobicContact CD2-CG 4.39Å; F57-P105 HydrophobicContact CE2-CB 3.84Å; F57-P105 HydrophobicContact CG-CB 4.18Å; F57-P105 HydrophobicContact CG-CG 4.32Å; F57-P105 HydrophobicContact CZ-CB 4.32Å
58	P	92.6	Very high	93.5	Very high	119 Å²	119	71 Å²	71	77%	0.773	41%	0.407	S	S	*	.			trans	-67.6	146.6	175	29.4	-34.8	0	0	0	111.1
59	L	93.8	Very high	93.6	Very high	20 Å²	20	68.5 Å²	68.5	11%	0.105	40%	0.395	C	S	.	.			trans	-121.3	149.4	174.7	-75.2	171.2	0	0	0	110	F57 P84 Q85 W88 M108	F57-L59 HydrophobicContact CD2-CD2 4.08Å; F57-L59 HydrophobicContact CD2-CG 4.17Å; F57-L59 HydrophobicContact CE2-CD1 4.45Å; F57-L59 HydrophobicContact CE2-CD2 3.73Å; F57-L59 HydrophobicContact CE2-CG 4.03Å; L59-P84 HydrophobicContact CB-CB 4.31Å; L59-P84 HydrophobicContact CD2-CB 4.22Å; L59-Q85 HydrophobicContact CB-CB 4.17Å; L59-W88 HydrophobicContact CD1-CB 3.46Å; L59-W88 VanDerWaalsContact CD1-CB 3.46Å; L59-W88 HydrophobicContact CD1-CD2 3.77Å; L59-W88 HydrophobicContact CD1-CE3 3.69Å; L59-W88 HydrophobicContact CD1-CG 3.69Å; L59-M108 HydrophobicContact CD1-CG 4.45Å; L59-M108 HydrophobicContact CD2-CB 4.18Å; L59-M108 HydrophobicContact CD2-CG 3.82Å
60	S	94.9	Very high	93.6	Very high	48 Å²	48	68 Å²	68	34%	0.336	39%	0.392	S	S	.	.			trans	-64	142.4	176.7	-176.9	0	0	0	0	111.3	E62 P84 Q85	S60-E62 WeakPolarHBondContact OG-CB 3.39Å; S60-E62 PolarHBondContact OG-N 3Å; S60-E62 VanDerWaalsContact OG-N 3.1Å; S60-P84 WeakPolarHBondContact O-CD 3.46Å; S60-Q85 PolarHBondContact O-N 3.17Å
61	T	95.2	Very high	93.4	Very high	74 Å²	74	63.8 Å²	63.8	45%	0.454	38%	0.375	S	S	.	.			trans	-99.9	-0.3	172.3	56.1	0	0	0	0	112.3	Q49 S83 Q85	Q49-T61 HydrophobicContact CB-CG2 4.09Å; Q49-T61 PolarHBondContact NE2-O 3.35Å; Q49-T61 VanDerWaalsContact NE2-O 3.12Å; Q49-T61 PolarHBondContact OE1-O 2.93Å; T61-S83 VanDerWaalsContact C-CB 3.47Å; T61-S83 WeakPolarHBondContact O-CB 3.46Å; T61-Q85 HydrophobicContact CG2-CB 4.27Å
62	E	94.8	Very high	93	Very high	153 Å²	153	65.2 Å²	65.2	72%	0.715	38%	0.377	S	S	*	.			trans	-68	140.5	176.3	-63.8	179.9	176	0	0	110.4	S60 S83	S60-E62 WeakPolarHBondContact OG-CB 3.39Å; S60-E62 PolarHBondContact OG-N 3Å; S60-E62 VanDerWaalsContact OG-N 3.1Å; E62-S83 VanDerWaalsContact O-CA 3.29Å; E62-S83 WeakPolarHBondContact O-CA 3.41Å; E62-S83 WeakPolarHBondContact O-CB 3.44Å
63	R	95.1	Very high	92.5	Very high	99 Å²	99	65 Å²	65	37%	0.374	38%	0.376	S	S	.	.			trans	-117.4	142	-178.9	-64.2	-176.4	67.3	-173.8	0.1	109.4	I80 Y81	R63-I80 HydrophobicContact CB-CG2 3.65Å; R63-I80 PolarHBondContact NH2-O 3.29Å; R63-Y81 WeakPolarHBondContact CB-O 3.19Å; R63-Y81 PolarHBondContact NE-O 3.48Å; R63-Y81 PolarHBondContact NH2-O 3.1Å
64	E	95.3	Very high	91.9	Very high	103 Å²	103	64 Å²	64	48%	0.481	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-95.4	137.1	179.3	-66	176.8	-176.7	0	0	111	Y81 N116	E64-Y81 HydrophobicContact CB-CD2 4.44Å; E64-Y81 PolarHBondContact O-N 3.39Å; E64-N116 PolarHBondContact OE2-ND2 3.23Å
65	L	96.4	Very high	91.7	Very high	119 Å²	119	67.5 Å²	67.5	62%	0.623	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	125.9	172.4	-169.6	80.5	0	0	0	109.2	K78 I80	L65-K78 HydrophobicContact CD1-CB 4.04Å; L65-K78 HydrophobicContact CD2-CD 4.29Å; L65-K78 HydrophobicContact CG-CB 4.19Å; L65-I80 HydrophobicContact CD1-CG1 4.05Å
66	S	96.4	Very high	91.4	Very high	3 Å²	3	68.2 Å²	68.2	2%	0.021	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	170	173.9	72.7	0	0	0	0	112	I68 K78 W79 Y81 E120	S66-I68 VanDerWaalsContact C-N 3.28Å; S66-I68 PolarHBondContact OG-N 3.16Å; S66-I68 PolarHBondContact OG-O 3.41Å; S66-K78 WeakPolarHBondContact O-CD 3.44Å; S66-W79 VanDerWaalsContact CB-O 3.24Å; S66-W79 WeakPolarHBondContact CB-O 3.43Å; S66-W79 PolarHBondContact N-O 3.41Å; S66-W79 WeakPolarHBondContact OG-CA 3.43Å; S66-W79 WeakPolarHBondContact OG-CB 3.33Å; S66-W79 PolarHBondContact OG-N 3.11Å; S66-W79 PolarHBondContact OG-O 2.98Å; S66-Y81 VanDerWaalsContact CB-CE2 3.48Å; S66-E120 VanDerWaalsContact CA-OE1 3.27Å; S66-E120 WeakPolarHBondContact CA-OE1 3.04Å; S66-E120 VanDerWaalsContact CB-OE1 3.26Å; S66-E120 WeakPolarHBondContact CB-OE1 3.29Å
67	S	95.2	Very high	91.6	Very high	52 Å²	52	69.9 Å²	69.9	36%	0.364	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-9.8	166.6	82.7	0	0	0	0	113.4	P69 E120	S67-P69 WeakPolarHBondContact O-CD 3.49Å; S67-E120 VanDerWaalsContact CB-OE2 3.24Å; S67-E120 WeakPolarHBondContact CB-OE2 3.36Å; S67-E120 PolarHBondContact N-OE1 3.41Å; S67-E120 PolarHBondContact OG-OE2 3.43Å
68	I	96	Very high	91.8	Very high	3 Å²	3	72.3 Å²	72.3	2%	0.015	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	119.3	-166.8	-48	179.1	0	0	0	110.5	S66 K78 W79 W123 L142 F145	S66-I68 VanDerWaalsContact C-N 3.28Å; S66-I68 PolarHBondContact OG-N 3.16Å; S66-I68 PolarHBondContact OG-O 3.41Å; I68-K78 CarbonylContact O-C 3.6Å; I68-K78 WeakPolarHBondContact O-CA 3.32Å; I68-K78 VanDerWaalsContact O-CB 3.29Å; I68-K78 WeakPolarHBondContact O-CB 3.47Å; I68-W79 VanDerWaalsContact O-CD1 3.3Å; I68-W79 PolarHBondContact O-N 2.95Å; I68-W123 HydrophobicContact CB-CD2 4.42Å; I68-W123 HydrophobicContact CB-CG 4.36Å; I68-W123 HydrophobicContact CD1-CB 3.88Å; I68-W123 HydrophobicContact CD1-CG 4.13Å; I68-W123 HydrophobicContact CG1-CB 3.87Å; I68-W123 HydrophobicContact CG1-CD2 4.15Å; I68-W123 HydrophobicContact CG1-CG 3.65Å; I68-W123 HydrophobicContact CG2-CD2 3.79Å; I68-W123 HydrophobicContact CG2-CE3 4Å; I68-W123 HydrophobicContact CG2-CG 4.22Å; I68-W123 HydrophobicContact CG2-CH2 4.43Å; I68-W123 HydrophobicContact CG2-CZ2 4.22Å; I68-W123 HydrophobicContact CG2-CZ3 4.32Å; I68-L142 HydrophobicContact CG2-CB 3.61Å; I68-L142 HydrophobicContact CG2-CD2 3.83Å; I68-L142 HydrophobicContact CG2-CG 4.36Å; I68-F145 HydrophobicContact CD1-CE2 4.39Å
69	P	94.9	Very high	91.9	Very high	30 Å²	30	67.3 Å²	67.3	20%	0.195	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	141.9	177.8	29.1	-31.2	0	0	0	112.4	S67 W123 K141 L142	S67-P69 WeakPolarHBondContact O-CD 3.49Å; P69-W123 HydrophobicContact CG-CZ2 4.19Å; P69-K141 HydrophobicContact CB-CG 4.19Å; P69-K141 HydrophobicContact CG-CB 4.45Å; P69-K141 HydrophobicContact CG-CG 4.17Å; P69-L142 PolarHBondContact O-N 3.49Å
70	K	93.9	Very high	91.9	Very high	52 Å²	52	70.1 Å²	70.1	23%	0.226	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-80	135.4	173.3	-69.3	-172.2	169.7	-159.8	0	111.1	E41 E77 W79	E41-K70 IonicContact OE2-NZ 2.75Å; K70-E77 WeakPolarHBondContact CB-O 3.46Å; K70-E77 HydrophobicContact CD-CB 4.47Å; K70-E77 PolarHBondContact N-O 3.41Å; K70-W79 HydrophobicContact CG-CD2 3.98Å; K70-W79 HydrophobicContact CG-CG 4.08Å; K70-W79 HydrophobicContact CG-CZ2 4.3Å
71	A	90.2	Very high	92	Very high	34 Å²	34	68.5 Å²	68.5	28%	0.281	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-46.6	179.3	0	0	0	0	0	113	S73 K141 L142 R143	A71-S73 VanDerWaalsContact C-N 3.26Å; A71-S73 PolarHBondContact O-N 3.47Å; A71-K141 HydrophobicContact CB-CB 4.07Å; A71-L142 PolarHBondContact N-O 2.9Å; A71-R143 HydrophobicContact CB-CB 3.86Å; A71-R143 HydrophobicContact CB-CG 4.15Å
72	D	84.7	Confident	91.9	Very high	116 Å²	116	66.4 Å²	66.4	62%	0.62	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-0.1	-170.2	-57.5	-32.2	0	0	0	113.3
73	S	81.8	Confident	91.9	Very high	12 Å²	12	59.1 Å²	59.1	8%	0.084	32%	0.324	C	S	.	.			trans	-92.6	120.6	177.7	-169.7	0	0	0	0	111.6	A71 N75 E77	A71-S73 VanDerWaalsContact C-N 3.26Å; A71-S73 PolarHBondContact O-N 3.47Å; S73-N75 VanDerWaalsContact C-N 3.25Å; S73-N75 PolarHBondContact O-N 3.14Å; S73-E77 WeakPolarHBondContact CB-OE2 3.31Å; S73-E77 WeakPolarHBondContact OG-CB 3.33Å; S73-E77 WeakPolarHBondContact OG-CG 3.42Å; S73-E77 PolarHBondContact OG-N 2.99Å; S73-E77 PolarHBondContact OG-OE2 3.05Å
74	S	78.1	Confident	91.9	Very high	110 Å²	110	55 Å²	55	77%	0.769	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-29.2	172.9	55.6	0	0	0	0	112.3	G76	S74-G76 VanDerWaalsContact C-N 3.31Å; S74-G76 PolarHBondContact O-N 2.76Å
75	N	84.6	Confident	91.9	Very high	133 Å²	133	50.2 Å²	50.2	71%	0.711	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	8.7	-169.4	-60.4	-9.1	0	0	0	113	S73 E77	S73-N75 VanDerWaalsContact C-N 3.25Å; S73-N75 PolarHBondContact O-N 3.14Å; N75-E77 VanDerWaalsContact C-N 3.31Å; N75-E77 PolarHBondContact O-N 3.41Å
76	G	85.2	Confident	91.8	Very high	43 Å²	43	45.1 Å²	45.1	44%	0.443	26%	0.261	S	S	.	.			trans	70	27.5	-177.6	0	0	0	0	0	113.4	S74	S74-G76 VanDerWaalsContact C-N 3.31Å; S74-G76 PolarHBondContact O-N 2.76Å
77	E	93.1	Very high	91.7	Very high	108 Å²	108	47 Å²	47	51%	0.505	27%	0.269	S	S	.	.			trans	-60.2	147.1	176.6	-65.7	170	154	0	0	111.1	K70 S73 N75	K70-E77 WeakPolarHBondContact CB-O 3.46Å; K70-E77 HydrophobicContact CD-CB 4.47Å; K70-E77 PolarHBondContact N-O 3.41Å; S73-E77 WeakPolarHBondContact CB-OE2 3.31Å; S73-E77 WeakPolarHBondContact OG-CB 3.33Å; S73-E77 WeakPolarHBondContact OG-CG 3.42Å; S73-E77 PolarHBondContact OG-N 2.99Å; S73-E77 PolarHBondContact OG-OE2 3.05Å; N75-E77 VanDerWaalsContact C-N 3.31Å; N75-E77 PolarHBondContact O-N 3.41Å
78	K	95	Very high	91.6	Very high	87 Å²	87	44.5 Å²	44.5	38%	0.378	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	161.7	179.4	-59.3	-173.3	-174.8	179	0	111	L65 S66 I68	L65-K78 HydrophobicContact CD1-CB 4.04Å; L65-K78 HydrophobicContact CD2-CD 4.29Å; L65-K78 HydrophobicContact CG-CB 4.19Å; S66-K78 WeakPolarHBondContact O-CD 3.44Å; I68-K78 CarbonylContact O-C 3.6Å; I68-K78 WeakPolarHBondContact O-CA 3.32Å; I68-K78 VanDerWaalsContact O-CB 3.29Å; I68-K78 WeakPolarHBondContact O-CB 3.47Å
79	W	95.2	Very high	91.5	Very high	14 Å²	14	44.9 Å²	44.9	5%	0.053	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	144.4	171.3	-65.6	88.6	0	0	0	109.9	E41 N42 S66 I68 K70 L142 F145	E41-W79 HydrophobicContact CB-CH2 3.89Å; E41-W79 HydrophobicContact CB-CZ3 4.18Å; E41-W79 HydrophobicContact CG-CH2 4.49Å; N42-W79 HydrophobicContact CB-CZ3 4.21Å; S66-W79 VanDerWaalsContact CB-O 3.24Å; S66-W79 WeakPolarHBondContact CB-O 3.43Å; S66-W79 PolarHBondContact N-O 3.41Å; S66-W79 WeakPolarHBondContact OG-CA 3.43Å; S66-W79 WeakPolarHBondContact OG-CB 3.33Å; S66-W79 PolarHBondContact OG-N 3.11Å; S66-W79 PolarHBondContact OG-O 2.98Å; I68-W79 VanDerWaalsContact O-CD1 3.3Å; I68-W79 PolarHBondContact O-N 2.95Å; K70-W79 HydrophobicContact CG-CD2 3.98Å; K70-W79 HydrophobicContact CG-CG 4.08Å; K70-W79 HydrophobicContact CG-CZ2 4.3Å; W79-L142 WeakPolarHBondContact CZ2-O 3.36Å; W79-L142 PolarHBondContact NE1-O 3.1Å; W79-F145 HydrophobicContact CD2-CB 4.49Å; W79-F145 HydrophobicContact CE3-CB 4.16Å; W79-F145 HydrophobicContact CH2-CB 4.22Å; W79-F145 HydrophobicContact CZ3-CB 4.03Å
80	I	94.7	Very high	91.3	Very high	80 Å²	80	44.7 Å²	44.7	41%	0.41	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	121.9	179.3	-53	178.8	0	0	0	107.5	R63 L65	R63-I80 HydrophobicContact CB-CG2 3.65Å; R63-I80 PolarHBondContact NH2-O 3.29Å; L65-I80 HydrophobicContact CD1-CG1 4.05Å
81	Y	95.5	Very high	91.2	Very high	13 Å²	13	43.7 Å²	43.7	5%	0.051	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-68.4	151.7	178.7	-66	-51.7	0	0	0	111.4	R63 E64 S66 N116 N119 E120	R63-Y81 WeakPolarHBondContact CB-O 3.19Å; R63-Y81 PolarHBondContact NE-O 3.48Å; R63-Y81 PolarHBondContact NH2-O 3.1Å; E64-Y81 HydrophobicContact CB-CD2 4.44Å; E64-Y81 PolarHBondContact O-N 3.39Å; S66-Y81 VanDerWaalsContact CB-CE2 3.48Å; Y81-N116 HydrophobicContact CD2-CB 3.98Å; Y81-N116 HydrophobicContact CE2-CB 4.01Å; Y81-N119 HydrophobicContact CE1-CB 4Å; Y81-N119 VanDerWaalsContact OH-CB 3.3Å; Y81-N119 WeakPolarHBondContact OH-CB 3.36Å; Y81-E120 PolarHBondContact OH-OE1 2.81Å
82	P	93.8	Very high	91.3	Very high	30 Å²	30	43.9 Å²	43.9	20%	0.195	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-63.6	147.6	173.2	27.7	-33.7	0	0	0	110.4	M44 M86	M44-P82 HydrophobicContact CE-CB 4.35Å; P82-M86 HydrophobicContact CB-CB 3.83Å; P82-M86 HydrophobicContact CB-CE 4.19Å; P82-M86 HydrophobicContact CB-SD 4.42Å
83	S	94.9	Very high	91.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-70.5	164.5	172.4	63.2	0	0	0	0	111.2	Q49 T61 E62 Q85 M86 F87	Q49-S83 PolarHBondContact OE1-OG 3.26Å; T61-S83 VanDerWaalsContact C-CB 3.47Å; T61-S83 WeakPolarHBondContact O-CB 3.46Å; E62-S83 VanDerWaalsContact O-CA 3.29Å; E62-S83 WeakPolarHBondContact O-CA 3.41Å; E62-S83 WeakPolarHBondContact O-CB 3.44Å; S83-Q85 VanDerWaalsContact C-N 3.26Å; S83-Q85 PolarHBondContact O-N 3.09Å; S83-M86 WeakPolarHBondContact O-CB 3.47Å; S83-M86 PolarHBondContact O-N 3.41Å; S83-M86 VanDerWaalsContact OG-CG 3.27Å; S83-M86 WeakPolarHBondContact OG-CG 3.33Å; S83-M86 PolarHBondContact OG-N 3.23Å; S83-F87 PolarHBondContact O-N 3.39Å
84	P	94.9	Very high	91.7	Very high	14 Å²	14	49.6 Å²	49.6	9%	0.091	26%	0.263	C	S	.	.	H	α-helix	trans	-52.7	-41.4	172.3	-27.9	34.6	0	0	0	114.7	L59 S60 M86 F87 W88 M108 I112	L59-P84 HydrophobicContact CB-CB 4.31Å; L59-P84 HydrophobicContact CD2-CB 4.22Å; S60-P84 WeakPolarHBondContact O-CD 3.46Å; P84-M86 PolarHBondContact O-N 3.31Å; P84-F87 PolarHBondContact O-N 2.92Å; P84-W88 WeakPolarHBondContact O-CB 3.38Å; P84-W88 PolarHBondContact O-N 2.87Å; P84-M108 HydrophobicContact CB-CG 4.45Å; P84-I112 HydrophobicContact CB-CD1 3.53Å; P84-I112 HydrophobicContact CG-CD1 3.71Å
85	Q	95.3	Very high	92.1	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.009	25%	0.248	C	C	.	.	H	α-helix	trans	-64.4	-39.1	175.4	-171.8	58.5	71.4	0	0	112.8	Q49 L59 S60 T61 S83 N89	Q49-Q85 VanDerWaalsContact O-CG 3.29Å; Q49-Q85 WeakPolarHBondContact O-CG 3.26Å; L59-Q85 HydrophobicContact CB-CB 4.17Å; S60-Q85 PolarHBondContact O-N 3.17Å; T61-Q85 HydrophobicContact CG2-CB 4.27Å; S83-Q85 VanDerWaalsContact C-N 3.26Å; S83-Q85 PolarHBondContact O-N 3.09Å; Q85-N89 PolarHBondContact NE2-OD1 2.63Å; Q85-N89 WeakPolarHBondContact O-CB 3.35Å; Q85-N89 VanDerWaalsContact O-CG 3.27Å; Q85-N89 PolarHBondContact O-N 2.96Å; Q85-N89 PolarHBondContact O-ND2 3.4Å
86	M	94.8	Very high	92.3	Very high	12 Å²	12	42.1 Å²	42.1	6%	0.059	22%	0.221	C	C	.	.	H	α-helix	trans	-66.9	-39.3	175.6	-71.6	176.1	67	0	0	111.9	M44 P47 Q49 P82 S83 P84 N89 A90	M44-M86 HydrophobicContact CE-CE 3.56Å; P47-M86 HydrophobicContact CB-CE 3.73Å; P47-M86 HydrophobicContact CB-SD 4.16Å; Q49-M86 HydrophobicContact CG-CG 3.94Å; Q49-M86 HydrophobicContact CG-SD 4.19Å; P82-M86 HydrophobicContact CB-CB 3.83Å; P82-M86 HydrophobicContact CB-CE 4.19Å; P82-M86 HydrophobicContact CB-SD 4.42Å; S83-M86 WeakPolarHBondContact O-CB 3.47Å; S83-M86 PolarHBondContact O-N 3.41Å; S83-M86 VanDerWaalsContact OG-CG 3.27Å; S83-M86 WeakPolarHBondContact OG-CG 3.33Å; S83-M86 PolarHBondContact OG-N 3.23Å; P84-M86 PolarHBondContact O-N 3.31Å; M86-N89 PolarHBondContact O-N 2.99Å; M86-A90 WeakPolarHBondContact O-CB 3.43Å; M86-A90 PolarHBondContact O-N 3.06Å
87	F	93.7	Very high	92.3	Very high	42 Å²	42	46 Å²	46	18%	0.184	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-46.5	176.6	-171.3	-89.7	0	0	0	110.9	S83 P84 N89 A90 M91 M108 I111 I112	S83-F87 PolarHBondContact O-N 3.39Å; P84-F87 PolarHBondContact O-N 2.92Å; F87-N89 PolarHBondContact O-N 3.4Å; F87-A90 CarbonylContact O-C 3.53Å; F87-A90 WeakPolarHBondContact O-CA 3.41Å; F87-A90 WeakPolarHBondContact O-CB 3.41Å; F87-A90 PolarHBondContact O-N 3.2Å; F87-M91 HydrophobicContact CD1-CE 4.03Å; F87-M91 HydrophobicContact CD1-CG 4.08Å; F87-M91 HydrophobicContact CD1-SD 4.07Å; F87-M91 HydrophobicContact CE1-CE 3.91Å; F87-M91 HydrophobicContact CE1-CG 3.83Å; F87-M91 HydrophobicContact CE1-SD 3.46Å; F87-M91 WeakPolarHBondContact CE1-SD 3.22Å; F87-M91 HydrophobicContact CZ-CG 4.46Å; F87-M91 HydrophobicContact CZ-SD 4.27Å; F87-M91 WeakPolarHBondContact O-CG 3.42Å; F87-M91 PolarHBondContact O-N 3.32Å; F87-M108 HydrophobicContact CD1-SD 3.65Å; F87-M108 HydrophobicContact CE1-SD 4.15Å; F87-I111 HydrophobicContact CE1-CG2 3.9Å; F87-I111 HydrophobicContact CZ-CG2 3.83Å; F87-I112 HydrophobicContact CB-CD1 4.04Å; F87-I112 HydrophobicContact CB-CG1 4.15Å; F87-I112 HydrophobicContact CD1-CD1 4.34Å; F87-I112 HydrophobicContact CD1-CG1 3.99Å; F87-I112 HydrophobicContact CD2-CG1 4.21Å; F87-I112 HydrophobicContact CE1-CG1 4.44Å; F87-I112 HydrophobicContact CG-CD1 4.23Å; F87-I112 HydrophobicContact CG-CG1 3.86Å
88	W	93.1	Very high	91.5	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-54.1	-52.4	172.7	179.2	-86.1	0	0	0	112.2	S52 Q55 P56 F57 L59 P84 A90 M91 L92 W96 W98 M108	S52-W88 PolarHBondContact OG-NE1 3.3Å; Q55-W88 HydrophobicContact CG-CZ2 4.08Å; P56-W88 HydrophobicContact CG-CH2 4.39Å; F57-W88 HydrophobicContact CE2-CZ3 4.23Å; F57-W88 HydrophobicContact CZ-CH2 4.28Å; F57-W88 AromaticContact CZ-CZ3 3.84Å; F57-W88 HydrophobicContact CZ-CZ3 3.84Å; L59-W88 HydrophobicContact CD1-CB 3.46Å; L59-W88 VanDerWaalsContact CD1-CB 3.46Å; L59-W88 HydrophobicContact CD1-CD2 3.77Å; L59-W88 HydrophobicContact CD1-CE3 3.69Å; L59-W88 HydrophobicContact CD1-CG 3.69Å; P84-W88 WeakPolarHBondContact O-CB 3.38Å; P84-W88 PolarHBondContact O-N 2.87Å; W88-A90 PolarHBondContact O-N 3.36Å; W88-M91 PolarHBondContact O-N 2.88Å; W88-M91 VanDerWaalsContact O-N 3.08Å; W88-L92 PolarHBondContact O-N 2.92Å; W88-W96 HydrophobicContact CD2-CZ3 4.01Å; W88-W96 AromaticContact CE3-CH2 3.99Å; W88-W96 HydrophobicContact CE3-CH2 3.99Å; W88-W96 AromaticContact CE3-CZ3 3.81Å; W88-W96 HydrophobicContact CE3-CZ3 3.81Å; W88-W96 AromaticContact CH2-CH2 3.5Å; W88-W96 HydrophobicContact CH2-CH2 3.5Å; W88-W96 VanDerWaalsContact CH2-CH2 3.5Å; W88-W96 AromaticContact CH2-CZ3 3.7Å; W88-W96 HydrophobicContact CH2-CZ3 3.7Å; W88-W96 HydrophobicContact CZ2-CH2 4.14Å; W88-W96 AromaticContact CZ2-CZ3 3.89Å; W88-W96 HydrophobicContact CZ2-CZ3 3.89Å; W88-W96 AromaticContact CZ3-CH2 3.41Å; W88-W96 HydrophobicContact CZ3-CH2 3.41Å; W88-W96 VanDerWaalsContact CZ3-CH2 3.41Å; W88-W96 AromaticContact CZ3-CZ3 3.66Å; W88-W96 HydrophobicContact CZ3-CZ3 3.66Å; W88-W98 HydrophobicContact CH2-CB 3.71Å; W88-W98 HydrophobicContact CH2-CG 4.26Å; W88-W98 HydrophobicContact CZ2-CB 4.04Å; W88-W98 HydrophobicContact CZ2-CG 4.21Å; W88-M108 HydrophobicContact CE3-CE 3.52Å; W88-M108 HydrophobicContact CZ3-CE 3.88Å
89	N	93.8	Very high	90.6	Very high	11 Å²	11	50.3 Å²	50.3	6%	0.059	23%	0.232	C	C	.	.	H	α-helix	trans	-59.6	-32.8	177.3	-72.9	-18.2	0	0	0	111.5	N48 L50 Q85 M86 F87 R93	N48-N89 PolarHBondContact O-ND2 3.01Å; L50-N89 PolarHBondContact O-ND2 2.81Å; Q85-N89 PolarHBondContact NE2-OD1 2.63Å; Q85-N89 WeakPolarHBondContact O-CB 3.35Å; Q85-N89 VanDerWaalsContact O-CG 3.27Å; Q85-N89 PolarHBondContact O-N 2.96Å; Q85-N89 PolarHBondContact O-ND2 3.4Å; M86-N89 PolarHBondContact O-N 2.99Å; F87-N89 PolarHBondContact O-N 3.4Å; N89-R93 VanDerWaalsContact C-NH1 3.27Å; N89-R93 WeakPolarHBondContact O-CG 3.48Å; N89-R93 PolarHBondContact O-N 3.08Å; N89-R93 PolarHBondContact O-NH1 2.93Å; N89-R93 VanDerWaalsContact O-NH1 3.11Å
90	A	91.7	Very high	89.7	Confident	25 Å²	25	55.8 Å²	55.8	21%	0.207	26%	0.262	C	S	.	.	H	α-helix	trans	-70.7	-38.7	175.4	0	0	0	0	0	113.3	M86 F87 W88 R93 K94	M86-A90 WeakPolarHBondContact O-CB 3.43Å; M86-A90 PolarHBondContact O-N 3.06Å; F87-A90 CarbonylContact O-C 3.53Å; F87-A90 WeakPolarHBondContact O-CA 3.41Å; F87-A90 WeakPolarHBondContact O-CB 3.41Å; F87-A90 PolarHBondContact O-N 3.2Å; W88-A90 PolarHBondContact O-N 3.36Å; A90-R93 VanDerWaalsContact CA-CZ 3.45Å; A90-R93 VanDerWaalsContact CB-NH2 3.34Å; A90-R93 PolarHBondContact O-N 3.03Å; A90-K94 PolarHBondContact O-N 3.21Å
91	M	91	Very high	88.6	Confident	31 Å²	31	55.8 Å²	55.8	15%	0.153	26%	0.263	C	S	.	.	H	α-helix	trans	-64.8	-44.9	175.6	-67.5	-158	-63.5	0	0	111.5	F87 W88 R93 K94 G95 W96 M108	F87-M91 HydrophobicContact CD1-CE 4.03Å; F87-M91 HydrophobicContact CD1-CG 4.08Å; F87-M91 HydrophobicContact CD1-SD 4.07Å; F87-M91 HydrophobicContact CE1-CE 3.91Å; F87-M91 HydrophobicContact CE1-CG 3.83Å; F87-M91 HydrophobicContact CE1-SD 3.46Å; F87-M91 WeakPolarHBondContact CE1-SD 3.22Å; F87-M91 HydrophobicContact CZ-CG 4.46Å; F87-M91 HydrophobicContact CZ-SD 4.27Å; F87-M91 WeakPolarHBondContact O-CG 3.42Å; F87-M91 PolarHBondContact O-N 3.32Å; W88-M91 PolarHBondContact O-N 2.88Å; W88-M91 VanDerWaalsContact O-N 3.08Å; M91-R93 VanDerWaalsContact C-N 3.27Å; M91-R93 PolarHBondContact O-N 3.31Å; M91-K94 WeakPolarHBondContact O-CA 3.35Å; M91-K94 WeakPolarHBondContact O-CB 3.27Å; M91-K94 PolarHBondContact O-N 2.85Å; M91-G95 PolarHBondContact O-N 3.47Å; M91-W96 HydrophobicContact CB-CB 3.96Å; M91-W96 HydrophobicContact CB-CD2 4.08Å; M91-W96 HydrophobicContact CB-CE3 3.67Å; M91-W96 HydrophobicContact CB-CG 4.21Å; M91-W96 HydrophobicContact CE-CD2 4.15Å; M91-W96 HydrophobicContact CE-CE3 3.82Å; M91-W96 HydrophobicContact CE-CH2 4.17Å; M91-W96 HydrophobicContact CE-CZ3 3.81Å; M91-W96 WeakPolarHBondContact O-CB 3.47Å; M91-W96 PolarHBondContact O-N 2.9Å; M91-W96 VanDerWaalsContact O-N 3.16Å; M91-W96 HydrophobicContact SD-CD2 4.42Å; M91-W96 HydrophobicContact SD-CE3 4.49Å; M91-M108 HydrophobicContact CE-CE 3.36Å; M91-M108 HydrophobicContact CE-SD 3.88Å
92	L	91.7	Very high	87.7	Confident	39 Å²	39	63.1 Å²	63.1	20%	0.204	30%	0.303	C	S	.	.	H	α-helix	trans	-57	-40.6	176.4	-67.9	-178.7	0	0	0	112.5	S52 W88 K94 G95 W96 R97	S52-L92 VanDerWaalsContact OG-CD1 3.31Å; S52-L92 WeakPolarHBondContact OG-CD1 3.35Å; W88-L92 PolarHBondContact O-N 2.92Å; L92-K94 VanDerWaalsContact C-N 3.27Å; L92-K94 PolarHBondContact O-N 3.45Å; L92-G95 PolarHBondContact O-N 3.42Å; L92-G95 VanDerWaalsContact O-N 3.14Å; L92-W96 HydrophobicContact CD2-CE3 4Å; L92-W96 HydrophobicContact CD2-CZ3 4.25Å; L92-W96 WeakPolarHBondContact CD2-O 3.26Å; L92-R97 PolarHBondContact O-NH1 3.44Å; L92-R97 VanDerWaalsContact O-NH1 3.11Å
93	R	88.5	Confident	87.2	Confident	71 Å²	71	63.3 Å²	63.3	27%	0.268	30%	0.302	S	S	.	.	H	α-helix	trans	-63.9	-28.7	174.8	-72.3	-170.1	-48.8	-90.2	8.6	113.4	Y35 N89 A90 M91 G95	Y35-R93 WeakPolarHBondContact OH-CD 3.46Å; N89-R93 VanDerWaalsContact C-NH1 3.27Å; N89-R93 WeakPolarHBondContact O-CG 3.48Å; N89-R93 PolarHBondContact O-N 3.08Å; N89-R93 PolarHBondContact O-NH1 2.93Å; N89-R93 VanDerWaalsContact O-NH1 3.11Å; A90-R93 VanDerWaalsContact CA-CZ 3.45Å; A90-R93 VanDerWaalsContact CB-NH2 3.34Å; A90-R93 PolarHBondContact O-N 3.03Å; M91-R93 VanDerWaalsContact C-N 3.27Å; M91-R93 PolarHBondContact O-N 3.31Å; R93-G95 PolarHBondContact O-N 3.02Å
94	K	86.7	Confident	86.8	Confident	177 Å²	177	69.5 Å²	69.5	77%	0.77	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	0.6	176.6	-71	-177.5	178.2	-178.3	0	113.4	A90 M91 L92	A90-K94 PolarHBondContact O-N 3.21Å; M91-K94 WeakPolarHBondContact O-CA 3.35Å; M91-K94 WeakPolarHBondContact O-CB 3.27Å; M91-K94 PolarHBondContact O-N 2.85Å; L92-K94 VanDerWaalsContact C-N 3.27Å; L92-K94 PolarHBondContact O-N 3.45Å
95	G	87.3	Confident	86.3	Confident	44 Å²	44	70.9 Å²	70.9	45%	0.454	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.1	0.6	180	0	0	0	0	0	114.5	M91 L92 R93 R97	M91-G95 PolarHBondContact O-N 3.47Å; L92-G95 PolarHBondContact O-N 3.42Å; L92-G95 VanDerWaalsContact O-N 3.14Å; R93-G95 PolarHBondContact O-N 3.02Å; G95-R97 PolarHBondContact O-NH1 3.45Å
96	W	88.5	Confident	86	Confident	42 Å²	42	76 Å²	76	16%	0.159	36%	0.362	C	S	.	.			trans	-63.8	143.5	173.9	178.6	70.9	0	0	0	111	W88 M91 L92 W98 D101 I103	W88-W96 HydrophobicContact CD2-CZ3 4.01Å; W88-W96 AromaticContact CE3-CH2 3.99Å; W88-W96 HydrophobicContact CE3-CH2 3.99Å; W88-W96 AromaticContact CE3-CZ3 3.81Å; W88-W96 HydrophobicContact CE3-CZ3 3.81Å; W88-W96 AromaticContact CH2-CH2 3.5Å; W88-W96 HydrophobicContact CH2-CH2 3.5Å; W88-W96 VanDerWaalsContact CH2-CH2 3.5Å; W88-W96 AromaticContact CH2-CZ3 3.7Å; W88-W96 HydrophobicContact CH2-CZ3 3.7Å; W88-W96 HydrophobicContact CZ2-CH2 4.14Å; W88-W96 AromaticContact CZ2-CZ3 3.89Å; W88-W96 HydrophobicContact CZ2-CZ3 3.89Å; W88-W96 AromaticContact CZ3-CH2 3.41Å; W88-W96 HydrophobicContact CZ3-CH2 3.41Å; W88-W96 VanDerWaalsContact CZ3-CH2 3.41Å; W88-W96 AromaticContact CZ3-CZ3 3.66Å; W88-W96 HydrophobicContact CZ3-CZ3 3.66Å; M91-W96 HydrophobicContact CB-CB 3.96Å; M91-W96 HydrophobicContact CB-CD2 4.08Å; M91-W96 HydrophobicContact CB-CE3 3.67Å; M91-W96 HydrophobicContact CB-CG 4.21Å; M91-W96 HydrophobicContact CE-CD2 4.15Å; M91-W96 HydrophobicContact CE-CE3 3.82Å; M91-W96 HydrophobicContact CE-CH2 4.17Å; M91-W96 HydrophobicContact CE-CZ3 3.81Å; M91-W96 WeakPolarHBondContact O-CB 3.47Å; M91-W96 PolarHBondContact O-N 2.9Å; M91-W96 VanDerWaalsContact O-N 3.16Å; M91-W96 HydrophobicContact SD-CD2 4.42Å; M91-W96 HydrophobicContact SD-CE3 4.49Å; L92-W96 HydrophobicContact CD2-CE3 4Å; L92-W96 HydrophobicContact CD2-CZ3 4.25Å; L92-W96 WeakPolarHBondContact CD2-O 3.26Å; W96-W98 HydrophobicContact CH2-CB 3.51Å; W96-W98 HydrophobicContact CZ2-CB 3.94Å; W96-W98 HydrophobicContact CZ3-CB 4.08Å; W96-D101 PolarHBondContact NE1-OD2 3.45Å; W96-I103 HydrophobicContact CH2-CD1 4.02Å; W96-I103 HydrophobicContact CZ2-CB 4.3Å; W96-I103 HydrophobicContact CZ2-CD1 3.28Å; W96-I103 HydrophobicContact CZ2-CG1 3.85Å
97	R	84.9	Confident	85.8	Confident	124 Å²	124	78.4 Å²	78.4	47%	0.468	38%	0.375	S	S	.	.			trans	-134.6	121.1	179	-61.2	-65.4	177.3	-96.1	1	109.2	L92 G95 R99 D100	L92-R97 PolarHBondContact O-NH1 3.44Å; L92-R97 VanDerWaalsContact O-NH1 3.11Å; G95-R97 PolarHBondContact O-NH1 3.45Å; R97-R99 PolarHBondContact O-N 3.39Å; R97-R99 VanDerWaalsContact O-N 3.09Å; R97-D100 WeakPolarHBondContact CB-OD2 3.33Å; R97-D100 PolarHBondContact O-N 3.11Å
98	W	76.3	Confident	85.7	Confident	88 Å²	88	76.4 Å²	76.4	33%	0.333	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-15.2	179.8	67.2	-94.8	0	0	0	114.7	P56 W88 W96 D100	P56-W98 HydrophobicContact CG-CD2 4.39Å; P56-W98 HydrophobicContact CG-CE3 4.26Å; W88-W98 HydrophobicContact CH2-CB 3.71Å; W88-W98 HydrophobicContact CH2-CG 4.26Å; W88-W98 HydrophobicContact CZ2-CB 4.04Å; W88-W98 HydrophobicContact CZ2-CG 4.21Å; W96-W98 HydrophobicContact CH2-CB 3.51Å; W96-W98 HydrophobicContact CZ2-CB 3.94Å; W96-W98 HydrophobicContact CZ3-CB 4.08Å; W98-D100 VanDerWaalsContact C-N 3.25Å
99	R	76.2	Confident	85.6	Confident	198 Å²	198	80.3 Å²	80.3	75%	0.747	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-18.4	175.9	-71.6	-171.2	-101.3	-142.6	-4.1	112.9	R97	R97-R99 PolarHBondContact O-N 3.39Å; R97-R99 VanDerWaalsContact O-N 3.09Å
100	D	76.3	Confident	85.7	Confident	129 Å²	129	84.1 Å²	84.1	69%	0.69	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-22.5	-177.7	-56.6	-19.9	0	0	0	111.2	R97 W98	R97-D100 WeakPolarHBondContact CB-OD2 3.33Å; R97-D100 PolarHBondContact O-N 3.11Å; W98-D100 VanDerWaalsContact C-N 3.25Å
101	D	72.7	Confident	85.8	Confident	79 Å²	79	86.1 Å²	86.1	42%	0.422	41%	0.414	S	S	.	.	S	Bend	trans	-130	129.1	-178.2	-59.7	-45.3	0	0	0	110.9	W96 I103	W96-D101 PolarHBondContact NE1-OD2 3.45Å; D101-I103 HydrophobicContact CB-CG1 3.95Å; D101-I103 PolarHBondContact O-N 2.65Å
102	D	75.8	Confident	85.9	Confident	167 Å²	167	85 Å²	85	89%	0.893	41%	0.409	S	S	*	.			trans	-73.3	61.8	174.2	-74.2	-33.2	0	0	0	112.3	K104	D102-K104 PolarHBondContact O-N 3.13Å
103	I	82.7	Confident	86.1	Confident	35 Å²	35	88.5 Å²	88.5	18%	0.179	42%	0.424	C	S	.	.			trans	-74.9	120.8	177.6	-64.2	-162.3	0	0	0	110.3	F57 W96 D101 D107 M108	F57-I103 WeakPolarHBondContact CE1-O 3.26Å; W96-I103 HydrophobicContact CH2-CD1 4.02Å; W96-I103 HydrophobicContact CZ2-CB 4.3Å; W96-I103 HydrophobicContact CZ2-CD1 3.28Å; W96-I103 HydrophobicContact CZ2-CG1 3.85Å; D101-I103 HydrophobicContact CB-CG1 3.95Å; D101-I103 PolarHBondContact O-N 2.65Å; I103-D107 HydrophobicContact CG2-CB 4.16Å; I103-M108 HydrophobicContact CG2-CE 3.91Å
104	K	86.5	Confident	86.5	Confident	130 Å²	130	89.8 Å²	89.8	57%	0.565	44%	0.435	S	S	*	.			trans	-86.2	157.2	171	-60	179.6	-176.9	172.6	0	111	D102 E106 D107 M108	D102-K104 PolarHBondContact O-N 3.13Å; K104-E106 WeakPolarHBondContact CB-OE2 3.45Å; K104-E106 PolarHBondContact O-N 3.23Å; K104-D107 WeakPolarHBondContact CB-OD2 3.44Å; K104-D107 PolarHBondContact N-OD2 3.13Å; K104-D107 WeakPolarHBondContact O-CB 3.44Å; K104-D107 PolarHBondContact O-N 3.18Å; K104-M108 PolarHBondContact O-N 2.97Å
105	P	85.3	Confident	86.9	Confident	42 Å²	42	84.9 Å²	84.9	27%	0.273	42%	0.415	S	S	.	.	H	α-helix	trans	-56.1	-33.1	176.2	17.5	-28.2	0	0	0	113.2	F57 M108 N109	F57-P105 HydrophobicContact CD1-CG 4.5Å; F57-P105 HydrophobicContact CD2-CB 3.75Å; F57-P105 HydrophobicContact CD2-CG 4.39Å; F57-P105 HydrophobicContact CE2-CB 3.84Å; F57-P105 HydrophobicContact CG-CB 4.18Å; F57-P105 HydrophobicContact CG-CG 4.32Å; F57-P105 HydrophobicContact CZ-CB 4.32Å; P105-M108 WeakPolarHBondContact O-CB 3.29Å; P105-M108 PolarHBondContact O-N 3.38Å; P105-N109 PolarHBondContact O-N 3.43Å; P105-N109 PolarHBondContact O-ND2 3.45Å
106	E	89.3	Confident	87.3	Confident	110 Å²	110	83.1 Å²	83.1	51%	0.514	40%	0.395	S	S	.	.	H	α-helix	trans	-66.7	-38.2	177.1	-60	73.6	-161.8	0	0	111.9	K104 M108 N109 N110	K104-E106 WeakPolarHBondContact CB-OE2 3.45Å; K104-E106 PolarHBondContact O-N 3.23Å; E106-M108 VanDerWaalsContact C-N 3.28Å; E106-M108 PolarHBondContact O-N 2.97Å; E106-N109 PolarHBondContact O-N 3.26Å; E106-N110 VanDerWaalsContact O-CG 3.22Å; E106-N110 PolarHBondContact O-N 3.41Å; E106-N110 PolarHBondContact O-ND2 2.89Å
107	D	91.1	Very high	87.7	Confident	63 Å²	63	83.9 Å²	83.9	34%	0.337	40%	0.404	S	S	.	.	H	α-helix	trans	-63.5	-37.9	177.4	-60.5	-37.6	0	0	0	110.8	I103 K104 N110 I111	I103-D107 HydrophobicContact CG2-CB 4.16Å; K104-D107 WeakPolarHBondContact CB-OD2 3.44Å; K104-D107 PolarHBondContact N-OD2 3.13Å; K104-D107 WeakPolarHBondContact O-CB 3.44Å; K104-D107 PolarHBondContact O-N 3.18Å; D107-N110 PolarHBondContact O-N 2.87Å; D107-I111 WeakPolarHBondContact O-CB 3.42Å; D107-I111 WeakPolarHBondContact O-CD1 3.42Å; D107-I111 WeakPolarHBondContact O-CG1 3.43Å; D107-I111 PolarHBondContact O-N 3.5Å
108	M	90.3	Very high	88.3	Confident	0 Å²	0	82 Å²	82	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-59.4	-49.3	175.2	-169.5	58.8	48.7	0	0	111.6	L59 P84 F87 W88 M91 I103 K104 P105 E106 N110 I111 I112	L59-M108 HydrophobicContact CD1-CG 4.45Å; L59-M108 HydrophobicContact CD2-CB 4.18Å; L59-M108 HydrophobicContact CD2-CG 3.82Å; P84-M108 HydrophobicContact CB-CG 4.45Å; F87-M108 HydrophobicContact CD1-SD 3.65Å; F87-M108 HydrophobicContact CE1-SD 4.15Å; W88-M108 HydrophobicContact CE3-CE 3.52Å; W88-M108 HydrophobicContact CZ3-CE 3.88Å; M91-M108 HydrophobicContact CE-CE 3.36Å; M91-M108 HydrophobicContact CE-SD 3.88Å; I103-M108 HydrophobicContact CG2-CE 3.91Å; K104-M108 PolarHBondContact O-N 2.97Å; P105-M108 WeakPolarHBondContact O-CB 3.29Å; P105-M108 PolarHBondContact O-N 3.38Å; E106-M108 VanDerWaalsContact C-N 3.28Å; E106-M108 PolarHBondContact O-N 2.97Å; M108-N110 VanDerWaalsContact C-N 3.31Å; M108-N110 PolarHBondContact O-N 2.92Å; M108-I111 PolarHBondContact O-N 3.48Å; M108-I112 HydrophobicContact CG-CD1 3.82Å; M108-I112 WeakPolarHBondContact O-CD1 3.38Å; M108-I112 VanDerWaalsContact O-CG1 3.26Å; M108-I112 WeakPolarHBondContact O-CG1 3.22Å; M108-I112 PolarHBondContact O-N 2.87Å; M108-I112 HydrophobicContact SD-CD1 4.09Å
109	N	92.3	Very high	89.3	Confident	82 Å²	82	78.9 Å²	78.9	44%	0.439	39%	0.393	S	S	.	.	H	α-helix	trans	-61.8	-41.9	178.7	-68	-33.5	0	0	0	111	P105 E106 I112 H113	P105-N109 PolarHBondContact O-N 3.43Å; P105-N109 PolarHBondContact O-ND2 3.45Å; E106-N109 PolarHBondContact O-N 3.26Å; N109-I112 PolarHBondContact O-N 3.44Å; N109-H113 VanDerWaalsContact O-CB 3.26Å; N109-H113 WeakPolarHBondContact O-CB 3.36Å; N109-H113 PolarHBondContact O-N 3.36Å
110	N	94.6	Very high	90.3	Very high	90 Å²	90	71.4 Å²	71.4	48%	0.481	37%	0.367	S	S	.	.	H	α-helix	trans	-62.6	-46.9	177.2	-69.1	-26.8	0	0	0	112.1	E106 D107 M108 I112 H113 I114	E106-N110 VanDerWaalsContact O-CG 3.22Å; E106-N110 PolarHBondContact O-N 3.41Å; E106-N110 PolarHBondContact O-ND2 2.89Å; D107-N110 PolarHBondContact O-N 2.87Å; M108-N110 VanDerWaalsContact C-N 3.31Å; M108-N110 PolarHBondContact O-N 2.92Å; N110-I112 VanDerWaalsContact C-N 3.34Å; N110-I112 PolarHBondContact O-N 3.34Å; N110-H113 PolarHBondContact O-N 3.44Å; N110-I114 WeakPolarHBondContact O-CB 3.29Å; N110-I114 WeakPolarHBondContact O-CD1 3.46Å; N110-I114 WeakPolarHBondContact O-CG1 3.48Å; N110-I114 PolarHBondContact O-N 3.43Å
111	I	93.5	Very high	91.3	Very high	67 Å²	67	68.8 Å²	68.8	34%	0.344	35%	0.352	S	S	.	.	H	α-helix	trans	-59.4	-46.1	178.9	-70.6	162.9	0	0	0	110.6	F87 D107 M108 I114 H115	F87-I111 HydrophobicContact CE1-CG2 3.9Å; F87-I111 HydrophobicContact CZ-CG2 3.83Å; D107-I111 WeakPolarHBondContact O-CB 3.42Å; D107-I111 WeakPolarHBondContact O-CD1 3.42Å; D107-I111 WeakPolarHBondContact O-CG1 3.43Å; D107-I111 PolarHBondContact O-N 3.5Å; M108-I111 PolarHBondContact O-N 3.48Å; I111-I114 PolarHBondContact O-N 3.3Å; I111-H115 WeakPolarHBondContact O-CB 3.16Å; I111-H115 PolarHBondContact O-N 2.91Å
112	I	94.3	Very high	92.4	Very high	9 Å²	9	67.7 Å²	67.7	5%	0.046	35%	0.354	C	S	.	.	H	α-helix	trans	-66.2	-44.9	-179.8	-66.5	161.2	0	0	0	110.5	P84 F87 M108 N109 N110 I114 H115 N116	P84-I112 HydrophobicContact CB-CD1 3.53Å; P84-I112 HydrophobicContact CG-CD1 3.71Å; F87-I112 HydrophobicContact CB-CD1 4.04Å; F87-I112 HydrophobicContact CB-CG1 4.15Å; F87-I112 HydrophobicContact CD1-CD1 4.34Å; F87-I112 HydrophobicContact CD1-CG1 3.99Å; F87-I112 HydrophobicContact CD2-CG1 4.21Å; F87-I112 HydrophobicContact CE1-CG1 4.44Å; F87-I112 HydrophobicContact CG-CD1 4.23Å; F87-I112 HydrophobicContact CG-CG1 3.86Å; M108-I112 HydrophobicContact CG-CD1 3.82Å; M108-I112 WeakPolarHBondContact O-CD1 3.38Å; M108-I112 VanDerWaalsContact O-CG1 3.26Å; M108-I112 WeakPolarHBondContact O-CG1 3.22Å; M108-I112 PolarHBondContact O-N 2.87Å; M108-I112 HydrophobicContact SD-CD1 4.09Å; N109-I112 PolarHBondContact O-N 3.44Å; N110-I112 VanDerWaalsContact C-N 3.34Å; N110-I112 PolarHBondContact O-N 3.34Å; I112-I114 VanDerWaalsContact C-N 3.34Å; I112-I114 PolarHBondContact O-N 3.05Å; I112-H115 WeakPolarHBondContact O-CB 3.28Å; I112-H115 PolarHBondContact O-N 3.29Å; I112-H115 VanDerWaalsContact O-N 3.13Å; I112-N116 PolarHBondContact O-N 3.45Å; I112-N116 PolarHBondContact O-OD1 3.05Å
113	H	95.5	Very high	93.4	Very high	112 Å²	112	60.5 Å²	60.5	52%	0.519	31%	0.314	S	S	.	.	H	α-helix	trans	-57.9	-47.6	177.3	-177.8	68.2	0	0	0	111.3	N109 N110 H115 N116 V117	N109-H113 VanDerWaalsContact O-CB 3.26Å; N109-H113 WeakPolarHBondContact O-CB 3.36Å; N109-H113 PolarHBondContact O-N 3.36Å; N110-H113 PolarHBondContact O-N 3.44Å; H113-H115 VanDerWaalsContact C-N 3.31Å; H113-H115 PolarHBondContact O-N 2.87Å; H113-N116 PolarHBondContact O-N 3.33Å; H113-V117 WeakPolarHBondContact O-CB 3.41Å; H113-V117 VanDerWaalsContact O-CG2 3.29Å; H113-V117 WeakPolarHBondContact O-CG2 3.47Å; H113-V117 PolarHBondContact O-N 3.38Å
114	I	96.9	Very high	94.1	Very high	97 Å²	97	65.6 Å²	65.6	50%	0.497	33%	0.331	S	S	.	.	H	α-helix	trans	-59.5	-42.1	176	-68.1	162.7	0	0	0	110.9	N110 I111 I112 V117 N118	N110-I114 WeakPolarHBondContact O-CB 3.29Å; N110-I114 WeakPolarHBondContact O-CD1 3.46Å; N110-I114 WeakPolarHBondContact O-CG1 3.48Å; N110-I114 PolarHBondContact O-N 3.43Å; I111-I114 PolarHBondContact O-N 3.3Å; I112-I114 VanDerWaalsContact C-N 3.34Å; I112-I114 PolarHBondContact O-N 3.05Å; I114-V117 PolarHBondContact O-N 3.28Å; I114-N118 WeakPolarHBondContact O-CB 3.3Å; I114-N118 VanDerWaalsContact O-CG 3.22Å; I114-N118 PolarHBondContact O-N 3.46Å; I114-N118 PolarHBondContact O-ND2 2.97Å
115	H	94.7	Very high	94.6	Very high	75 Å²	75	63.2 Å²	63.2	35%	0.347	32%	0.322	S	S	.	.	H	α-helix	trans	-63.3	-46.3	178	-176.1	71.9	0	0	0	112.2	I111 I112 H113 N118 N119	I111-H115 WeakPolarHBondContact O-CB 3.16Å; I111-H115 PolarHBondContact O-N 2.91Å; I112-H115 WeakPolarHBondContact O-CB 3.28Å; I112-H115 PolarHBondContact O-N 3.29Å; I112-H115 VanDerWaalsContact O-N 3.13Å; H113-H115 VanDerWaalsContact C-N 3.31Å; H113-H115 PolarHBondContact O-N 2.87Å; H115-N118 PolarHBondContact O-N 2.95Å; H115-N119 PolarHBondContact CD2-ND2 3.02Å; H115-N119 VanDerWaalsContact CD2-ND2 3.3Å; H115-N119 PolarHBondContact NE2-ND2 2.91Å; H115-N119 VanDerWaalsContact O-CG 3.24Å; H115-N119 PolarHBondContact O-N 3.1Å; H115-N119 PolarHBondContact O-ND2 3.24Å
116	N	95.9	Very high	95.1	Very high	7 Å²	7	64 Å²	64	4%	0.037	33%	0.326	C	S	.	.	H	α-helix	trans	-63.3	-45.3	178.1	-67.3	-5.2	0	0	0	110.5	E64 Y81 I112 H113 N118 N119 E120	E64-N116 PolarHBondContact OE2-ND2 3.23Å; Y81-N116 HydrophobicContact CD2-CB 3.98Å; Y81-N116 HydrophobicContact CE2-CB 4.01Å; I112-N116 PolarHBondContact O-N 3.45Å; I112-N116 PolarHBondContact O-OD1 3.05Å; H113-N116 PolarHBondContact O-N 3.33Å; N116-N118 PolarHBondContact O-N 3.09Å; N116-N119 WeakPolarHBondContact O-CB 3.34Å; N116-N119 PolarHBondContact O-N 2.82Å; N116-E120 WeakPolarHBondContact O-CG 3.48Å; N116-E120 PolarHBondContact O-N 2.75Å
117	V	97.4	Very high	95.3	Very high	57 Å²	57	61.9 Å²	61.9	35%	0.345	32%	0.318	S	S	.	.	H	α-helix	trans	-57	-49.2	173.7	170.1	0	0	0	0	110.6	H113 I114 N119 E120 L121	H113-V117 WeakPolarHBondContact O-CB 3.41Å; H113-V117 VanDerWaalsContact O-CG2 3.29Å; H113-V117 WeakPolarHBondContact O-CG2 3.47Å; H113-V117 PolarHBondContact O-N 3.38Å; I114-V117 PolarHBondContact O-N 3.28Å; V117-N119 VanDerWaalsContact C-N 3.28Å; V117-N119 PolarHBondContact O-N 2.94Å; V117-E120 CarbonylContact O-C 3.6Å; V117-E120 WeakPolarHBondContact O-CB 3.39Å; V117-E120 PolarHBondContact O-N 3.05Å; V117-E120 VanDerWaalsContact O-N 3.1Å; V117-L121 HydrophobicContact CG1-CD1 4.26Å; V117-L121 HydrophobicContact CG1-CG 4.13Å; V117-L121 VanDerWaalsContact O-CG 3.28Å; V117-L121 WeakPolarHBondContact O-CG 3.48Å; V117-L121 PolarHBondContact O-N 3.28Å
118	N	96.7	Very high	95.5	Very high	85 Å²	85	64.8 Å²	64.8	46%	0.455	33%	0.327	S	S	.	.	H	α-helix	trans	-58.4	-39	178.7	-77.4	-30.6	0	0	0	112.7	I114 H115 N116 L121 A122	I114-N118 WeakPolarHBondContact O-CB 3.3Å; I114-N118 VanDerWaalsContact O-CG 3.22Å; I114-N118 PolarHBondContact O-N 3.46Å; I114-N118 PolarHBondContact O-ND2 2.97Å; H115-N118 PolarHBondContact O-N 2.95Å; N116-N118 PolarHBondContact O-N 3.09Å; N118-L121 PolarHBondContact O-N 3.1Å; N118-A122 WeakPolarHBondContact O-CB 3.27Å; N118-A122 PolarHBondContact O-N 3.29Å
119	N	96.4	Very high	95.7	Very high	22 Å²	22	72.2 Å²	72.2	12%	0.118	36%	0.356	C	S	.	.	H	α-helix	trans	-65.3	-42.5	175.6	-67.4	-26.5	0	0	0	111.8	Y81 H115 N116 V117 A122 W123 F145	Y81-N119 HydrophobicContact CE1-CB 4Å; Y81-N119 VanDerWaalsContact OH-CB 3.3Å; Y81-N119 WeakPolarHBondContact OH-CB 3.36Å; H115-N119 PolarHBondContact CD2-ND2 3.02Å; H115-N119 VanDerWaalsContact CD2-ND2 3.3Å; H115-N119 PolarHBondContact NE2-ND2 2.91Å; H115-N119 VanDerWaalsContact O-CG 3.24Å; H115-N119 PolarHBondContact O-N 3.1Å; H115-N119 PolarHBondContact O-ND2 3.24Å; N116-N119 WeakPolarHBondContact O-CB 3.34Å; N116-N119 PolarHBondContact O-N 2.82Å; V117-N119 VanDerWaalsContact C-N 3.28Å; V117-N119 PolarHBondContact O-N 2.94Å; N119-A122 PolarHBondContact O-N 3.17Å; N119-W123 PolarHBondContact O-N 3.44Å; N119-F145 HydrophobicContact CB-CZ 4.25Å
120	E	97.7	Very high	95.8	Very high	42 Å²	42	72 Å²	72	20%	0.196	35%	0.352	C	S	.	.	H	α-helix	trans	-65.3	-39.5	175.5	-68	-64	159.8	0	0	111.9	S66 S67 Y81 N116 V117 W123 R124	S66-E120 VanDerWaalsContact CA-OE1 3.27Å; S66-E120 WeakPolarHBondContact CA-OE1 3.04Å; S66-E120 VanDerWaalsContact CB-OE1 3.26Å; S66-E120 WeakPolarHBondContact CB-OE1 3.29Å; S67-E120 VanDerWaalsContact CB-OE2 3.24Å; S67-E120 WeakPolarHBondContact CB-OE2 3.36Å; S67-E120 PolarHBondContact N-OE1 3.41Å; S67-E120 PolarHBondContact OG-OE2 3.43Å; Y81-E120 PolarHBondContact OH-OE1 2.81Å; N116-E120 WeakPolarHBondContact O-CG 3.48Å; N116-E120 PolarHBondContact O-N 2.75Å; V117-E120 CarbonylContact O-C 3.6Å; V117-E120 WeakPolarHBondContact O-CB 3.39Å; V117-E120 PolarHBondContact O-N 3.05Å; V117-E120 VanDerWaalsContact O-N 3.1Å; E120-W123 PolarHBondContact O-N 2.93Å; E120-R124 WeakPolarHBondContact O-CG 3.32Å; E120-R124 PolarHBondContact O-N 3.35Å
121	L	98	Very high	95.6	Very high	73 Å²	73	70.7 Å²	70.7	38%	0.382	35%	0.354	S	S	.	.	H	α-helix	trans	-60.8	-47.1	172.7	-65.2	-169.9	0	0	0	111.5	V117 N118 W123 R124 E125	V117-L121 HydrophobicContact CG1-CD1 4.26Å; V117-L121 HydrophobicContact CG1-CG 4.13Å; V117-L121 VanDerWaalsContact O-CG 3.28Å; V117-L121 WeakPolarHBondContact O-CG 3.48Å; V117-L121 PolarHBondContact O-N 3.28Å; N118-L121 PolarHBondContact O-N 3.1Å; L121-W123 VanDerWaalsContact C-N 3.29Å; L121-W123 PolarHBondContact O-N 3.36Å; L121-R124 PolarHBondContact O-N 3.3Å; L121-E125 PolarHBondContact O-N 2.87Å
122	A	96.4	Very high	95.6	Very high	56 Å²	56	73.2 Å²	73.2	46%	0.463	37%	0.368	S	S	.	.	H	α-helix	trans	-60.9	-41.5	178.1	0	0	0	0	0	111.1	N118 N119 E125 V126	N118-A122 WeakPolarHBondContact O-CB 3.27Å; N118-A122 PolarHBondContact O-N 3.29Å; N119-A122 PolarHBondContact O-N 3.17Å; A122-E125 WeakPolarHBondContact O-CB 3.47Å; A122-E125 PolarHBondContact O-N 2.95Å; A122-V126 WeakPolarHBondContact O-CG2 3.41Å; A122-V126 PolarHBondContact O-N 3.27Å
123	W	96.7	Very high	95.4	Very high	17 Å²	17	77.3 Å²	77.3	6%	0.064	39%	0.386	C	S	.	.	H	α-helix	trans	-64.6	-45	175.9	-176.4	-120.9	0	0	0	112.6	I68 P69 N119 E120 L121 E125 V126 L127 L142	I68-W123 HydrophobicContact CB-CD2 4.42Å; I68-W123 HydrophobicContact CB-CG 4.36Å; I68-W123 HydrophobicContact CD1-CB 3.88Å; I68-W123 HydrophobicContact CD1-CG 4.13Å; I68-W123 HydrophobicContact CG1-CB 3.87Å; I68-W123 HydrophobicContact CG1-CD2 4.15Å; I68-W123 HydrophobicContact CG1-CG 3.65Å; I68-W123 HydrophobicContact CG2-CD2 3.79Å; I68-W123 HydrophobicContact CG2-CE3 4Å; I68-W123 HydrophobicContact CG2-CG 4.22Å; I68-W123 HydrophobicContact CG2-CH2 4.43Å; I68-W123 HydrophobicContact CG2-CZ2 4.22Å; I68-W123 HydrophobicContact CG2-CZ3 4.32Å; P69-W123 HydrophobicContact CG-CZ2 4.19Å; N119-W123 PolarHBondContact O-N 3.44Å; E120-W123 PolarHBondContact O-N 2.93Å; L121-W123 VanDerWaalsContact C-N 3.29Å; L121-W123 PolarHBondContact O-N 3.36Å; W123-E125 PolarHBondContact O-N 2.93Å; W123-V126 HydrophobicContact CE3-CB 4.05Å; W123-V126 HydrophobicContact CE3-CG1 4.06Å; W123-V126 HydrophobicContact CZ3-CB 4.29Å; W123-V126 HydrophobicContact CZ3-CG1 3.77Å; W123-V126 WeakPolarHBondContact O-CB 3.37Å; W123-V126 PolarHBondContact O-N 2.98Å; W123-V126 VanDerWaalsContact O-N 3.1Å; W123-L127 HydrophobicContact CD2-CG 4.44Å; W123-L127 HydrophobicContact CH2-CD2 4.4Å; W123-L127 HydrophobicContact CZ2-CD2 3.73Å; W123-L127 HydrophobicContact CZ2-CG 4.34Å; W123-L127 WeakPolarHBondContact O-CG 3.26Å; W123-L127 PolarHBondContact O-N 2.97Å; W123-L142 HydrophobicContact CH2-CB 4.2Å; W123-L142 HydrophobicContact CZ3-CB 3.96Å; W123-L142 HydrophobicContact CZ3-CD1 4.3Å
124	R	96.9	Very high	94.9	Very high	142 Å²	142	73.7 Å²	73.7	54%	0.536	38%	0.376	S	S	.	.	H	α-helix	trans	-58.5	-36.1	174.6	-72.1	-168	-59.4	135.6	-15.6	112.2	E120 L121 L127 K128	E120-R124 WeakPolarHBondContact O-CG 3.32Å; E120-R124 PolarHBondContact O-N 3.35Å; L121-R124 PolarHBondContact O-N 3.3Å; R124-L127 PolarHBondContact O-N 3.31Å; R124-K128 WeakPolarHBondContact O-CG 3.36Å; R124-K128 PolarHBondContact O-N 2.98Å
125	E	97.1	Very high	94.6	Very high	79 Å²	79	75.7 Å²	75.7	37%	0.369	39%	0.387	S	S	.	.	H	α-helix	trans	-67.1	-46.9	174.7	-169	60.1	-160.1	0	0	111.1	L121 A122 W123 L127 K128 W129	L121-E125 PolarHBondContact O-N 2.87Å; A122-E125 WeakPolarHBondContact O-CB 3.47Å; A122-E125 PolarHBondContact O-N 2.95Å; W123-E125 PolarHBondContact O-N 2.93Å; E125-L127 VanDerWaalsContact C-N 3.27Å; E125-L127 PolarHBondContact O-N 3.05Å; E125-K128 WeakPolarHBondContact O-CB 3.49Å; E125-K128 PolarHBondContact O-N 2.82Å; E125-K128 WeakPolarHBondContact OE2-CD 3.37Å; E125-K128 IonicContact OE2-NZ 3.62Å; E125-K128 PolarHBondContact OE2-NZ 3.29Å; E125-W129 PolarHBondContact O-N 2.86Å; E125-W129 PolarHBondContact OE1-NE1 3.12Å
126	V	94.9	Very high	94.2	Very high	59 Å²	59	79.2 Å²	79.2	36%	0.358	40%	0.404	S	S	.	.	H	α-helix	trans	-53.1	-45.9	173.3	171.4	0	0	0	0	110.9	A122 W123 K128 W129 E130	A122-V126 WeakPolarHBondContact O-CG2 3.41Å; A122-V126 PolarHBondContact O-N 3.27Å; W123-V126 HydrophobicContact CE3-CB 4.05Å; W123-V126 HydrophobicContact CE3-CG1 4.06Å; W123-V126 HydrophobicContact CZ3-CB 4.29Å; W123-V126 HydrophobicContact CZ3-CG1 3.77Å; W123-V126 WeakPolarHBondContact O-CB 3.37Å; W123-V126 PolarHBondContact O-N 2.98Å; W123-V126 VanDerWaalsContact O-N 3.1Å; V126-K128 VanDerWaalsContact C-N 3.25Å; V126-K128 PolarHBondContact O-N 3.1Å; V126-W129 WeakPolarHBondContact O-CA 3.41Å; V126-W129 WeakPolarHBondContact O-CB 3.44Å; V126-W129 PolarHBondContact O-N 3.46Å; V126-E130 HydrophobicContact CG1-CG 3.93Å; V126-E130 WeakPolarHBondContact O-CG 3.26Å; V126-E130 PolarHBondContact O-N 2.89Å
127	L	94.4	Very high	93.7	Very high	66 Å²	66	81.6 Å²	81.6	35%	0.346	42%	0.421	S	S	.	.	H	α-helix	trans	-59.4	-33.1	177.8	-67.1	178.7	0	0	0	113.4	W123 R124 E125 A131 P140	W123-L127 HydrophobicContact CD2-CG 4.44Å; W123-L127 HydrophobicContact CH2-CD2 4.4Å; W123-L127 HydrophobicContact CZ2-CD2 3.73Å; W123-L127 HydrophobicContact CZ2-CG 4.34Å; W123-L127 WeakPolarHBondContact O-CG 3.26Å; W123-L127 PolarHBondContact O-N 2.97Å; R124-L127 PolarHBondContact O-N 3.31Å; E125-L127 VanDerWaalsContact C-N 3.27Å; E125-L127 PolarHBondContact O-N 3.05Å; L127-A131 WeakPolarHBondContact O-CB 3.27Å; L127-A131 PolarHBondContact O-N 3.18Å; L127-P140 HydrophobicContact CD2-CB 4.37Å; L127-P140 HydrophobicContact CD2-CG 3.42Å; L127-P140 VanDerWaalsContact CD2-CG 3.42Å
128	K	95	Very high	93.1	Very high	123 Å²	123	86 Å²	86	54%	0.535	44%	0.439	S	S	.	.	H	α-helix	trans	-67.6	-38.4	173.4	-64.7	174.2	-164.8	161.8	0	112	R124 E125 V126	R124-K128 WeakPolarHBondContact O-CG 3.36Å; R124-K128 PolarHBondContact O-N 2.98Å; E125-K128 WeakPolarHBondContact O-CB 3.49Å; E125-K128 PolarHBondContact O-N 2.82Å; E125-K128 WeakPolarHBondContact OE2-CD 3.37Å; E125-K128 IonicContact OE2-NZ 3.62Å; E125-K128 PolarHBondContact OE2-NZ 3.29Å; V126-K128 VanDerWaalsContact C-N 3.25Å; V126-K128 PolarHBondContact O-N 3.1Å
129	W	94.7	Very high	92.7	Very high	156 Å²	156	86.8 Å²	86.8	59%	0.591	45%	0.447	S	S	*	.	H	α-helix	trans	-70.4	-40.9	176.7	-71.9	99.3	0	0	0	111.9	E125 V126 A131 L132 H133	E125-W129 PolarHBondContact O-N 2.86Å; E125-W129 PolarHBondContact OE1-NE1 3.12Å; V126-W129 WeakPolarHBondContact O-CA 3.41Å; V126-W129 WeakPolarHBondContact O-CB 3.44Å; V126-W129 PolarHBondContact O-N 3.46Å; W129-A131 VanDerWaalsContact C-N 3.28Å; W129-A131 PolarHBondContact O-N 2.63Å; W129-L132 HydrophobicContact CE3-CD1 4.01Å; W129-L132 HydrophobicContact CZ3-CD1 4.34Å; W129-L132 WeakPolarHBondContact O-CB 3.24Å; W129-L132 PolarHBondContact O-N 2.96Å; W129-H133 PolarHBondContact O-ND1 2.99Å
130	E	93.8	Very high	92.5	Very high	77 Å²	77	87.1 Å²	87.1	36%	0.36	45%	0.451	S	S	.	.	H	α-helix	trans	-66.1	-31.1	175.3	-65.6	-62.3	135.3	0	0	111.7	V126 L132 H133 A134 P140	V126-E130 HydrophobicContact CG1-CG 3.93Å; V126-E130 WeakPolarHBondContact O-CG 3.26Å; V126-E130 PolarHBondContact O-N 2.89Å; E130-L132 PolarHBondContact O-N 2.7Å; E130-L132 VanDerWaalsContact O-N 3.16Å; E130-H133 CarbonylContact O-C 3.52Å; E130-H133 WeakPolarHBondContact O-CA 3.48Å; E130-H133 PolarHBondContact O-N 3.45Å; E130-A134 PolarHBondContact O-N 3.45Å; E130-P140 HydrophobicContact CB-CB 4.14Å; E130-P140 HydrophobicContact CB-CG 4.1Å; E130-P140 HydrophobicContact CG-CB 3.92Å; E130-P140 HydrophobicContact CG-CG 4.35Å
131	A	91.6	Very high	92.3	Very high	63 Å²	63	89.7 Å²	89.7	52%	0.521	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-61.2	-23.5	174.6	0	0	0	0	0	113.4	L127 W129 H133 A134	L127-A131 WeakPolarHBondContact O-CB 3.27Å; L127-A131 PolarHBondContact O-N 3.18Å; W129-A131 VanDerWaalsContact C-N 3.28Å; W129-A131 PolarHBondContact O-N 2.63Å; A131-H133 PolarHBondContact O-N 2.98Å; A131-A134 WeakPolarHBondContact O-CB 3.36Å; A131-A134 PolarHBondContact O-N 3.33Å
132	L	91.9	Very high	92.1	Very high	121 Å²	121	88.2 Å²	88.2	63%	0.634	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-70.5	-17	173.1	-58.6	176.3	0	0	0	112.8	W129 E130	W129-L132 HydrophobicContact CE3-CD1 4.01Å; W129-L132 HydrophobicContact CZ3-CD1 4.34Å; W129-L132 WeakPolarHBondContact O-CB 3.24Å; W129-L132 PolarHBondContact O-N 2.96Å; E130-L132 PolarHBondContact O-N 2.7Å; E130-L132 VanDerWaalsContact O-N 3.16Å
133	H	90.4	Very high	92	Very high	94 Å²	94	93.7 Å²	93.7	44%	0.435	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-116.2	26.2	178.7	-55.8	87.8	0	0	0	111.4	W129 E130 A131 N135 E136 C137	W129-H133 PolarHBondContact O-ND1 2.99Å; E130-H133 CarbonylContact O-C 3.52Å; E130-H133 WeakPolarHBondContact O-CA 3.48Å; E130-H133 PolarHBondContact O-N 3.45Å; A131-H133 PolarHBondContact O-N 2.98Å; H133-N135 PolarHBondContact O-N 3.24Å; H133-N135 VanDerWaalsContact O-N 3.09Å; H133-E136 WeakPolarHBondContact O-CB 3.36Å; H133-E136 PolarHBondContact O-N 2.99Å; H133-C137 PolarHBondContact O-N 3.2Å
134	A	86.2	Confident	91.7	Very high	37 Å²	37	99.4 Å²	99.4	31%	0.306	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-25.9	-175.6	0	0	0	0	0	113.8	E130 A131 E136 M138	E130-A134 PolarHBondContact O-N 3.45Å; A131-A134 WeakPolarHBondContact O-CB 3.36Å; A131-A134 PolarHBondContact O-N 3.33Å; A134-E136 PolarHBondContact O-N 3.26Å; A134-M138 HydrophobicContact CB-SD 3.88Å
135	N	89.1	Confident	91.3	Very high	138 Å²	138	96.2 Å²	96.2	74%	0.738	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-23.4	174	61.5	-51.1	0	0	0	113.5	H133	H133-N135 PolarHBondContact O-N 3.24Å; H133-N135 VanDerWaalsContact O-N 3.09Å
136	E	87.8	Confident	90.7	Very high	150 Å²	150	94.6 Å²	94.6	70%	0.701	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-44.6	179	-61.5	179.8	-168.3	0	0	111.6	H133 A134	H133-E136 WeakPolarHBondContact O-CB 3.36Å; H133-E136 PolarHBondContact O-N 2.99Å; A134-E136 PolarHBondContact O-N 3.26Å
137	C	83.9	Confident	89.7	Confident	57 Å²	57	95 Å²	95	39%	0.385	49%	0.49	S	S	.	.			trans	-147	120.9	-178.1	-174.1	0	0	0	0	111.4	H133	H133-C137 PolarHBondContact O-N 3.2Å
138	M	86.6	Confident	88.7	Confident	148 Å²	148	96.2 Å²	96.2	73%	0.729	50%	0.497	S	S	*	.	S	Bend	trans	-88.8	-14.3	177.9	-71.4	-65	-63.5	0	0	113.6	A134	A134-M138 HydrophobicContact CB-SD 3.88Å
139	T	88.6	Confident	87.6	Confident	103 Å²	103	95 Å²	95	63%	0.632	51%	0.509	S	S	*	.	S	Bend	trans	-130.5	69.8	-171.6	52	0	0	0	0	111.5	K141	T139-K141 PolarHBondContact O-N 3.3Å
140	P	92	Very high	86.7	Confident	29 Å²	29	95.7 Å²	95.7	19%	0.188	52%	0.517	C	S	.	.			trans	-60.8	136.3	179.1	26.4	-35.6	0	0	0	111.3	L127 E130	L127-P140 HydrophobicContact CD2-CB 4.37Å; L127-P140 HydrophobicContact CD2-CG 3.42Å; L127-P140 VanDerWaalsContact CD2-CG 3.42Å; E130-P140 HydrophobicContact CB-CB 4.14Å; E130-P140 HydrophobicContact CB-CG 4.1Å; E130-P140 HydrophobicContact CG-CB 3.92Å; E130-P140 HydrophobicContact CG-CG 4.35Å
141	K	93.2	Very high	85.9	Confident	96 Å²	96	97.7 Å²	97.7	42%	0.417	53%	0.53	S	S	.	.			trans	-129	144.7	177.5	-60.6	-179.8	176.8	-174.4	0	110.9	P69 A71 T139	P69-K141 HydrophobicContact CB-CG 4.19Å; P69-K141 HydrophobicContact CG-CB 4.45Å; P69-K141 HydrophobicContact CG-CG 4.17Å; A71-K141 HydrophobicContact CB-CB 4.07Å; T139-K141 PolarHBondContact O-N 3.3Å
142	L	94.2	Very high	85.3	Confident	41 Å²	41	101.1 Å²	101.1	22%	0.215	53%	0.53	C	S	.	.	B	Isolated β-bridge	trans	-87.8	119.9	179.1	-174.1	70.3	0	0	0	110.3	I68 P69 A71 W79 W123 F145	I68-L142 HydrophobicContact CG2-CB 3.61Å; I68-L142 HydrophobicContact CG2-CD2 3.83Å; I68-L142 HydrophobicContact CG2-CG 4.36Å; P69-L142 PolarHBondContact O-N 3.49Å; A71-L142 PolarHBondContact N-O 2.9Å; W79-L142 WeakPolarHBondContact CZ2-O 3.36Å; W79-L142 PolarHBondContact NE1-O 3.1Å; W123-L142 HydrophobicContact CH2-CB 4.2Å; W123-L142 HydrophobicContact CZ3-CB 3.96Å; W123-L142 HydrophobicContact CZ3-CD1 4.3Å; L142-F145 HydrophobicContact CD2-CB 4.43Å; L142-F145 HydrophobicContact CD2-CD2 3.66Å; L142-F145 HydrophobicContact CD2-CE2 4.43Å
143	R	92.5	Very high	84.9	Confident	172 Å²	172	98.5 Å²	98.5	65%	0.649	52%	0.522	S	S	*	.			trans	-80.4	-40	179.5	-167.6	179.2	-177.5	-166.2	0.7	113.4	A71	A71-R143 HydrophobicContact CB-CB 3.86Å; A71-R143 HydrophobicContact CB-CG 4.15Å
144	R	92.1	Very high	84.7	Confident	137 Å²	137	98.8 Å²	98.8	52%	0.517	53%	0.532	S	S	.	.			trans	-141.6	140.6	-175.8	-61.4	-179.9	79.8	170.7	0.5	111	P40 E41	P40-R144 PolarHBondContact O-NE 3.27Å; P40-R144 PolarHBondContact O-NH2 3.11Å; E41-R144 CarbonylContact O-C 3.43Å; E41-R144 VanDerWaalsContact O-CA 3.26Å; E41-R144 WeakPolarHBondContact O-CA 3.45Å; E41-R144 WeakPolarHBondContact O-CB 3.24Å
145	F	87	Confident	84.7	Confident	74 Å²	74	105 Å²	105	33%	0.325	55%	0.548	S	S	.	.			trans	-111.6	63.4	173.2	-157.2	-77	0	0	0	108.6	E41 N42 I68 W79 N119 L142	E41-F145 PolarHBondContact O-N 2.94Å; N42-F145 WeakPolarHBondContact CA-O 3.47Å; N42-F145 HydrophobicContact CB-CB 4.11Å; N42-F145 WeakPolarHBondContact CB-O 3.39Å; I68-F145 HydrophobicContact CD1-CE2 4.39Å; W79-F145 HydrophobicContact CD2-CB 4.49Å; W79-F145 HydrophobicContact CE3-CB 4.16Å; W79-F145 HydrophobicContact CH2-CB 4.22Å; W79-F145 HydrophobicContact CZ3-CB 4.03Å; N119-F145 HydrophobicContact CB-CZ 4.25Å; L142-F145 HydrophobicContact CD2-CB 4.43Å; L142-F145 HydrophobicContact CD2-CD2 3.66Å; L142-F145 HydrophobicContact CD2-CE2 4.43Å
146	A	84.4	Confident	84.5	Confident	46 Å²	46	100 Å²	100	38%	0.38	53%	0.525	S	S	.	.			trans	-128.1	126.9	-175.2	0	0	0	0	0	110.5	L43	L43-A146 HydrophobicContact CD1-CB 3.96Å; L43-A146 HydrophobicContact CG-CB 3.98Å
147	G	74.3	Confident	84.4	Confident	67 Å²	67	101 Å²	101	69%	0.691	52%	0.523	S	S	*	.			trans	-101.6	142.8	168.5	0	0	0	0	0	110.5
148	D	73.9	Confident	84.7	Confident	92 Å²	92	103.1 Å²	103.1	49%	0.492	53%	0.529	S	S	.	.			trans	-105.2	93.7	171.5	-167.7	-23.3	0	0	0	110.1	K150 N151	D148-K150 PolarHBondContact O-N 2.5Å; D148-K150 PolarHBondContact OD1-N 3.14Å; D148-N151 HydrophobicContact CB-CB 4.37Å; D148-N151 PolarHBondContact OD1-N 2.82Å; D148-N151 WeakPolarHBondContact OD2-CB 3.37Å; D148-N151 PolarHBondContact OD2-ND2 2.88Å
149	A	72.2	Confident	84.6	Confident	96 Å²	96	101.6 Å²	101.6	79%	0.793	52%	0.515	S	S	*	.	S	Bend	trans	-71.5	-17.6	179.2	0	0	0	0	0	113.2
150	K	75.2	Confident	84.4	Confident	172 Å²	172	103.8 Å²	103.8	75%	0.748	51%	0.512	S	S	*	.	S	Bend	trans	-86.3	-34.4	-177.8	-64.7	-179	-179	177.7	0	110.9	D148 Y152	D148-K150 PolarHBondContact O-N 2.5Å; D148-K150 PolarHBondContact OD1-N 3.14Å; K150-Y152 PolarHBondContact O-N 3.47Å
151	N	77.1	Confident	84	Confident	118 Å²	118	106.7 Å²	106.7	63%	0.631	54%	0.538	S	S	*	.	S	Bend	trans	-92.1	96.1	179.4	-72	-44.6	0	0	0	112	D148 S153	D148-N151 HydrophobicContact CB-CB 4.37Å; D148-N151 PolarHBondContact OD1-N 2.82Å; D148-N151 WeakPolarHBondContact OD2-CB 3.37Å; D148-N151 PolarHBondContact OD2-ND2 2.88Å; N151-S153 PolarHBondContact O-N 2.85Å
152	Y	79.4	Confident	83.6	Confident	136 Å²	136	107.8 Å²	107.8	53%	0.533	55%	0.546	S	S	.	.			trans	-57.9	133	170.2	-67.7	-75.3	0	0	0	111.3	K150 A156	K150-Y152 PolarHBondContact O-N 3.47Å; Y152-A156 HydrophobicContact CD1-CB 4.08Å; Y152-A156 HydrophobicContact CG-CB 4.49Å
153	S	83.9	Confident	82.6	Confident	66 Å²	66	108.4 Å²	108.4	46%	0.462	56%	0.562	S	S	.	*			trans	-54.8	151.5	171.7	69.4	0	0	0	0	110.9	N151 R155 A156 R157	N151-S153 PolarHBondContact O-N 2.85Å; S153-R155 PolarHBondContact O-N 3.44Å; S153-R155 VanDerWaalsContact O-N 3.09Å; S153-A156 WeakPolarHBondContact O-CA 3.04Å; S153-A156 WeakPolarHBondContact O-CB 3.47Å; S153-A156 PolarHBondContact O-N 3.48Å; S153-A156 WeakPolarHBondContact OG-CB 3.47Å; S153-A156 PolarHBondContact OG-N 3.18Å; S153-A156 VanDerWaalsContact OG-N 3.17Å; S153-R157 PolarHBondContact O-N 2.66Å
154	P	85.5	Confident	81.3	Confident	99 Å²	99	103.2 Å²	103.2	64%	0.643	55%	0.55	S	S	*	*	H	α-helix	trans	-49.8	-39.5	176.1	-29.1	35.3	0	0	0	112.6	R157 I158	P154-R157 WeakPolarHBondContact O-CB 3.29Å; P154-R157 PolarHBondContact O-N 3.3Å; P154-I158 WeakPolarHBondContact O-CG1 3.15Å; P154-I158 PolarHBondContact O-N 2.88Å
155	R	85.7	Confident	79.7	Confident	168 Å²	168	102.3 Å²	102.3	63%	0.634	55%	0.551	S	S	*	*	H	α-helix	trans	-62.3	-43.8	174.2	-175.8	173.9	177	79	-12.4	112.9	S153 R157 I158 R159	S153-R155 PolarHBondContact O-N 3.44Å; S153-R155 VanDerWaalsContact O-N 3.09Å; R155-R157 VanDerWaalsContact C-N 3.35Å; R155-I158 PolarHBondContact O-N 3.19Å; R155-R159 WeakPolarHBondContact O-CG 3.49Å; R155-R159 PolarHBondContact O-N 3.04Å
156	A	86	Confident	77.8	Confident	32 Å²	32	105.3 Å²	105.3	26%	0.264	57%	0.565	S	S	.	*	H	α-helix	trans	-65.2	-38.3	175.9	0	0	0	0	0	111.9	Y152 S153 R159 R160	Y152-A156 HydrophobicContact CD1-CB 4.08Å; Y152-A156 HydrophobicContact CG-CB 4.49Å; S153-A156 WeakPolarHBondContact O-CA 3.04Å; S153-A156 WeakPolarHBondContact O-CB 3.47Å; S153-A156 PolarHBondContact O-N 3.48Å; S153-A156 WeakPolarHBondContact OG-CB 3.47Å; S153-A156 PolarHBondContact OG-N 3.18Å; S153-A156 VanDerWaalsContact OG-N 3.17Å; A156-R159 PolarHBondContact O-N 3.28Å; A156-R160 WeakPolarHBondContact O-CB 3.43Å; A156-R160 PolarHBondContact O-N 2.91Å
157	R	85.9	Confident	75.9	Confident	171 Å²	171	105.6 Å²	105.6	65%	0.645	57%	0.567	S	S	*	*	H	α-helix	trans	-61.6	-45.5	174	-66.3	173.4	62.5	-177.2	-0.8	111.9	S153 P154 R155 R160 A161	S153-R157 PolarHBondContact O-N 2.66Å; P154-R157 WeakPolarHBondContact O-CB 3.29Å; P154-R157 PolarHBondContact O-N 3.3Å; R155-R157 VanDerWaalsContact C-N 3.35Å; R157-R160 PolarHBondContact O-N 3.43Å; R157-A161 WeakPolarHBondContact O-CB 3.22Å; R157-A161 PolarHBondContact O-N 3.38Å
158	I	88.8	Confident	74.8	Confident	102 Å²	102	111.2 Å²	111.2	52%	0.523	57%	0.569	S	S	.	*	H	α-helix	trans	-63.3	-45.9	177.2	-66.6	164.7	0	0	0	110.7	P154 R155 R160 A161 M162	P154-I158 WeakPolarHBondContact O-CG1 3.15Å; P154-I158 PolarHBondContact O-N 2.88Å; R155-I158 PolarHBondContact O-N 3.19Å; I158-R160 VanDerWaalsContact C-N 3.32Å; I158-R160 PolarHBondContact O-N 2.85Å; I158-A161 PolarHBondContact O-N 2.92Å; I158-M162 HydrophobicContact CG2-CE 3.9Å; I158-M162 HydrophobicContact CG2-CG 4.4Å; I158-M162 HydrophobicContact CG2-SD 4.1Å; I158-M162 WeakPolarHBondContact O-CG 3.39Å; I158-M162 PolarHBondContact O-N 2.97Å
159	R	85.5	Confident	73.7	Confident	117 Å²	117	112.9 Å²	112.9	44%	0.442	58%	0.577	S	S	.	*	H	α-helix	trans	-60.2	-40.6	176.2	-74	-173.1	-161.8	-86.7	18.2	113.1	R155 A156 M162 G163 T164	R155-R159 WeakPolarHBondContact O-CG 3.49Å; R155-R159 PolarHBondContact O-N 3.04Å; A156-R159 PolarHBondContact O-N 3.28Å; R159-M162 HydrophobicContact CG-CE 4.38Å; R159-M162 PolarHBondContact O-N 2.89Å; R159-G163 PolarHBondContact O-N 2.91Å; R159-T164 PolarHBondContact O-N 2.83Å; R159-T164 PolarHBondContact O-OG1 2.76Å
160	R	82.8	Confident	72.5	Confident	149 Å²	149	115 Å²	115	56%	0.562	57%	0.574	S	S	*	*	H	α-helix	trans	-63.4	-44.6	174.8	-178.7	175	180	-155.2	-1.4	111.2	A156 R157 I158 M162 G163	A156-R160 WeakPolarHBondContact O-CB 3.43Å; A156-R160 PolarHBondContact O-N 2.91Å; R157-R160 PolarHBondContact O-N 3.43Å; I158-R160 VanDerWaalsContact C-N 3.32Å; I158-R160 PolarHBondContact O-N 2.85Å; R160-M162 VanDerWaalsContact C-N 3.33Å; R160-M162 PolarHBondContact O-N 3.16Å; R160-G163 PolarHBondContact O-N 3.31Å; R160-G163 VanDerWaalsContact O-N 3.11Å
161	A	83.8	Confident	71	Confident	89 Å²	89	117 Å²	117	74%	0.736	58%	0.577	S	S	*	*	H	α-helix	trans	-63	-37	176.7	0	0	0	0	0	112.6	R157 I158 G163	R157-A161 WeakPolarHBondContact O-CB 3.22Å; R157-A161 PolarHBondContact O-N 3.38Å; I158-A161 PolarHBondContact O-N 2.92Å; A161-G163 PolarHBondContact O-N 3.44Å
162	M	85.8	Confident	69.3	Low	120 Å²	120	116.3 Å²	116.3	59%	0.591	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	6.5	174.8	-64.9	-174.9	-53.3	0	0	113.9	I158 R159 R160 T164	I158-M162 HydrophobicContact CG2-CE 3.9Å; I158-M162 HydrophobicContact CG2-CG 4.4Å; I158-M162 HydrophobicContact CG2-SD 4.1Å; I158-M162 WeakPolarHBondContact O-CG 3.39Å; I158-M162 PolarHBondContact O-N 2.97Å; R159-M162 HydrophobicContact CG-CE 4.38Å; R159-M162 PolarHBondContact O-N 2.89Å; R160-M162 VanDerWaalsContact C-N 3.33Å; R160-M162 PolarHBondContact O-N 3.16Å; M162-T164 HydrophobicContact CB-CG2 4.37Å; M162-T164 PolarHBondContact O-N 3.4Å; M162-T164 VanDerWaalsContact O-N 3.11Å
163	G	72.8	Confident	67.5	Low	53 Å²	53	112.7 Å²	112.7	55%	0.546	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	70.6	5.7	176.7	0	0	0	0	0	115.2	R159 R160 A161 Q165	R159-G163 PolarHBondContact O-N 2.91Å; R160-G163 PolarHBondContact O-N 3.31Å; R160-G163 VanDerWaalsContact O-N 3.11Å; A161-G163 PolarHBondContact O-N 3.44Å; G163-Q165 PolarHBondContact O-N 3.09Å
164	T	65.3	Low	65.4	Low	64 Å²	64	119.4 Å²	119.4	39%	0.393	59%	0.593	S	S	.	*	H	α-helix	trans	-72.5	4.5	-176.2	57.2	0	0	0	0	114.5	R159 M162 F166	R159-T164 PolarHBondContact O-N 2.83Å; R159-T164 PolarHBondContact O-OG1 2.76Å; M162-T164 HydrophobicContact CB-CG2 4.37Å; M162-T164 PolarHBondContact O-N 3.4Å; M162-T164 VanDerWaalsContact O-N 3.11Å; T164-F166 VanDerWaalsContact C-N 3.34Å; T164-F166 PolarHBondContact O-N 3.32Å
165	Q	58.2	Low	63	Low	117 Å²	117	123.2 Å²	123.2	55%	0.547	61%	0.608	S	S	.	*	H	α-helix	trans	-70.8	-25.7	-178.3	-167.9	174.3	-41.6	0	0	113.3	G163	G163-Q165 PolarHBondContact O-N 3.09Å
166	F	48	Very low	60.7	Low	137 Å²	137	125 Å²	125	60%	0.601	64%	0.636	S	S	*	*	H	α-helix	trans	-107.5	-17.5	178.5	-88.9	-82.4	0	0	0	114.5	T164 Y168 I169 L170	T164-F166 VanDerWaalsContact C-N 3.34Å; T164-F166 PolarHBondContact O-N 3.32Å; F166-Y168 PolarHBondContact O-N 3.39Å; F166-I169 PolarHBondContact O-N 3.41Å; F166-L170 PolarHBondContact O-N 3.49Å; F166-L170 VanDerWaalsContact O-N 3.08Å
167	A	44.4	Very low	59.4	Low	53 Å²	53	129.6 Å²	129.6	44%	0.438	66%	0.655	S	S	.	*	H	α-helix	trans	-64.6	-25.6	-177.7	0	0	0	0	0	113.1	R171	A167-R171 WeakPolarHBondContact O-CB 3.1Å; A167-R171 PolarHBondContact O-N 3.4Å
168	Y	50	Low	58.1	Low	184 Å²	184	127.4 Å²	127.4	72%	0.722	66%	0.656	S	S	*	*	H	α-helix	trans	-75.2	-34.6	178.4	-135.1	-93.1	0	0	0	113	F166	F166-Y168 PolarHBondContact O-N 3.39Å
169	I	51	Low	56.3	Low	128 Å²	128	128.8 Å²	128.8	66%	0.656	66%	0.663	S	S	*	*	H	α-helix	trans	-73.6	-35.3	173.9	-61.5	177.9	0	0	0	110.1	F166	F166-I169 PolarHBondContact O-N 3.41Å
170	L	47	Very low	54.6	Low	139 Å²	139	129.5 Å²	129.5	73%	0.728	68%	0.676	S	S	*	*	H	α-helix	trans	-77.7	-21.8	177.2	-67.4	174.2	0	0	0	114	F166	F166-L170 PolarHBondContact O-N 3.49Å; F166-L170 VanDerWaalsContact O-N 3.08Å
171	R	44.7	Very low	52.9	Low	216 Å²	216	128.3 Å²	128.3	82%	0.815	68%	0.683	S	S	*	*	H	α-helix	trans	-88.4	-22.3	-176.9	-161.1	172.2	-170.3	-150.8	1.5	114.2	A167	A167-R171 WeakPolarHBondContact O-CB 3.1Å; A167-R171 PolarHBondContact O-N 3.4Å
172	N	41.7	Very low	50.8	Low	103 Å²	103	130.9 Å²	130.9	55%	0.551	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	43.7	176.3	-65.6	-15.2	0	0	0	111.4	Y174	N172-Y174 PolarHBondContact O-N 3.47Å
173	G	40.6	Very low	48.3	Very low	60 Å²	60	131.7 Å²	131.7	62%	0.619	69%	0.686	S	S	*	*			trans	-64	83.1	164.4	0	0	0	0	0	110.6
174	Y	40	Very low	46.4	Very low	206 Å²	206	137.8 Å²	137.8	81%	0.808	70%	0.697	S	S	*	*			trans	-108.9	94.1	153.2	-71	-80.7	0	0	0	106.7	N172	N172-Y174 PolarHBondContact O-N 3.47Å
175	L	34.5	Very low	44.8	Very low	180 Å²	180	143.9 Å²	143.9	94%	0.942	72%	0.722	S	S	*	*			trans	-91.7	86	153.6	-72	171.6	0	0	0	106.2
176	V	38.2	Very low	43.6	Very low	204 Å²	204	146.4 Å²	146.4	100%	1.236	74%	0.738	S	S	*	*			trans	-138.2	0	151.5	-177.6	0	0	0	0	106.4

Retrieved 176 of 176 residues in 93.6 ms (Link to these results)

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